*HEADER    TRANSLATION                             20-AUG-01   1JT8              
*TITLE     ARCHAEAL INITIATION FACTOR-1A, AIF-1A                                 
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROBABLE TRANSLATION INITIATION FACTOR 1A;                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: EIF-1A;                                                     
*COMPND   5 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                                   
*KEYWDS    BETA BARREL, TRANSLATION FACTOR                                       
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    D.W.HOFFMAN, W.LI                                                     
*REVDAT   1   05-SEP-01 1JT8    0                                                


{ distance constraints for aif1a }

{ E3 HN 8.57 }

assign (resid 3 and name hn ) (resid 3 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 3 and name hn ) (resid 3 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 3 and name hn ) (resid 3 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 3 and name hn ) (resid 3 and name hg* )  2.0 1.0 3.0 { w }

{ Q4 HN 8.25 }

assign (resid 4 and name hn ) (resid 4 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 4 and name hn ) (resid 4 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 4 and name hn ) (resid 4 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 4 and name hn ) (resid 4 and name hg* )  2.0 1.0 3.0 { w }

{ Q5 HN 8.46 }

{ Q6 HN 8.51 }

assign (resid 6 and name hn ) (resid 6 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 6 and name hn ) (resid 6 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 6 and name hn ) (resid 6 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 6 and name hn ) (resid 6 and name hg* )  2.0 1.0 3.0 { w }
assign (resid 6 and name hn ) (resid 5 and name ha )  2.0 1.0 2.0 { m }
assign (resid 6 and name hn ) (resid 5 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 6 and name hn ) (resid 5 and name hb2 )  2.0 1.0 3.0 { w }

{ E7 HN 8.54 }

assign (resid 7 and name hn ) (resid 7 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 7 and name hn ) (resid 7 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 7 and name hn ) (resid 7 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 7 and name hn ) (resid 7 and name hg* )  2.0 1.0 3.0 { w }
assign (resid 7 and name hn ) (resid 6 and name ha )  2.0 1.0 2.0 { m }
assign (resid 7 and name hn ) (resid 6 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 7 and name hn ) (resid 6 and name hb2 )  2.0 1.0 3.0 { w }

{ Q8 HN 8.40 }

assign (resid 8 and name hn ) (resid 8 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 8 and name hn ) (resid 8 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 8 and name hn ) (resid 8 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 8 and name hn ) (resid 8 and name hg* )  2.0 1.0 3.0 { w }
assign (resid 8 and name hn ) (resid 7 and name ha )  2.0 1.0 2.0 { m }
assign (resid 8 and name hn ) (resid 7 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 8 and name hn ) (resid 7 and name hb2 )  2.0 1.0 3.0 { w }

{ Q9 HN 8.38 }

assign (resid 9 and name hn ) (resid 9 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 9 and name hn ) (resid 9 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 9 and name hn ) (resid 9 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 9 and name hn ) (resid 9 and name hg* )  2.0 1.0 3.0 { w }
assign (resid 9 and name hn ) (resid 8 and name ha )  2.0 1.0 2.0 { m }
assign (resid 9 and name hn ) (resid 8 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 9 and name hn ) (resid 8 and name hb2 )  2.0 1.0 3.0 { w }
assign (resid 9 and name he21) (resid 9 and name he22 )  2.0 1.0 1.0 { s }
assign (resid 9 and name he2*) (resid 9 and name hg1 )  2.0 1.0 3.0 { w }
assign (resid 9 and name he21) (resid 9 and name hg2 )  2.0 1.0 3.0 { w }

{ I10 HN 7.91 }

assign (resid 10 and name hn ) (resid 9 and name ha )   2.0 1.0 1.0 { s }
assign (resid 10 and name hn ) (resid 10 and name ha )  2.0 1.0 2.0 { m }
assign (resid 10 and name hn ) (resid 10 and name hb )  2.0 1.0 2.0 { m }
assign (resid 10 and name hn ) (resid 10 and name hg2*) 2.0 1.0 1.0 { s }
assign (resid 10 and name hn ) (resid 9 and name hg*)   2.0 1.0 3.0 { w }
assign (resid 10 and name hn ) (resid 9 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 10 and name hn ) (resid 9 and name hb2)   2.0 1.0 2.0 { m }

{ R11 HN 8.17 }

assign (resid 11 and name hn ) (resid 10 and name ha )  2.0 1.0 2.0 { m }
assign (resid 11 and name hn ) (resid 10 and name hg2*) 2.0 1.0 3.0 { w }
assign (resid 11 and name hn ) (resid 10 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 11 and name hn ) (resid 10 and name hb2 ) 2.0 1.0 2.0 { m }

{ V12 HN 7.50 }

assign (resid 12 and name hn ) (resid 11 and name ha  ) 2.0 1.0 1.0 { s }
assign (resid 12 and name hn ) (resid 12 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 12 and name hn ) (resid 11 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 12 and name hn ) (resid 11 and name hb2 ) 2.0 1.0 2.0 { m }
assign (resid 12 and name hn ) (resid 12 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 12 and name hn ) (resid 12 and name hg1*) 2.0 1.0 2.0 { m }
assign (resid 12 and name ha ) (resid 12 and name hg2*) 2.0 1.0 2.0 { m }
assign (resid 12 and name ha ) (resid 12 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 12 and name ha ) (resid 12 and name hg1*) 2.0 1.0 2.0 { m }
assign (resid 12 and name ha ) (resid 12 and name hg2*) 2.0 1.0 2.0 { m }

{ R13 HN 7.93 }

assign (resid 13 and name hn ) (resid 12 and name ha  ) 2.0 1.0 1.0 { s }
assign (resid 13 and name hn ) (resid 13 and name hb* ) 2.0 1.0 2.0 { m }
assign (resid 13 and name hn ) (resid 13 and name hg* ) 2.0 1.0 3.0 { w }
assign (resid 13 and name hn ) (resid 12 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 13 and name hn ) (resid 12 and name hg1*) 2.0 1.0 2.0 { m }
assign (resid 13 and name hn ) (resid 12 and name hg2*) 2.0 1.0 2.0 { m }

{ I14 }

assign (resid 14 and name hn ) (resid 14 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 14 and name hn ) (resid 14 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 14 and name hn ) (resid 14 and name hg2*) 2.0 1.0 2.0 { m }
assign (resid 14 and name hn ) (resid 13 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 14 and name hn ) (resid 13 and name hb* ) 2.0 1.0 3.0 { w }
assign (resid 14 and name hn ) (resid 13 and name hg* ) 2.0 1.0 3.0 { w }
assign (resid 14 and name ha ) (resid 14 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 14 and name ha ) (resid 14 and name hg2*) 2.0 1.0 2.0 { m }

{ P15}

{ R16 124.9, 9.59 }

assign (resid 16 and name hn ) (resid 16 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 16 and name hn ) (resid 16 and name hb1 ) 2.0 1.0 3.0 { w }
assign (resid 16 and name hn ) (resid 16 and name hb2 ) 2.0 1.0 3.0 { w }
assign (resid 16 and name ha ) (resid 16 and name hb1 ) 2.0 1.0 3.0 { w }
assign (resid 16 and name ha ) (resid 16 and name hb2 ) 2.0 1.0 3.0 { w }

{ K17  HN  8.12 }

assign (resid 17 and name hn ) (resid 18 and name hn  ) 2.0 1.0 1.0 { s }
assign (resid 17 and name hn ) (resid 17 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 17 and name hn ) (resid 17 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 17 and name hn ) (resid 17 and name hb1 ) 2.0 1.0 3.0 { w }
assign (resid 17 and name hn ) (resid 17 and name hb2 ) 2.0 1.0 3.0 { w }

{ E18  HN  10.16 }

assign (resid 18 and name hn ) (resid 18 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 18 and name hn ) (resid 18 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 18 and name hn ) (resid 18 and name hb2 ) 2.0 1.0 2.0 { m }
assign (resid 18 and name hn ) (resid 17 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 18 and name hn ) (resid 17 and name hb1 ) 2.0 1.0 3.0 { w }
assign (resid 18 and name hn ) (resid 17 and name hb2 ) 2.0 1.0 3.0 { w }
assign (resid 18 and name ha ) (resid 18 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 18 and name ha ) (resid 18 and name hb2 ) 2.0 1.0 2.0 { m }

{ E19  HN 7.24 }

assign (resid 19 and name hn ) (resid 19 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 19 and name hn ) (resid 19 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 19 and name hn ) (resid 19 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 19 and name hn ) (resid 19 and name hg1  ) 2.0 1.0 3.0 { w }
assign (resid 19 and name hn ) (resid 19 and name hg2  ) 2.0 1.0 3.0 { w }
assign (resid 19 and name hn ) (resid 18 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 19 and name hn ) (resid 18 and name hb1  ) 2.0 1.0 3.0 { w }
assign (resid 19 and name hn ) (resid 18 and name hb2  ) 2.0 1.0 3.0 { w }
assign (resid 19 and name ha ) (resid 19 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 19 and name ha ) (resid 19 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 19 and name ha ) (resid 19 and name hg1  ) 2.0 1.0 3.0 { w }
assign (resid 19 and name ha ) (resid 19 and name hg2  ) 2.0 1.0 3.0 { w }

{ N20  HN 8.10 }

assign (resid 20 and name hn ) (resid 20 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 20 and name hn ) (resid 20 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 20 and name hn ) (resid 20 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 20 and name ha ) (resid 20 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 20 and name ha ) (resid 20 and name hb2  ) 2.0 1.0 2.0 { m }

{ E21  HN 6.76 }

assign (resid 21 and name hn ) (resid 21 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 21 and name hn ) (resid 20 and name ha  ) 2.0 1.0 2.0 { m }

{ I22 HN 8.86 }

assign (resid 22 and name hn ) (resid 22 and name ha )   2.0 1.0 4.0 {448 vw}
assign (resid 22 and name hn ) (resid 22 and name hb )   2.0 1.0 3.0 {144 w }
assign (resid 22 and name hn ) (resid 22 and name hg2*)  2.0 1.0 2.0 {186 m }
assign (resid 22 and name hn ) (resid 23 and name hn )   2.0 1.0 4.0 {848 vw}
assign (resid 22 and name hn ) (resid 22 and name hg1*)  2.0 1.0 4.0 {101 vw}
assign (resid 22 and name hn ) (resid 22 and name hd1*)  2.0 1.0 4.0 {077 vw}
assign (resid 22 and name hn ) (resid 68 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 22 and name hn ) (resid 67 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 22 and name ha ) (resid 22 and name hb )   2.0 1.0 3.0 {144 w }
assign (resid 22 and name ha ) (resid 22 and name hg2*)  2.0 1.0 2.0 {186 m }
assign (resid 22 and name ha ) (resid 22 and name hg1*)  2.0 1.0 4.0 {101 vw}
assign (resid 22 and name ha ) (resid 22 and name hd1*)  2.0 1.0 4.0 {077 vw}

{ L23 HN 8.48 }

assign (resid 23 and name hn ) (resid 22 and name ha )   2.0 1.0 2.0 {448 m }
assign (resid 23 and name hn ) (resid 22 and name hb )   2.0 1.0 4.0 {144 w }
assign (resid 23 and name hn ) (resid 22 and name hg2*)  2.0 1.0 2.0 {186 m }
assign (resid 23 and name hn ) (resid 22 and name hg1*)  2.0 1.0 4.0 {101 vw}
assign (resid 23 and name hn ) (resid 22 and name hd1*)  2.0 1.0 4.0 {077 vw}
assign (resid 23 and name hn ) (resid 23 and name hg )   2.0 1.0 4.0 {184 vw}
assign (resid 23 and name hn ) (resid 23 and name hd**)  2.0 1.0 4.0 {144 vw}
assign (resid 23 and name hn ) (resid 23 and name hb* )  2.0 1.0 4.0 {100 vw}
assign (resid 23 and name hn ) (resid 23 and name hb* )  2.0 1.0 4.0 {080 vw}
assign (resid 23 and name hn ) (resid 40 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 23 and name ha ) (resid 67 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 23 and name ha ) (resid 66 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 23 and name ha ) (resid 89 and name ha  )  2.0 1.0 4.0 { vw }
assign (resid 23 and name ha ) (resid 23 and name hg )   2.0 1.0 4.0 {184 vw}
assign (resid 23 and name ha ) (resid 23 and name hd**)  2.0 1.0 4.0 {144 vw}
assign (resid 23 and name ha ) (resid 23 and name hb* )  2.0 1.0 4.0 {100 vw}
assign (resid 23 and name ha ) (resid 23 and name hb* )  2.0 1.0 4.0 {080 vw}

{ G24 HN 8.90 }

assign (resid 24 and name hn ) (resid 23 and name ha )   2.0 1.0 1.0 {516 s }
assign (resid 24 and name hn ) (resid 23 and name hd**)  2.0 1.0 4.0 {148 vw}
assign (resid 24 and name hn ) (resid 23 and name hg )   2.0 1.0 4.0 {188 vw}
assign (resid 24 and name hn ) (resid 23 and name hb*)   2.0 1.0 4.0 {100 vw}
assign (resid 24 and name hn ) (resid 23 and name hb*)   2.0 1.0 4.0 {080 vw}
assign (resid 24 and name hn ) (resid 23 and name hd**)  2.0 1.0 4.0 {052 vw}
assign (resid 24 and name hn ) (resid 66 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 24 and name hn ) (resid 65 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 24 and name ha1 ) (resid 39 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 24 and name ha2 ) (resid 39 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 24 and name ha1 ) (resid 24 and name ha2 )  2.0 1.0 1.0 { s }

{ I25 HN 8.89 }

assign (resid 25 and name hn ) (resid 24 and name ha1)   2.0 1.0 2.0 {497 m }
assign (resid 25 and name hn ) (resid 24 and name ha2)   2.0 1.0 2.0 {342 m }
assign (resid 25 and name hn ) (resid 39 and name ha )   2.0 1.0 3.0 {536 w }
assign (resid 25 and name hn ) (resid 25 and name hb  )  2.0 1.0 2.0 {158 m }
assign (resid 25 and name hn ) (resid 25 and name hg2*)  2.0 1.0 4.0 {090 vw}
assign (resid 25 and name hn ) (resid 25 and name hg1*)  2.0 1.0 4.0 {083 vw}
assign (resid 25 and name hn ) (resid 25 and name hd1*)  2.0 1.0 4.0 {058 vw}
assign (resid 25 and name hn ) (resid 38 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 25 and name ha ) (resid 64 and name ha  )  2.0 1.0 1.0  { s }
assign (resid 25 and name ha ) (resid 65 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 25 and name ha ) (resid 25 and name hb  )  2.0 1.0 2.0 {158 m }
assign (resid 25 and name ha ) (resid 25 and name hg2*)  2.0 1.0 4.0 {090 vw}
assign (resid 25 and name ha ) (resid 25 and name hg1*)  2.0 1.0 4.0 {083 vw}
assign (resid 25 and name ha ) (resid 25 and name hd1*)  2.0 1.0 4.0 {058 vw}
assign (resid 64 and name ha) (resid 25 and name hb)  2.0 1.0 3.0 { w }
assign (resid 25 and name ha) (resid 64 and name hb)  2.0 1.0 3.0 { w }

{ I26 HN 8.98 }

assign (resid 26 and name hn ) (resid 64 and name ha  )  2.0 1.0 2.0 {498 m }
assign (resid 26 and name hn ) (resid 25 and name ha  )  2.0 1.0 1.0 {537 s }
assign (resid 26 and name hn ) (resid 25 and name hb  )  2.0 1.0 3.0 {158 m }
assign (resid 26 and name hn ) (resid 25 and name hg2*)  2.0 1.0 4.0 {090 vw}
assign (resid 26 and name hn ) (resid 25 and name hg1*)  2.0 1.0 4.0 {083 vw}
assign (resid 26 and name hn ) (resid 25 and name hd1*)  2.0 1.0 4.0 {058 vw}
assign (resid 26 and name ha ) (resid 37 and name ha  )  2.0 1.0 1.0  { s }
assign (resid 26 and name hn ) (resid 26 and name ha )   2.0 1.0 2.0 { m}
assign (resid 26 and name hn ) (resid 26 and name hb )   2.0 1.0 2.0 { m }
assign (resid 26 and name hn ) (resid 26 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 26 and name ha ) (resid 26 and name hb )   2.0 1.0 2.0 { m }
assign (resid 26 and name ha ) (resid 26 and name hg2*)  2.0 1.0 2.0 { m }

{ E27 HN 8.97 }

assign (resid 27 and name hn ) (resid 26 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 27 and name hn ) (resid 26 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 27 and name hn ) (resid 26 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 27 and name hn ) (resid 27 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 27 and name hn ) (resid 27 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 27 and name hn ) (resid 27 and name hg1 )  2.0 1.0 3.0 { w }
assign (resid 27 and name hn ) (resid 27 and name hg2 )  2.0 1.0 3.0 { w }
assign (resid 27 and name hn ) (resid 37 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 27 and name hn ) (resid 36 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 27 and name ha ) (resid 27 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 27 and name ha ) (resid 27 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 27 and name ha ) (resid 27 and name hg1 )  2.0 1.0 3.0 { w }
assign (resid 27 and name ha ) (resid 27 and name hg2 )  2.0 1.0 3.0 { w }

{ Q28 HN 7.34 }

assign (resid 28 and name hn ) (resid 28 and name ha )   2.0 1.0 2.0 { m }
assign (resid 28 and name hn ) (resid 28 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 28 and name hn ) (resid 28 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 28 and name hn ) (resid 28 and name hg1)   2.0 1.0 3.0 { w }
assign (resid 28 and name hn ) (resid 28 and name hg2)  2.0 1.0 3.0 { w }
assign (resid 28 and name ha ) (resid 28 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 28 and name ha ) (resid 28 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 28 and name ha ) (resid 28 and name hg1)   2.0 1.0 3.0 { w }
assign (resid 28 and name ha ) (resid 28 and name hg2)  2.0 1.0 3.0 { w }

{ M29 HN 9.45 }

assign (resid 29 and name hn ) (resid 29 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 29 and name hn ) (resid 29 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 29 and name hn ) (resid 29 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 29 and name hn ) (resid 29 and name hg1  ) 2.0 1.0 4.0 { vw }
assign (resid 29 and name hn ) (resid 29 and name hg2  ) 2.0 1.0 4.0 { vw }
assign (resid 29 and name hn ) (resid 28 and name ha  ) 2.0 1.0 2.0 { m }
assign (resid 29 and name hn ) (resid 28 and name hb1  ) 2.0 1.0 3.0 { w }
assign (resid 29 and name hn ) (resid 28 and name hb2  ) 2.0 1.0 3.0 { w }

{ L30 }

assign (resid 30 and name hn ) (resid 30 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 30 and name hn ) (resid 30 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 30 and name hn ) (resid 30 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 30 and name hn ) (resid 30 and name hd1*) 2.0 1.0 3.0 { w }
assign (resid 30 and name hn ) (resid 30 and name hd2*) 2.0 1.0 3.0 { w }
assign (resid 30 and name ha ) (resid 30 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 30 and name ha ) (resid 30 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 30 and name ha ) (resid 30 and name hd1*) 2.0 1.0 3.0 { w }
assign (resid 30 and name ha ) (resid 30 and name hd2*) 2.0 1.0 3.0 { w }

{ G31 }

assign (resid 31 and name hn ) (resid 31 and name ha1 ) 2.0 1.0 2.0 { m }
assign (resid 31 and name hn ) (resid 31 and name ha2 ) 2.0 1.0 2.0 { m }
assign (resid 31 and name ha1) (resid 31 and name ha2 ) 2.0 1.0 2.0 { m }

{ A32 }

{ S33   HN  8.47}

assign (resid 33 and name hn ) (resid 33 and name ha  ) 2.0 1.0 3.0 { w }
assign (resid 33 and name hn ) (resid 33 and name hb1  ) 2.0 1.0 3.0 { w }
assign (resid 33 and name hn ) (resid 33 and name hb2  ) 2.0 1.0 3.0 { w }

{ R34 HN 7.39 }

assign (resid 34 and name hn ) (resid 33 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 34 and name hn ) (resid 33 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 34 and name hn ) (resid 33 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 34 and name hn ) (resid 34 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 34 and name hn ) (resid 34 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 34 and name hn ) (resid 34 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 34 and name hn ) (resid 34 and name hg1 )  2.0 1.0 3.0 { w }
assign (resid 34 and name hn ) (resid 34 and name hg2 )  2.0 1.0 3.0 { w }
assign (resid 34 and name ha ) (resid 49 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 34 and name ha ) (resid 48 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 34 and name ha ) (resid 48 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 34 and name ha ) (resid 48 and name hb2 )  2.0 1.0 3.0 { w }
assign (resid 48 and name ha ) (resid 34 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 48 and name ha ) (resid 34 and name hb2 )  2.0 1.0 3.0 { w }

{ V35 HN 8.64 }

assign (resid 35 and name hn ) (resid 34 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 35 and name hn ) (resid 34 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 35 and name hn ) (resid 34 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 35 and name hn ) (resid 34 and name hg1 )  2.0 1.0 3.0 { w }
assign (resid 35 and name hn ) (resid 34 and name hg2 )  2.0 1.0 3.0 { w }
assign (resid 35 and name hn ) (resid 35 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 35 and name hn ) (resid 35 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 35 and name hn ) (resid 35 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 35 and name hn ) (resid 47 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 35 and name hn ) (resid 48 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 35 and name ha ) (resid 35 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 35 and name ha ) (resid 35 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 35 and name hb ) (resid 35 and name hg1*)  2.0 1.0 1.0 { s }
assign (resid 35 and name hb ) (resid 35 and name hg2*)  2.0 1.0 1.0 { s }

{ R36 HN 8.92 }

assign (resid 36 and name hn ) (resid 35 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 36 and name hn ) (resid 36 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 36 and name hn ) (resid 36 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 36 and name hn ) (resid 36 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 36 and name hn ) (resid 36 and name hg1 )  2.0 1.0 3.0 { w }
assign (resid 36 and name hn ) (resid 36 and name hg2 )  2.0 1.0 3.0 { w }
assign (resid 36 and name ha ) (resid 36 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 36 and name ha ) (resid 36 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 36 and name hn ) (resid 35 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 36 and name hn ) (resid 35 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 36 and name hn ) (resid 35 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 36 and name hn ) (resid 27 and name hn  )  2.0 1.0 2.0 { m }

{ V37 HN 9.36 }

assign (resid 37 and name hn ) (resid 36 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 37 and name hn ) (resid 36 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 36 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 37 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 37 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 37 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 37 and name ha ) (resid 37 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 37 and name ha ) (resid 37 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 37 and name ha ) (resid 37 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 47 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 46 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 37 and name hn ) (resid 45 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 37 and name hg**)(resid 26 and name hb  )  2.0 1.0 4.0 { w }
assign (resid 37 and name ha ) (resid 26 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 26 and name ha) (resid 37 and name hb)  2.0 1.0 3.0
assign (resid 37 and name ha) (resid 26 and name hb)  2.0 1.0 3.0


{ R38 HN 9.06 }

assign (resid 38 and name hn ) (resid 37 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 38 and name hn ) (resid 38 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 38 and name hn ) (resid 38 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 38 and name hn ) (resid 37 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 38 and name hn ) (resid 37 and name hg**)  2.0 1.0 2.0 { m }
assign (resid 38 and name hn ) (resid 37 and name hg**)  2.0 1.0 2.0 { m }
assign (resid 38 and name hn ) (resid 26 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 38 and name hn ) (resid 25 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 38 and name ha ) (resid 44 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 38 and name ha ) (resid 44 and name hb  )  2.0 1.0 3.0 { w }
assign (resid 38 and name ha ) (resid 44 and name hg* )  2.0 1.0 4.0 { w }

{ C39 HN 8.24 }

assign (resid 39 and name hn ) (resid 38 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 39 and name hn ) (resid 38 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 39 and name hn ) (resid 38 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 39 and name hn ) (resid 39 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 39 and name hn ) (resid 39 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 39 and name ha ) (resid 39 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 39 and name ha ) (resid 39 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 39 and name hb1) (resid 39 and name hb2 )  2.0 1.0 1.0 { s }
assign (resid 39 and name hn ) (resid 44 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 39 and name hn ) (resid 43 and name hn  )  2.0 1.0 3.0 { w }

{ L40 HN 8.97 }

assign (resid 40 and name hn ) (resid 39 and name ha  )  2.0 1.0 2.0 {536 m }
assign (resid 40 and name hn ) (resid 40 and name ha  )  2.0 1.0 3.0 {402 w }
assign (resid 40 and name hn ) (resid 40 and name hb1 )  2.0 1.0 2.0 {166 m }
assign (resid 40 and name hn ) (resid 40 and name hb2 )  2.0 1.0 2.0 {184 m }
assign (resid 40 and name hn ) (resid 40 and name hg* )  2.0 1.0 3.0 {106 w }
assign (resid 40 and name hn ) (resid 40 and name hd1*)  2.0 1.0 3.0 {075 w }
assign (resid 40 and name hn ) (resid 40 and name hd2*)  2.0 1.0 3.0 {075 w }
assign (resid 40 and name ha ) (resid 40 and name hb1 )  2.0 1.0 2.0 {166 m }
assign (resid 40 and name ha ) (resid 40 and name hb2 )  2.0 1.0 2.0 {184 m }
assign (resid 40 and name ha ) (resid 40 and name hg* )  2.0 1.0 3.0 {106 w }
assign (resid 40 and name ha ) (resid 40 and name hd1*)  2.0 1.0 3.0 {075 w }
assign (resid 40 and name ha ) (resid 40 and name hd2*)  2.0 1.0 3.0 {075 w }
assign (resid 40 and name hn ) (resid 24 and name ha1 )  2.0 1.0 3.0 { w }
assign (resid 40 and name hn ) (resid 24 and name ha2 )  2.0 1.0 3.0 { w }
assign (resid 40 and name hn ) (resid 23 and name hn  )  2.0 1.0 3.0 { w }

{ D41 HN 7.87 }

assign (resid 41 and name hn ) (resid 40 and name hn  )  2.0 1.0 3.0 {897 w }
assign (resid 41 and name hn ) (resid 42 and name hn  )  2.0 1.0 3.0 {792 w }

{ G42 HN 7.92 }

{assign (resid 42 and name hn ) (resid 40 and name ha  )  2.0 1.0 2.0} {402 w }
assign (resid 42 and name hn ) (resid 40 and name hb1 )  2.0 1.0 3.0 {166 w }
assign (resid 42 and name hn ) (resid 40 and name hb2 )  2.0 1.0 3.0 {184 w }
assign (resid 42 and name hn ) (resid 40 and name hg* )  2.0 1.0 3.0 {106 w }
assign (resid 42 and name hn ) (resid 40 and name hd**)  2.0 1.0 3.0 {075 w }
assign (resid 42 and name hn ) (resid 42 and name ha1 )  2.0 1.0 2.0 {426 m }
assign (resid 42 and name hn ) (resid 42 and name ha2 )  2.0 1.0 2.0 {378 m }
assign (resid 42 and name ha1) (resid 42 and name ha2 )  2.0 1.0 2.0 { m }

{ K43 HN 6.95 }

assign (resid 43 and name hn ) (resid 42 and name hn  )  2.0 1.0 2.0 {792 m }
assign (resid 43 and name hn ) (resid 42 and name ha* )  2.0 1.0 2.0 {378 m }
assign (resid 43 and name hn ) (resid 43 and name hb1 )  2.0 1.0 2.0 {164 m }
assign (resid 43 and name hn ) (resid 43 and name hb2 )  2.0 1.0 2.0 {130 m }
assign (resid 43 and name hn ) (resid 39 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 43 and name hn ) (resid 43 and name hg1 )  2.0 1.0 4.0 { w }
assign (resid 43 and name hn ) (resid 43 and name hg2 )  2.0 1.0 4.0 { w }
assign (resid 43 and name ha ) (resid 43 and name hb1 )  2.0 1.0 2.0 {164 m }
assign (resid 43 and name ha ) (resid 43 and name hb2 )  2.0 1.0 2.0 {130 m }
assign (resid 43 and name ha ) (resid 43 and name hg1 )  2.0 1.0 4.0 { w }
assign (resid 43 and name ha ) (resid 43 and name hg2 )  2.0 1.0 4.0 { w }

{ T44 HN 8.85 }

assign (resid 44 and name hn ) (resid 43 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 44 and name hn ) (resid 43 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 44 and name hn ) (resid 43 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 44 and name hn ) (resid 44 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 44 and name hn ) (resid 44 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 44 and name hn ) (resid 44 and name hg* )  2.0 1.0 2.0 { m }
assign (resid 44 and name hn ) (resid 43 and name hg* )  2.0 1.0 2.0 { m }
assign (resid 44 and name hn ) (resid 76 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 44 and name ha ) (resid 39 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 44 and name ha ) (resid 38 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 44 and name ha ) (resid 44 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 44 and name ha ) (resid 44 and name hg* )  2.0 1.0 2.0 { m }
assign (resid 38 and name ha) (resid 44 and name hb)  2.0 1.0 3.0 { w }
assign (resid 44 and name ha) (resid 38 and name hb1)  2.0 1.0 3.0 { w }
assign (resid 44 and name ha) (resid 38 and name hb2)  2.0 1.0 3.0 { w }

{ R45 HN 8.78 }

assign (resid 45 and name hn ) (resid 44 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 45 and name hn ) (resid 44 and name hg* )  2.0 1.0 2.0 { m }
assign (resid 45 and name hn ) (resid 38 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 45 and name hn ) (resid 37 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 45 and name hn ) (resid 45 and name hb1 )  2.0 1.0 3.0 { w }
assign (resid 45 and name hn ) (resid 45 and name hb2 )  2.0 1.0 3.0 { w }
assign (resid 45 and name ha ) (resid 76 and name hn )  2.0 1.0 2.0 { m }
assign (resid 45 and name ha ) (resid 45 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 45 and name ha ) (resid 45 and name hb2 )  2.0 1.0 2.0 { m }

{ L46 HN 8.38 }

assign (resid 46 and name hn ) (resid 45 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 46 and name hn ) (resid 45 and name hb* )  2.0 1.0 1.0 { m }
assign (resid 46 and name hn ) (resid 46 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 46 and name hn ) (resid 46 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 46 and name hn ) (resid 46 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 46 and name hn ) (resid 46 and name hd1*)  2.0 1.0 3.0 { w }
assign (resid 46 and name hn ) (resid 46 and name hd2*)  2.0 1.0 3.0 { w }
assign (resid 46 and name hn ) (resid 77 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 46 and name hn ) (resid 47 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 46 and name ha ) (resid 37 and name hn )  2.0 1.0 2.0 { m }
assign (resid 46 and name ha ) (resid 36 and name ha )  2.0 1.0 1.0 { s }
assign (resid 46 and name ha ) (resid 46 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 46 and name ha ) (resid 46 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 46 and name ha ) (resid 46 and name hd1*)  2.0 1.0 3.0 { w }
assign (resid 46 and name ha ) (resid 46 and name hd2*)  2.0 1.0 3.0 { w }
assign (resid 36 and name ha) (resid 46 and name hb1)  2.0 1.0 3.0 { w }
assign (resid 36 and name ha) (resid 46 and name hb2)  2.0 1.0 3.0 { w }
assign (resid 46 and name ha) (resid 36 and name hb1)  2.0 1.0 3.0 { w }
assign (resid 46 and name ha) (resid 36 and name hb2)  2.0 1.0 3.0 { w }

{ G47 HN 9.63 }

assign (resid 47 and name hn ) (resid 46 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 47 and name hn ) (resid 47 and name ha2 )  2.0 1.0 2.0 { m }
assign (resid 47 and name hn ) (resid 47 and name ha1 )  2.0 1.0 2.0 { m }
assign (resid 47 and name ha1) (resid 47 and name ha2 )  2.0 1.0 1.0 { s }
assign (resid 47 and name hn ) (resid 46 and name hb* )  2.0 1.0 2.0 { m }
assign (resid 47 and name hn ) (resid 36 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 47 and name hn ) (resid 48 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 47 and name hn ) (resid 37 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 47 and name hn ) (resid 78 and name hn  )  2.0 1.0 3.0 { w }

{ R48 HN 8.22 }

assign (resid 48 and name hn ) (resid 47 and name ha1 )  2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 47 and name ha2 )  2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 48 and name ha )   2.0 1.0 3.0 { w }
assign (resid 48 and name hn ) (resid 48 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 48 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 48 and name hn ) (resid 48 and name hg*)   2.0 1.0 3.0 { w }
assign (resid 48 and name ha ) (resid 48 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 48 and name ha ) (resid 48 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 48 and name ha ) (resid 48 and name hg*)   2.0 1.0 3.0 { w }
assign (resid 48 and name hn ) (resid 79 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 48 and name ha ) (resid 79 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 34 and name ha) (resid 48 and name hb1)  2.0 1.0 3.0
assign (resid 34 and name ha) (resid 48 and name hb2)  2.0 1.0 3.0
assign (resid 48 and name ha) (resid 34 and name hb1)  2.0 1.0 3.0
assign (resid 48 and name ha) (resid 34 and name hb2)  2.0 1.0 3.0

{ I49 HN 8.73 }

assign (resid 49 and name hn ) (resid 48 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 49 and name hn ) (resid 49 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 49 and name hn ) (resid 49 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 49 and name hn ) (resid 49 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 49 and name ha ) (resid 49 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 49 and name ha ) (resid 49 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 49 and name hn ) (resid 34 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 49 and name hn ) (resid 48 and name hb1)  2.0 1.0 2.0 { m }
assign (resid 49 and name hn ) (resid 48 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 49 and name ha ) (resid 80 and name hn  )  2.0 1.0 3.0 { w }

{ P50 }

{ G51 HN 8.43 }

assign (resid 51 and name hn ) (resid 51 and name ha1 )  2.0 1.0 2.0 { m }
assign (resid 51 and name hn ) (resid 51 and name ha2 )  2.0 1.0 2.0 { m }
assign (resid 51 and name ha1) (resid 51 and name ha2 )  2.0 1.0 1.0 { s }

{ R52 HN 8.82 }

assign (resid 52 and name hn ) (resid 52 and name ha )   2.0 1.0 3.0 { w }
assign (resid 52 and name hn ) (resid 52 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 52 and name hn ) (resid 52 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 52 and name hn ) (resid 52 and name hg*)   2.0 1.0 3.0 { w }
assign (resid 52 and name ha ) (resid 52 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 52 and name ha ) (resid 52 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 52 and name ha ) (resid 52 and name hg*)   2.0 1.0 3.0 { w }

{ L53 }

assign (resid 53 and name hn ) (resid 52 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 53 and name hn ) (resid 53 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 53 and name hn ) (resid 53 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 53 and name hn ) (resid 53 and name hb2 ) 2.0 1.0 2.0 { m }
assign (resid 53 and name hn ) (resid 53 and name hd1*) 2.0 1.0 3.0 { w }
assign (resid 53 and name hn ) (resid 53 and name hd2*) 2.0 1.0 3.0 { w }
assign (resid 53 and name ha ) (resid 53 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 53 and name ha ) (resid 53 and name hb2 ) 2.0 1.0 2.0 { m }
assign (resid 53 and name ha ) (resid 53 and name hd1*) 2.0 1.0 3.0 { w }
assign (resid 53 and name ha ) (resid 53 and name hd2*) 2.0 1.0 3.0 { w }

{ K54 }

assign (resid 54 and name hn ) (resid 53 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 54 and name hn ) (resid 53 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 54 and name hn ) (resid 53 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 54 and name hn ) (resid 54 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 54 and name hn ) (resid 54 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 54 and name hn ) (resid 54 and name hb2 ) 2.0 1.0 2.0 { m }
assign (resid 54 and name hn ) (resid 53 and name hn   ) 2.0 1.0 2.0 { m }

{ N55 }

assign (resid 55 and name hn ) (resid 54 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 55 and name hn ) (resid 54 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 55 and name hn ) (resid 54 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 55 and name hn ) (resid 55 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 55 and name hn ) (resid 55 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 55 and name hn ) (resid 55 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 55 and name ha ) (resid 55 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 55 and name ha ) (resid 55 and name hb2  ) 2.0 1.0 2.0 { m }

{ R56 }

assign (resid 56 and name hn ) (resid 55 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 56 and name hn ) (resid 56 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 56 and name hn ) (resid 56 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 56 and name hn ) (resid 56 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 56 and name hn ) (resid 55 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 56 and name hn ) (resid 55 and name hb2  ) 2.0 1.0 2.0 { m }


{ I57 }

assign (resid 57 and name hn ) (resid 56 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 57 and name hn ) (resid 57 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 57 and name hn ) (resid 57 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 57 and name hn ) (resid 57 and name hg2*) 2.0 1.0 2.0 { m }
assign (resid 57 and name hn ) (resid 56 and name hb1 ) 2.0 1.0 2.0 { m }
assign (resid 57 and name hn ) (resid 56 and name hb2 ) 2.0 1.0 3.0 { w }
assign (resid 57 and name hn ) (resid 56 and name hg* ) 2.0 1.0 3.0 { w }
assign (resid 57 and name ha ) (resid 57 and name hb  ) 2.0 1.0 2.0 { m }
assign (resid 57 and name ha ) (resid 57 and name hg2*) 2.0 1.0 2.0 { m }

{ W58 HN 7.65 }

assign (resid 58 and name hn ) (resid 58 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 58 and name hn ) (resid 58 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 58 and name hn ) (resid 58 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 58 and name ha ) (resid 58 and name hb1) 2.0 1.0 1.0 { s }
assign (resid 58 and name ha ) (resid 58 and name hb2) 2.0 1.0 1.0 { s }
assign (resid 58 and name hd1) (resid 58 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 58 and name hd1) (resid 58 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 58 and name hd1) (resid 58 and name ha ) 2.0 1.0 2.0 { m }

{ W58 HE1 9.88 }

assign (resid 58 and name hn ) (resid 57 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 58 and name hn ) (resid 57 and name hb*  ) 2.0 1.0 2.0 { m }
assign (resid 58 and name hn ) (resid 58 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 58 and name hn) (resid 58 and name hb*)   2.0 1.0 4.0 {319 vw}
assign (resid 58 and name he1) (resid 58 and name hb*)   2.0 1.0 4.0 {319 vw}
assign (resid 58 and name he1) (resid 58 and name hb*)   2.0 1.0 4.0 {308 vw}

{ V59 HN 7.96 }

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 59 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 59 and name hn ) (resid 59 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 59 and name hn ) (resid 59 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 59 and name ha ) (resid 59 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 59 and name ha ) (resid 59 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 59 and name ha ) (resid 59 and name hg2*)  2.0 1.0 2.0 { m }

{ R60 }

assign (resid 60 and name hn ) (resid 59 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 60 and name hn ) (resid 60 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 60 and name hn ) (resid 60 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 60 and name hn ) (resid 60 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 60 and name hn ) (resid 59 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 60 and name hn ) (resid 59 and name hb2  ) 2.0 1.0 2.0 { m }


{ E61 }

assign (resid 61 and name hn ) (resid 60 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 61 and name hn ) (resid 61 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 61 and name hn ) (resid 61 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 61 and name hn ) (resid 61 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 61 and name hn ) (resid 60 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 61 and name hn ) (resid 60 and name hb2  ) 2.0 1.0 2.0 { m }

{ G62 }

assign (resid 62 and name hn ) (resid 63 and name hn  ) 2.0 1.0 1.0 { s }
assign (resid 62 and name hn ) (resid 62 and name ha1  ) 2.0 1.0 2.0 { m }
assign (resid 62 and name hn ) (resid 62 and name ha2  ) 2.0 1.0 2.0 { m }
assign (resid 62 and name ha1) (resid 62 and name ha2  ) 2.0 1.0 1.0 { s }

{ D63 }

assign (resid 63 and name hn ) (resid 63 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 63 and name hn ) (resid 62 and name ha1  ) 2.0 1.0 2.0 { m }
assign (resid 63 and name hn ) (resid 62 and name ha2  ) 2.0 1.0 2.0 { m }
assign (resid 63 and name hn ) (resid 63 and name hb1  ) 2.0 1.0 2.0 { m }
assign (resid 63 and name hn ) (resid 63 and name hb2  ) 2.0 1.0 2.0 { m }
assign (resid 63 and name ha ) (resid 63 and name hb1  ) 2.0 1.0 1.0 { s }
assign (resid 63 and name ha ) (resid 63 and name hb2  ) 2.0 1.0 1.0 { s }

{ V64 HN 8.72 }

assign (resid 64 and name hn ) (resid 64 and name ha   ) 2.0 1.0 3.0 { w }
assign (resid 64 and name hn ) (resid 64 and name hb   ) 2.0 1.0 3.0 { w }
assign (resid 64 and name hn ) (resid 64 and name hg1* ) 2.0 1.0 3.0 { w }
assign (resid 64 and name hn ) (resid 64 and name hg2* ) 2.0 1.0 3.0 { w }
assign (resid 64 and name ha ) (resid 64 and name hb   ) 2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 64 and name hg1* ) 2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 64 and name hg2* ) 2.0 1.0 2.0 { m }
assign (resid 64 and name hb ) (resid 64 and name hg1* ) 2.0 1.0 2.0 { m }
assign (resid 64 and name hb ) (resid 64 and name hg2* ) 2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 26 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 25 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 64 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 64 and name hg**)  2.0 1.0 2.0 { m }
assign (resid 92 and name hd** )(resid 64 and name hg**)  2.0 1.0 5.0 { w }
assign (resid 64 and name hn ) (resid 63 and name ha   ) 2.0 1.0 2.0 { m }
assign (resid 64 and name ha ) (resid 89 and name hg**)  2.0 1.0 4.0 { m }

{ V65 HN 8.99 }

assign (resid 65 and name hn ) (resid 64 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 65 and name hn ) (resid 24 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 65 and name hn ) (resid 25 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 65 and name hn ) (resid 64 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 65 and name hn ) (resid 64 and name hg**)  2.0 1.0 2.0 { m }
assign (resid 65 and name hn ) (resid 65 and name ha   ) 2.0 1.0 3.0 { w }
assign (resid 65 and name hn ) (resid 65 and name hb   ) 2.0 1.0 3.0 { w }
assign (resid 65 and name hn ) (resid 65 and name hg1* ) 2.0 1.0 3.0 { w }
assign (resid 65 and name hn ) (resid 65 and name hg2* ) 2.0 1.0 3.0 { w }
assign (resid 65 and name ha ) (resid 65 and name hb   ) 2.0 1.0 2.0 { m }
assign (resid 65 and name ha ) (resid 65 and name hg1* ) 2.0 1.0 2.0 { m }
assign (resid 65 and name ha ) (resid 65 and name hg2* ) 2.0 1.0 2.0 { m }
assign (resid 65 and name hb ) (resid 65 and name hg1* ) 2.0 1.0 2.0 { m }
assign (resid 65 and name hb ) (resid 65 and name hg2* ) 2.0 1.0 2.0 { m }

{ I66 HN 7.94 }

assign (resid 66 and name hn ) (resid 65 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 66 and name hn ) (resid 65 and name hb  )  2.0 1.0 3.0 { w }
assign (resid 66 and name ha ) (resid 23 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 66 and name ha)  (resid 92 and name hd** )  2.0 1.0 3.0 { w }
assign (resid 66 and name hn ) (resid 66 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 66 and name hn ) (resid 66 and name hb  )  2.0 1.0 3.0 { w }
assign (resid 66 and name hn ) (resid 66 and name hg2* )  2.0 1.0 2.0 { m }
assign (resid 66 and name ha ) (resid 66 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 23 and name ha) (resid 66 and name hb)  2.0 1.0 3.0  {w}
assign (resid 66 and name ha) (resid 23 and name hb1)  2.0 1.0 3.0 {w}
assign (resid 66 and name ha) (resid 23 and name hb2)  2.0 1.0 3.0  {w}


{ V67 HN 9.48 }

assign (resid 67 and name hn ) (resid 66 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 67 and name hn ) (resid 23 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 67 and name hn ) (resid 68 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 67 and name hn ) (resid 67 and name hg1* )  2.0 1.0 2.0 { w }
assign (resid 67 and name hn ) (resid 67 and name hg2* )  2.0 1.0 2.0 { w }
assign (resid 67 and name hn ) (resid 67 and name hb )  2.0 1.0 2.0 { m }
assign (resid 67 and name hn ) (resid 67 and name ha )  2.0 1.0 3.0 { w }
assign (resid 67 and name hn ) (resid 22 and name hn )  2.0 1.0 2.0 { m }
assign (resid 67 and name hn ) (resid 68 and name hn )  2.0 1.0 3.0 { w }
assign (resid 67 and name ha ) (resid 67 and name hb )  2.0 1.0 2.0 { m }
assign (resid 67 and name ha ) (resid 67 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 67 and name ha ) (resid 67 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 67 and name hb ) (resid 67 and name hg1*)  2.0 1.0 2.0 { m }
assign (resid 67 and name hb ) (resid 67 and name hg2*)  2.0 1.0 2.0 { m }


{ K68 HN 8.89 }

assign (resid 68 and name hn ) (resid 68 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 68 and name hn ) (resid 68 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 68 and name hn ) (resid 68 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 68 and name hn ) (resid 67 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 68 and name hn ) (resid 67 and name hg** )  2.0 1.0 2.0 { m }
assign (resid 68 and name hn ) (resid 67 and name hb )  2.0 1.0 2.0 { m }
assign (resid 68 and name ha ) (resid 79 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 68 and name hn ) (resid 79 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 68 and name hn ) (resid 80 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 68 and name ha ) (resid 69 and name hd* )  2.0 1.0 2.0 { m }

{ P69 }

assign (resid 69 and name ha ) (resid 78 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 69 and name ha ) (resid 69 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 69 and name ha ) (resid 69 and name hb2 )  2.0 1.0 2.0 { m }

{ W70 HN 8.00 }

assign (resid 70 and name hn ) (resid 69 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 70 and name hn ) (resid 78 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 70 and name hn ) (resid 70 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 70 and name hn ) (resid 70 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 70 and name hn ) (resid 70 and name hb2  )  2.0 1.0 2.0 { m }

assign (resid 70 and name hn ) (resid 70 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 70 and name hn ) (resid 70 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 70 and name hn ) (resid 70 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 70 and name ha ) (resid 70 and name hb1) 2.0 1.0 1.0 { s }
assign (resid 70 and name ha ) (resid 70 and name hb2) 2.0 1.0 1.0 { s }
assign (resid 70 and name hd1) (resid 70 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 70 and name hd1) (resid 70 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 70 and name hd1) (resid 70 and name ha ) 2.0 1.0 2.0 { m }

{ W70 HD1 7.04 }

assign (resid 70 and name hd1) (resid 70 and name ha )   2.0 1.0 2.0 {598 m }
assign (resid 70 and name hd1) (resid 70 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 70 and name hd1) (resid 70 and name hb2 )   2.0 1.0 2.0 { m }
assign (resid 70 and name hd1) (resid 69 and name ha )   2.0 1.0 3.0 { w }
assign (resid 70 and name hd1) (resid 79 and name ha )   2.0 1.0 4.0 { vw }
assign (resid 70 and name hd1) (resid 77 and name ha )   2.0 1.0 4.0 { vw }

{ W70 HE1 9.95 }

assign (resid 70 and name he1) (resid 79 and name ha )   2.0 1.0 2.0 {598 m }
assign (resid 70 and name he1) (resid 78 and name ha )   2.0 1.0 2.0 {517 m }
assign (resid 70 and name he1) (resid 70 and name ha )   2.0 1.0 2.0 {482 m }
assign (resid 70 and name he1) (resid 69 and name ha )   2.0 1.0 4.0 {449 vw}
assign (resid 70 and name he1) (resid 70 and name hb1)   2.0 1.0 4.0 {357 vw}
assign (resid 70 and name he1) (resid 70 and name hb2)   2.0 1.0 4.0 {292 vw}
assign (resid 70 and name he1) (resid 79 and name hb1)   2.0 1.0 4.0 {271 vw}
assign (resid 70 and name he1) (resid 79 and name hb2)   2.0 1.0 4.0 {244 vw}
assign (resid 70 and name he1) (resid 80 and name hn )   2.0 1.0 4.0 {875 vw}
assign (resid 70 and name he1) (resid 79 and name hn )   2.0 1.0 4.0 {853 vw}
assign (resid 70 and name he1) (resid 70 and name hn )   2.0 1.0 4.0 {801 vw}
assign (resid 70 and name he1) (resid 77 and name ha )   2.0 1.0 4.0 {801 vw}
assign (resid 70 and name he1) (resid 68 and name hb1 )   2.0 1.0 4.0 {  vw }
assign (resid 70 and name he1) (resid 68 and name hb2 )   2.0 1.0 4.0 {  vw }

{ W70 HZ2 7.74 }

assign (resid 70 and name hz2) (resid 70 and name hb1 )   2.0 1.0 4.0 { vw }
assign (resid 70 and name hz2) (resid 70 and name hb2 )   2.0 1.0 4.0 { vw }
assign (resid 70 and name hz2) (resid 78 and name ha )    2.0 1.0 3.0 { w }
assign (resid 70 and name hz2) (resid 70 and name hb1 )   2.0 1.0 4.0 { vw }
assign (resid 70 and name hz2) (resid 79 and name hb1 )   2.0 1.0 4.0 { vw }
assign (resid 70 and name hz2) (resid 79 and name hb2 )   2.0 1.0 4.0 { vw }

{ E71 HN 8.60 }

assign (resid 71 and name hn ) (resid 71 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 71 and name hn ) (resid 71 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 71 and name hn ) (resid 71 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 71 and name hn ) (resid 71 and name hg*  )  2.0 1.0 3.0 { w }
assign (resid 71 and name ha ) (resid 71 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 71 and name ha ) (resid 71 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 71 and name ha ) (resid 71 and name hg*  )  2.0 1.0 3.0 { w }
assign (resid 71 and name hn ) (resid 70 and name ha  )  2.0 1.0 2.0 { m }

{ V72 HN 7.71 }

assign (resid 72 and name hn ) (resid 72 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 72 and name hn ) (resid 72 and name hb  )  2.0 1.0 3.0 { w }
assign (resid 72 and name hn ) (resid 72 and name hg1* )  2.0 1.0 3.0 { w }
assign (resid 72 and name hn ) (resid 72 and name hg2* )  2.0 1.0 3.0 { w }
assign (resid 72 and name hn ) (resid 71 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 72 and name hn ) (resid 71 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 72 and name hn ) (resid 71 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 72 and name hn ) (resid 71 and name hg*  )  2.0 1.0 4.0 { vw }
assign (resid 72 and name ha ) (resid 72 and name hb  )  2.0 1.0 2.0 { m }
assign (resid 72 and name ha ) (resid 72 and name hg1* )  2.0 1.0 3.0 { m }
assign (resid 72 and name ha ) (resid 72 and name hg2* )  2.0 1.0 3.0 { m }
assign (resid 72 and name hb ) (resid 72 and name hg1* )  2.0 1.0 2.0 { m }
assign (resid 72 and name hb ) (resid 72 and name hg2* )  2.0 1.0 2.0 { m }

{ Q73 HN 8.83 }

assign (resid 73 and name hn ) (resid 73 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 73 and name hn ) (resid 73 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 73 and name hn ) (resid 73 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 73 and name hn ) (resid 73 and name hg*  )  2.0 1.0 3.0 { w }
assign (resid 73 and name hn ) (resid 72 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 73 and name hn ) (resid 72 and name hb  )  2.0 1.0 3.0 { w }
assign (resid 73 and name hn ) (resid 72 and name hg1* )  2.0 1.0 4.0 { w }
assign (resid 73 and name hn ) (resid 72 and name hg2* )  2.0 1.0 4.0 { w }
assign (resid 73 and name ha ) (resid 73 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 73 and name ha ) (resid 73 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 73 and name ha ) (resid 73 and name hg*  )  2.0 1.0 3.0 { w }

{ G74 HN 8.60 }

assign (resid 74 and name hn ) (resid 74 and name ha1  )  2.0 1.0 2.0 { m }
assign (resid 74 and name hn ) (resid 74 and name ha2  )  2.0 1.0 2.0 { m }
assign (resid 74 and name ha1) (resid 74 and name ha2  )  2.0 1.0 1.0 { s }
assign (resid 74 and name hn ) (resid 73 and name ha   )  2.0 1.0 2.0 { m }
assign (resid 74 and name hn ) (resid 73 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 74 and name hn ) (resid 73 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 74 and name hn ) (resid 73 and name hg*  )  2.0 1.0 3.0 { w }

{ D75 HN 8.77 }

assign (resid 75 and name hn ) (resid 75 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 75 and name hn ) (resid 75 and name hb2  )  2.0 1.0 2.0 { m }
assign (resid 75 and name hn ) (resid 74 and name ha1  )  2.0 1.0 3.0 { w }
assign (resid 75 and name hn ) (resid 74 and name ha2  )  2.0 1.0 3.0 { w }
assign (resid 75 and name ha ) (resid 75 and name hb1  )  2.0 1.0 2.0 { m }
assign (resid 75 and name ha ) (resid 75 and name hb2  )  2.0 1.0 2.0 { m }

{ Q76 HN 7.74 }

assign (resid 76 and name hn ) (resid 75 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 76 and name hn ) (resid 75 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 76 and name hn ) (resid 75 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 76 and name hn ) (resid 76 and name ha   )  2.0 1.0 2.0 { m}
assign (resid 76 and name hn ) (resid 76 and name hb1  )  2.0 1.0 3.0 { w }
assign (resid 76 and name hn ) (resid 76 and name hb2  )  2.0 1.0 3.0 { w }

{ K77 HN 7.97 }

assign (resid 77 and name hn ) (resid 76 and name hn  )  2.0 1.0 3.0 { w }
assign (resid 77 and name hn ) (resid 76 and name ha   )  2.0 1.0 2.0 { m }
assign (resid 77 and name hn ) (resid 77 and name ha   )  2.0 1.0 3.0 { w }
assign (resid 77 and name hn ) (resid 76 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 77 and name hn ) (resid 76 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 77 and name hn ) (resid 77 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 77 and name hn ) (resid 77 and name hb2 )  2.0 1.0 2.0 { m }

{ C78 HN 7.97 }

assign (resid 78 and name hn ) (resid 77 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 78 and name hn ) (resid 47 and name ha1 )  2.0 1.0 3.0 { w }
assign (resid 78 and name hn ) (resid 47 and name ha2 )  2.0 1.0 3.0 { w }
assign (resid 78 and name ha ) (resid 79 and name hb1 )  2.0 1.0 4.0 { vw }
assign (resid 78 and name ha ) (resid 79 and name hb2 )  2.0 1.0 4.0 { vw }
assign (resid 78 and name hn ) (resid 78 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 78 and name hn ) (resid 78 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 78 and name ha ) (resid 78 and name hb1 )  2.0 1.0 1.0 { s }
assign (resid 78 and name ha ) (resid 78 and name hb2 )  2.0 1.0 1.0 { s }
assign (resid 78 and name ha) (resid 69 and name ha)   2.0 1.0 2.0 {m}
assign (resid 78 and name ha) (resid 69 and name hb1)  2.0 1.0 4.0  {vw}
assign (resid 78 and name ha) (resid 69 and name hb2)  2.0 1.0 4.0  {vw}
assign (resid 69 and name ha) (resid 78 and name hb1)  2.0 1.0 3.0  {w}
assign (resid 69 and name ha) (resid 78 and name hb2)  2.0 1.0 3.0  {w}

{ D79 HN 8.53 }

assign (resid 79 and name hn ) (resid 78 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 79 and name hn ) (resid 78 and name hb1)  2.0 1.0 2.0 { m }
assign (resid 79 and name hn ) (resid 78 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 79 and name hn ) (resid 68 and name hn  )  2.0 1.0 2.0 { m }
assign (resid 79 and name hn ) (resid 68 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 79 and name hn ) (resid 79 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 79 and name hn ) (resid 79 and name hb1)  2.0 1.0 2.0 { m }
assign (resid 79 and name hn ) (resid 79 and name hb2)  2.0 1.0 2.0 { m }
assign (resid 79 and name hn ) (resid 67 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 79 and name ha ) (resid 79 and name hb1)  2.0 1.0 2.0 { m }
assign (resid 79 and name ha ) (resid 79 and name hb2)  2.0 1.0 2.0 { m }

{ I80 HN 8.73 }

assign (resid 80 and name hn ) (resid 49 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 80 and name hn ) (resid 79 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 80 and name hn ) (resid 79 and name hb1)  2.0 1.0 3.0 { w }
assign (resid 80 and name hn ) (resid 79 and name hb2)  2.0 1.0 3.0 { w }
assign (resid 80 and name hn ) (resid 80 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 80 and name hn ) (resid 80 and name hb  )  2.0 1.0 3.0 { m }
assign (resid 80 and name hn ) (resid 80 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 80 and name ha ) (resid 80 and name hb  )  2.0 1.0 3.0 { m }
assign (resid 80 and name ha ) (resid 80 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 80 and name ha) (resid 67 and name hb)  2.0 1.0 3.0 {w}
assign (resid 67 and name ha) (resid 80 and name hb)  2.0 1.0 3.0 {w}

{ I81 HN 8.17 }

assign (resid 81 and name hn ) (resid 67 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 81 and name hn ) (resid 80 and name ha  )  2.0 1.0 1.0 { s }
assign (resid 81 and name hn ) (resid 80 and name hb  )  2.0 1.0 3.0 { m }
assign (resid 81 and name hn ) (resid 80 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 81 and name hn ) (resid 81 and name ha  )  2.0 1.0 3.0 { w }
assign (resid 81 and name hn ) (resid 81 and name hb  )  2.0 1.0 3.0 { m }
assign (resid 81 and name hn ) (resid 81 and name hg2*)  2.0 1.0 2.0 { m }
assign (resid 81 and name ha ) (resid 81 and name hb  )  2.0 1.0 3.0 { m }
assign (resid 81 and name ha ) (resid 81 and name hg2*)  2.0 1.0 2.0 { m }

{ W82 HN 7.57 }

assign (resid 82 and name hn ) (resid 81 and name hb  )  2.0 1.0 3.0 { w }
assign (resid 82 and name hn ) (resid 81 and name hg2*)  2.0 1.0 3.0 { w }
assign (resid 82 and name hn ) (resid 82 and name ha  )  2.0 1.0 2.0 { m }
assign (resid 82 and name hn ) (resid 82 and name hb1 )  2.0 1.0 2.0 { m }
assign (resid 82 and name hn ) (resid 82 and name hb2 )  2.0 1.0 2.0 { m }
assign (resid 82 and name hn ) (resid 82 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 82 and name hn ) (resid 82 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 82 and name hn ) (resid 82 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 82 and name ha ) (resid 82 and name hb1) 2.0 1.0 1.0 { s }
assign (resid 82 and name ha ) (resid 82 and name hb2) 2.0 1.0 1.0 { s }
assign (resid 82 and name hd1) (resid 82 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 82 and name hd1) (resid 82 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 82 and name hd1) (resid 82 and name ha ) 2.0 1.0 2.0 { m }

{ R83 HN 9.29 }

{ Y84 HN 8.04 }

assign (resid 84 and name hn ) (resid 84 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 84 and name hn ) (resid 84 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 84 and name hn ) (resid 84 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 84 and name ha ) (resid 84 and name hb1) 2.0 1.0 1.0 { s }
assign (resid 84 and name ha ) (resid 84 and name hb2) 2.0 1.0 1.0 { s }
assign (resid 84 and name hd*) (resid 84 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 84 and name hd*) (resid 84 and name hb2) 2.0 1.0 2.0 { m }

{ Y84 HD* 7.20 }

assign (resid 84 and name hd* ) (resid 84 and name hb1 )  2.0 1.0 3.0 { m }
assign (resid 84 and name hd* ) (resid 84 and name hb2 )  2.0 1.0 3.0 { m }

{ Y84 HE* 6.91 }

assign (resid 84 and name he* ) (resid 84 and name hb1 )  2.0 1.0 5.0 { vw }
assign (resid 84 and name he* ) (resid 84 and name hb2 )  2.0 1.0 5.0 { vw }

{ T85 HN 8.17 }

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

{ K86 HN }

{ T87 HN 8.23 }
 
assign (resid 87 and name hn ) (resid 87 and name ha)    2.0 1.0 2.0 { m }
assign (resid 87 and name hn ) (resid 87 and name hb)    2.0 1.0 2.0 { m }
assign (resid 87 and name hn ) (resid 87 and name hg*)    2.0 1.0 2.0 { m }
assign (resid 87 and name ha ) (resid 87 and name hb)    2.0 1.0 2.0 { m }
assign (resid 87 and name ha ) (resid 87 and name hg*)    2.0 1.0 2.0 { m }

{ Q88 HN 7.50 }

assign (resid 88 and name hn ) (resid 89 and name hn )   2.0 1.0 1.0 { s }
assign (resid 88 and name hn ) (resid 88 and name ha)    2.0 1.0 2.0 { m }
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 88 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 88 and name hn ) (resid 88 and name hb2)   2.0 1.0 3.0 { w }
assign (resid 88 and name ha ) (resid 88 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 88 and name ha ) (resid 88 and name hb2)   2.0 1.0 3.0 { w }

{ V89 HN 8.71 }

assign (resid 89 and name hn ) (resid 90 and name hn )   2.0 1.0 1.0 { s }
assign (resid 89 and name hn ) (resid 89 and name ha)    2.0 1.0 2.0 { m }
assign (resid 89 and name hn ) (resid 89 and name hb )   2.0 1.0 3.0 { w }
assign (resid 89 and name hn ) (resid 88 and name ha)    2.0 1.0 2.0 { m }
assign (resid 89 and name hn ) (resid 88 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 89 and name hn ) (resid 88 and name hb2)   2.0 1.0 3.0 { w }
assign (resid 89 and name hn ) (resid 89 and name hg1*)   2.0 1.0 3.0 { w }
assign (resid 89 and name hn ) (resid 89 and name hg2*)   2.0 1.0 3.0 { w }
assign (resid 89 and name hg**) (resid 23 and name ha)   2.0 1.0 4.0 { w }
assign (resid 89 and name hg**) (resid 25 and name ha)   2.0 1.0 4.0 { w }
assign (resid 89 and name hg**) (resid 25 and name hg2*)   2.0 1.0 5.0 { w }
assign (resid 89 and name ha) (resid 92 and name hd**)   2.0 1.0 3.0 { w }
assign (resid 89 and name ha ) (resid 89 and name hg1*)   2.0 1.0 3.0 { m }
assign (resid 89 and name ha ) (resid 89 and name hg2*)   2.0 1.0 3.0 { m }
assign (resid 89 and name hb ) (resid 89 and name hg1*)   2.0 1.0 3.0 { m }
assign (resid 89 and name hb ) (resid 89 and name hg2*)   2.0 1.0 3.0 { m }

{ E90 HN 7.79 }

assign (resid 90 and name hn ) (resid 91 and name hn )   2.0 1.0 2.0 { m }
assign (resid 90 and name hn ) (resid 90 and name ha)    2.0 1.0 2.0 { m }
assign (resid 90 and name hn ) (resid 90 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 90 and name hn ) (resid 90 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 90 and name hn ) (resid 90 and name hg1)   2.0 1.0 3.0 { w }
assign (resid 90 and name hn ) (resid 90 and name hg2)   2.0 1.0 3.0 { w }
assign (resid 90 and name hn ) (resid 89 and name ha)    2.0 1.0 2.0 { m }
assign (resid 90 and name hn ) (resid 89 and name hb)   2.0 1.0 3.0 { w }
assign (resid 90 and name hn ) (resid 89 and name hg1*)   2.0 1.0 4.0 { vw }
assign (resid 90 and name hn ) (resid 89 and name hg2*)   2.0 1.0 4.0 { vw }
assign (resid 90 and name ha ) (resid 90 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 90 and name ha ) (resid 90 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 90 and name ha ) (resid 90 and name hg1)   2.0 1.0 3.0 { w }
assign (resid 90 and name ha ) (resid 90 and name hg2)   2.0 1.0 3.0 { w }

{ W91 HN 7.53 }

assign (resid 91 and name hn ) (resid 92 and name hn )   2.0 1.0 2.0 { m }
assign (resid 91 and name hn ) (resid 91 and name ha)    2.0 1.0 2.0 { m }
assign (resid 91 and name hn ) (resid 91 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 91 and name hn ) (resid 91 and name hb2)   2.0 1.0 3.0 { w }
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 90 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 91 and name hn ) (resid 90 and name hb2)   2.0 1.0 3.0 { w }

assign (resid 91 and name hn ) (resid 91 and name ha ) 2.0 1.0 2.0 { m }
assign (resid 91 and name hn ) (resid 91 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 91 and name hn ) (resid 91 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 91 and name ha ) (resid 91 and name hb1) 2.0 1.0 1.0 { s }
assign (resid 91 and name ha ) (resid 91 and name hb2) 2.0 1.0 1.0 { s }
assign (resid 91 and name hd1) (resid 91 and name hb1) 2.0 1.0 2.0 { m }
assign (resid 91 and name hd1) (resid 91 and name hb2) 2.0 1.0 2.0 { m }
assign (resid 91 and name hd1) (resid 91 and name ha ) 2.0 1.0 2.0 { m }

{ W91 HE1 10.25 }

assign (resid 91 and name he1) (resid 91 and name hb*)   2.0 1.0 4.0 {372 vw}
assign (resid 91 and name he1) (resid 91 and name hb*)   2.0 1.0 4.0 {328 vw}
assign (resid 91 and name he1) (resid 12 and name hg1*)  2.0 1.0 4.0 {071 vw}
assign (resid 91 and name he1) (resid 12 and name hg2*)  2.0 1.0 4.0 {032 vw}

{ W91 HZ2 7.59 }

assign (resid 91 and name hz2) (resid 12 and name hg**)  2.0 1.0 4.0 {032 vw}

{ W91 HH2 7.27 }

assign (resid 91 and name hh2) (resid 12 and name hg**)  2.0 1.0 4.0 {032 vw}

{ L92 HN 8.70 }

assign (resid 92 and name hn ) (resid 93 and name hn )   2.0 1.0 2.0 { m }
assign (resid 92 and name hn ) (resid 92 and name ha )   2.0 1.0 2.0 { m }
assign (resid 92 and name hn ) (resid 89 and name ha )   2.0 1.0 2.0 { m }
assign (resid 92 and name hn ) (resid 91 and name ha )   2.0 1.0 2.0 { m }
assign (resid 92 and name hn ) (resid 92 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 92 and name hn ) (resid 92 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 92 and name hn ) (resid 91 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 92 and name hn ) (resid 91 and name hb2)   2.0 1.0 3.0 { w }
assign (resid 92 and name hn ) (resid 92 and name hd1*)   2.0 1.0 4.0 { vw }
assign (resid 92 and name hn ) (resid 92 and name hd2*)   2.0 1.0 4.0 { vw }
assign (resid 92 and name hd**) (resid 23 and name ha)   2.0 1.0 4.0 { w }
assign (resid 92 and name ha ) (resid 92 and name hd1*)   2.0 1.0 3.0 { w }
assign (resid 92 and name ha ) (resid 92 and name hd2*)   2.0 1.0 3.0 { w }
assign (resid 92 and name ha ) (resid 92 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 92 and name ha ) (resid 92 and name hb2)   2.0 1.0 2.0 { m }

{ K93 HN 8.75 }

assign (resid 93 and name hn ) (resid 94 and name hn )   2.0 1.0 2.0 { m }
assign (resid 93 and name hn ) (resid 93 and name ha )   2.0 1.0 2.0 { m }
assign (resid 93 and name hn ) (resid 92 and name ha )   2.0 1.0 2.0 { m }
assign (resid 93 and name hn ) (resid 93 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 93 and name hn ) (resid 93 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 93 and name hn ) (resid 92 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 93 and name hn ) (resid 92 and name hb2)   2.0 1.0 3.0 { w }
assign (resid 93 and name hn ) (resid 90 and name ha )   2.0 1.0 2.0 { m }

{ R94 HN 8.12 }

assign (resid 94 and name hn ) (resid 95 and name hn )   2.0 1.0 2.0 { m }
assign (resid 94 and name hn ) (resid 94 and name ha )   2.0 1.0 2.0 { m }
assign (resid 94 and name hn ) (resid 91 and name ha )   2.0 1.0 2.0 { m }
assign (resid 94 and name hn ) (resid 93 and name ha )   2.0 1.0 2.0 { m }
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 94 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 94 and name hn ) (resid 93 and name hb1)   2.0 1.0 3.0 { w }
assign (resid 94 and name hn ) (resid 93 and name hb2)   2.0 1.0 3.0 { w }

{ K95 HN 7.71 }

assign (resid 95 and name hn ) (resid 96 and name hn )   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 95 and name ha )   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 92 and name ha )   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 94 and name ha )   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 95 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 95 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 94 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 95 and name hn ) (resid 94 and name hb2)   2.0 1.0 2.0 { m }

{ G96 HN 7.42 }

assign (resid 96 and name hn ) (resid 97 and name hn )   2.0 1.0 2.0 { m }
assign (resid 96 and name hn ) (resid 96 and name ha1 )   2.0 1.0 2.0 { m }
assign (resid 96 and name hn ) (resid 96 and name ha2 )   2.0 1.0 2.0 { m }
assign (resid 96 and name ha1) (resid 96 and name ha2 )   2.0 1.0 1.0 { s }
assign (resid 96 and name hn ) (resid 95 and name ha  )   2.0 1.0 2.0 { m }
assign (resid 96 and name hn ) (resid 95 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 96 and name hn ) (resid 95 and name hb2 )   2.0 1.0 2.0 { m }
assign (resid 96 and name hn ) (resid 93 and name ha )   2.0 1.0 2.0 { m }
assign (resid 96 and name hn ) (resid 97 and name he*)   2.0 1.0 3.0 { w }

{ Y97 HN 7.95 }

assign (resid 97 and name hn ) (resid 98 and name hn )   2.0 1.0 2.0 { m }
assign (resid 97 and name hn ) (resid 97 and name ha )   2.0 1.0 2.0 { m }
assign (resid 97 and name hn ) (resid 94 and name ha )   2.0 1.0 2.0 { m }
assign (resid 97 and name hn ) (resid 97 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 97 and name hn ) (resid 97 and name hb2 )   2.0 1.0 2.0 { m }
assign (resid 97 and name hn ) (resid 96 and name ha1 )   2.0 1.0 2.0 { m }
assign (resid 97 and name hn ) (resid 96 and name ha2)   2.0 1.0 2.0 { m }
assign (resid 97 and name ha ) (resid 97 and name hb1)   2.0 1.0 1.0 { s }
assign (resid 97 and name ha ) (resid 97 and name hb2)   2.0 1.0 1.0 { s }
assign (resid 97 and name ha ) (resid 97 and name hd*)   2.0 1.0 2.0 { m }

{ Y97 HD* 6.81 }

assign (resid 97 and name hd* ) (resid 97 and name hb1)   2.0 1.0 2.0 { m }
assign (resid 97 and name hd* ) (resid 97 and name hb2)   2.0 1.0 2.0 { m }
assign (resid 97 and name hd* ) (resid 96 and name ha)   2.0 1.0 2.0 { m }
assign (resid 97 and name hd* ) (resid 97 and name ha)   2.0 1.0 2.0 { m }

{ Y97 HE* 7.15 }

assign (resid 97 and name he* ) (resid 97 and name hb1)   2.0 1.0 5.0 { vw }
assign (resid 97 and name he* ) (resid 97 and name hb2)   2.0 1.0 5.0 { vw }
assign (resid 97 and name he* ) (resid 96 and name ha)   2.0 1.0 4.0 { m }
assign (resid 97 and name he* ) (resid 97 and name ha)   2.0 1.0 4.0 { m }

{ L98 HN 8.08 }

assign (resid 98 and name hn ) (resid 99 and name hn )   2.0 1.0 2.0 { m }
assign (resid 98 and name hn ) (resid 98 and name ha )   2.0 1.0 2.0 { m }
assign (resid 98 and name hn ) (resid 95 and name ha )   2.0 1.0 2.0 { m }
assign (resid 98 and name hn ) (resid 98 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 98 and name hn ) (resid 98 and name hb2 )   2.0 1.0 2.0 { m }
assign (resid 98 and name hn ) (resid 98 and name hd1* )   2.0 1.0 3.0 { w }
assign (resid 98 and name hn ) (resid 98 and name hd2* )   2.0 1.0 3.0 { w }
assign (resid 98 and name hn ) (resid 97 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 98 and name hn ) (resid 97 and name hb2 )   2.0 1.0 2.0 { m }

{ D99 HN 7.31 }

assign (resid 99 and name hn ) (resid 100 and name hn )   2.0 1.0 2.0 { m }
assign (resid 99 and name hn ) (resid 99 and name ha )   2.0 1.0 2.0 { m }
assign (resid 99 and name hn ) (resid 99 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 99 and name hn ) (resid 99 and name hb2 )   2.0 1.0 2.0 { m }
assign (resid 99 and name hn ) (resid 98 and name hd1* )   2.0 1.0 3.0 { w }
assign (resid 99 and name hn ) (resid 98 and name hd2* )   2.0 1.0 3.0 { w }
assign (resid 99 and name hn ) (resid 98 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 99 and name hn ) (resid 98 and name hb2 )   2.0 1.0 2.0 { m }
assign (resid 99 and name hn ) (resid 96 and name ha* )   2.0 1.0 3.0 { w }

{ E100 HN 7.95 }

assign (resid 100 and name hn ) (resid 100 and name ha )   2.0 1.0 2.0 { m }
assign (resid 100 and name hn ) (resid 100 and name hb* )   2.0 1.0 2.0 { m }
assign (resid 100 and name hn ) (resid 99 and name ha )   2.0 1.0 2.0 { m }
assign (resid 100 and name hn ) (resid 99 and name hb1 )   2.0 1.0 2.0 { m }
assign (resid 100 and name hn ) (resid 99 and name hb2 )   2.0 1.0 2.0 { m }

{ hydrogen bonds }

{ **** link strands b3 to b5  **** }

assign (resid 44 and name o  )    (resid 76 and name hn)    2.15 0.2 0.2
assign (resid 44 and name c  )    (resid 76 and name  n)    4.35 0.2 0.2
assign (resid 44 and name o  )    (resid 76 and name  n)    3.14 0.2 0.2
assign (resid 44 and name c  )    (resid 76 and name hn)    3.38 0.2 0.2

assign (resid 76 and name o  )    (resid 46 and name hn)    2.15 0.2 0.2
assign (resid 76 and name c  )    (resid 46 and name  n)    4.35 0.2 0.2
assign (resid 76 and name o  )    (resid 46 and name  n)    3.14 0.2 0.2
assign (resid 76 and name c  )    (resid 46 and name hn)    3.38 0.2 0.2

assign (resid 46 and name o  )    (resid 78 and name hn)    2.15 0.2 0.2
assign (resid 46 and name c  )    (resid 78 and name  n)    4.35 0.2 0.2
assign (resid 46 and name o  )    (resid 78 and name  n)    3.14 0.2 0.2
assign (resid 46 and name c  )    (resid 78 and name hn)    3.38 0.2 0.2

assign (resid 78 and name o  )    (resid 48 and name hn)    2.15 0.2 0.2
assign (resid 78 and name c  )    (resid 48 and name  n)    4.35 0.2 0.2
assign (resid 78 and name o  )    (resid 48 and name  n)    3.14 0.2 0.2
assign (resid 78 and name c  )    (resid 48 and name hn)    3.38 0.2 0.2

assign (resid 48 and name o  )    (resid 80 and name hn)    2.15 0.2 0.2
assign (resid 48 and name c  )    (resid 80 and name  n)    4.35 0.2 0.2
assign (resid 48 and name o  )    (resid 80 and name  n)    3.14 0.2 0.2
assign (resid 48 and name c  )    (resid 80 and name hn)    3.38 0.2 0.2

{ **** link strands b1 to b2  **** }

assign (resid 40 and name o  )    (resid 23 and name hn)    2.15 0.2 0.2
assign (resid 40 and name c  )    (resid 23 and name  n)    4.35 0.2 0.2
assign (resid 40 and name o  )    (resid 23 and name  n)    3.14 0.2 0.2
assign (resid 40 and name c  )    (resid 23 and name hn)    3.38 0.2 0.2

assign (resid 23 and name o  )    (resid 40 and name hn)    2.15 0.2 0.2
assign (resid 23 and name c  )    (resid 40 and name  n)    4.35 0.2 0.2
assign (resid 23 and name o  )    (resid 40 and name  n)    3.14 0.2 0.2
assign (resid 23 and name c  )    (resid 40 and name hn)    3.38 0.2 0.2

assign (resid 38 and name o  )    (resid 25 and name hn)    2.15 0.2 0.2
assign (resid 38 and name c  )    (resid 25 and name  n)    4.35 0.2 0.2
assign (resid 38 and name o  )    (resid 25 and name  n)    3.14 0.2 0.2
assign (resid 38 and name c  )    (resid 25 and name hn)    3.38 0.2 0.2

assign (resid 25 and name o  )    (resid 38 and name hn)    2.15 0.2 0.2
assign (resid 25 and name c  )    (resid 38 and name  n)    4.35 0.2 0.2
assign (resid 25 and name o  )    (resid 38 and name  n)    3.14 0.2 0.2
assign (resid 25 and name c  )    (resid 38 and name hn)    3.38 0.2 0.2

assign (resid 36 and name o  )    (resid 27 and name hn)    2.15 0.2 0.2
assign (resid 36 and name c  )    (resid 27 and name  n)    4.35 0.2 0.2
assign (resid 36 and name o  )    (resid 27 and name  n)    3.14 0.2 0.2
assign (resid 36 and name c  )    (resid 27 and name hn)    3.38 0.2 0.2

assign (resid 27 and name o  )    (resid 36 and name hn)    2.15 0.2 0.2
assign (resid 27 and name c  )    (resid 36 and name  n)    4.35 0.2 0.2
assign (resid 27 and name o  )    (resid 36 and name  n)    3.14 0.2 0.2
assign (resid 27 and name c  )    (resid 36 and name hn)    3.38 0.2 0.2

{ **** link strands b2 to b3  **** }

assign (resid 43 and name o  )    (resid 39 and name hn)    2.15 0.2 0.2
assign (resid 43 and name c  )    (resid 39 and name  n)    4.35 0.2 0.2
assign (resid 43 and name o  )    (resid 39 and name  n)    3.14 0.2 0.2
assign (resid 43 and name c  )    (resid 39 and name hn)    3.38 0.2 0.2

assign (resid 39 and name o  )    (resid 43 and name hn)    2.15 0.2 0.2
assign (resid 39 and name c  )    (resid 43 and name  n)    4.35 0.2 0.2
assign (resid 39 and name o  )    (resid 43 and name  n)    3.14 0.2 0.2
assign (resid 39 and name c  )    (resid 43 and name hn)    3.38 0.2 0.2

assign (resid 45 and name o  )    (resid 37 and name hn)    2.15 0.2 0.2
assign (resid 45 and name c  )    (resid 37 and name  n)    4.35 0.2 0.2
assign (resid 45 and name o  )    (resid 37 and name  n)    3.14 0.2 0.2
assign (resid 45 and name c  )    (resid 37 and name hn)    3.38 0.2 0.2

assign (resid 37 and name o  )    (resid 45 and name hn)    2.15 0.2 0.2
assign (resid 37 and name c  )    (resid 45 and name  n)    4.35 0.2 0.2
assign (resid 37 and name o  )    (resid 45 and name  n)    3.14 0.2 0.2
assign (resid 37 and name c  )    (resid 45 and name hn)    3.38 0.2 0.2

assign (resid 47 and name o  )    (resid 35 and name hn)    2.15 0.2 0.2
assign (resid 47 and name c  )    (resid 35 and name  n)    4.35 0.2 0.2
assign (resid 47 and name o  )    (resid 35 and name  n)    3.14 0.2 0.2
assign (resid 47 and name c  )    (resid 35 and name hn)    3.38 0.2 0.2

assign (resid 35 and name o  )    (resid 47 and name hn)    2.15 0.2 0.2
assign (resid 35 and name c  )    (resid 47 and name  n)    4.35 0.2 0.2
assign (resid 35 and name o  )    (resid 47 and name  n)    3.14 0.2 0.2
assign (resid 35 and name c  )    (resid 47 and name hn)    3.38 0.2 0.2

{ **** link strands b4 to b5  **** }

assign (resid 64 and name o  )    (resid 83 and name hn)    2.15 0.2 0.2
assign (resid 64 and name c  )    (resid 83 and name  n)    4.35 0.2 0.2
assign (resid 64 and name o  )    (resid 83 and name  n)    3.14 0.2 0.2
assign (resid 64 and name c  )    (resid 83 and name hn)    3.38 0.2 0.2

assign (resid 83 and name o  )    (resid 64 and name hn)    2.15 0.2 0.2
assign (resid 83 and name c  )    (resid 64 and name  n)    4.35 0.2 0.2
assign (resid 83 and name o  )    (resid 64 and name  n)    3.14 0.2 0.2
assign (resid 83 and name c  )    (resid 64 and name hn)    3.38 0.2 0.2

assign (resid 66 and name o  )    (resid 81 and name hn)    2.15 0.2 0.2
assign (resid 66 and name c  )    (resid 81 and name  n)    4.35 0.2 0.2
assign (resid 66 and name o  )    (resid 81 and name  n)    3.14 0.2 0.2
assign (resid 66 and name c  )    (resid 81 and name hn)    3.38 0.2 0.2

assign (resid 81 and name o  )    (resid 66 and name hn)    2.15 0.2 0.2
assign (resid 81 and name c  )    (resid 66 and name  n)    4.35 0.2 0.2
assign (resid 81 and name o  )    (resid 66 and name  n)    3.14 0.2 0.2
assign (resid 81 and name c  )    (resid 66 and name hn)    3.38 0.2 0.2

assign (resid 68 and name o  )    (resid 79 and name hn)    2.15 0.2 0.2
assign (resid 68 and name c  )    (resid 79 and name  n)    4.35 0.2 0.2
assign (resid 68 and name o  )    (resid 79 and name  n)    3.14 0.2 0.2
assign (resid 68 and name c  )    (resid 79 and name hn)    3.38 0.2 0.2

assign (resid 79 and name o  )    (resid 68 and name hn)    2.15 0.2 0.2
assign (resid 79 and name c  )    (resid 68 and name  n)    4.35 0.2 0.2
assign (resid 79 and name o  )    (resid 68 and name  n)    3.14 0.2 0.2
assign (resid 79 and name c  )    (resid 68 and name hn)    3.38 0.2 0.2

assign (resid 70 and name o  )    (resid 77 and name hn)    2.15 0.2 0.2
assign (resid 70 and name c  )    (resid 77 and name  n)    4.35 0.2 0.2
assign (resid 70 and name o  )    (resid 77 and name  n)    3.14 0.2 0.2
assign (resid 70 and name c  )    (resid 77 and name hn)    3.38 0.2 0.2

assign (resid 77 and name o  )    (resid 70 and name hn)    2.15 0.2 0.2
assign (resid 77 and name c  )    (resid 70 and name  n)    4.35 0.2 0.2
assign (resid 77 and name o  )    (resid 70 and name  n)    3.14 0.2 0.2
assign (resid 77 and name c  )    (resid 70 and name hn)    3.38 0.2 0.2

assign (resid 72 and name o  )    (resid 75 and name hn)    2.15 0.2 0.2
assign (resid 72 and name c  )    (resid 75 and name  n)    4.35 0.2 0.2
assign (resid 72 and name o  )    (resid 75 and name  n)    3.14 0.2 0.2
assign (resid 72 and name c  )    (resid 75 and name hn)    3.38 0.2 0.2

{ **** link strands b1 to b4  **** }

assign (resid 22 and name o  )    (resid 67 and name hn)    2.15 0.2 0.2
assign (resid 22 and name c  )    (resid 67 and name  n)    4.35 0.2 0.2
assign (resid 22 and name o  )    (resid 67 and name  n)    3.14 0.2 0.2
assign (resid 22 and name c  )    (resid 67 and name hn)    3.38 0.2 0.2

assign (resid 67 and name o  )    (resid 22 and name hn)    2.15 0.2 0.2
assign (resid 67 and name c  )    (resid 22 and name  n)    4.35 0.2 0.2
assign (resid 67 and name o  )    (resid 22 and name  n)    3.14 0.2 0.2
assign (resid 67 and name c  )    (resid 22 and name hn)    3.38 0.2 0.2

assign (resid 24 and name o  )    (resid 65 and name hn)    2.15 0.2 0.2
assign (resid 24 and name c  )    (resid 65 and name  n)    4.35 0.2 0.2
assign (resid 24 and name o  )    (resid 65 and name  n)    3.14 0.2 0.2
assign (resid 24 and name c  )    (resid 65 and name hn)    3.38 0.2 0.2

assign (resid 65 and name o  )    (resid 24 and name hn)    2.15 0.2 0.2
assign (resid 65 and name c  )    (resid 24 and name  n)    4.35 0.2 0.2
assign (resid 65 and name o  )    (resid 24 and name  n)    3.14 0.2 0.2
assign (resid 65 and name c  )    (resid 24 and name hn)    3.38 0.2 0.2

assign (resid 26 and name o  )    (resid 63 and name hn)    2.15 0.2 0.2
assign (resid 26 and name c  )    (resid 63 and name  n)    4.35 0.2 0.2
assign (resid 26 and name o  )    (resid 63 and name  n)    3.14 0.2 0.2
assign (resid 26 and name c  )    (resid 63 and name hn)    3.38 0.2 0.2

assign (resid 63 and name o  )    (resid 26 and name hn)    2.15 0.2 0.2
assign (resid 63 and name c  )    (resid 26 and name  n)    4.35 0.2 0.2
assign (resid 63 and name o  )    (resid 26 and name  n)    3.14 0.2 0.2
assign (resid 63 and name c  )    (resid 26 and name hn)    3.38 0.2 0.2

{ *****  c terminal helix ***** }

assign (resid 88 and name o  )    (resid 92 and name hn)    2.15 0.4 0.2
assign (resid 88 and name c  )    (resid 92 and name  n)    4.35 0.4 0.2
assign (resid 88 and name o  )    (resid 92 and name  n)    3.14 0.4 0.2
assign (resid 88 and name c  )    (resid 92 and name hn)    3.38 0.4 0.2

assign (resid 89 and name o  )    (resid 93 and name hn)    2.15 0.4 0.2
assign (resid 89 and name c  )    (resid 93 and name  n)    4.35 0.4 0.2
assign (resid 89 and name o  )    (resid 93 and name  n)    3.14 0.4 0.2
assign (resid 89 and name c  )    (resid 93 and name hn)    3.38 0.4 0.2

assign (resid 90 and name o  )    (resid 94 and name hn)    2.15 0.4 0.2
assign (resid 90 and name c  )    (resid 94 and name  n)    4.35 0.4 0.2
assign (resid 90 and name o  )    (resid 94 and name  n)    3.14 0.4 0.2
assign (resid 90 and name c  )    (resid 94 and name hn)    3.38 0.4 0.2

assign (resid 91 and name o  )    (resid 95 and name hn)    2.15 0.4 0.2
assign (resid 91 and name c  )    (resid 95 and name  n)    4.35 0.4 0.2
assign (resid 91 and name o  )    (resid 95 and name  n)    3.14 0.4 0.2
assign (resid 91 and name c  )    (resid 95 and name hn)    3.38 0.4 0.2

assign (resid 92 and name o  )    (resid 96 and name hn)    2.15 0.4 0.2
assign (resid 92 and name c  )    (resid 96 and name  n)    4.35 0.4 0.2
assign (resid 92 and name o  )    (resid 96 and name  n)    3.14 0.4 0.2
assign (resid 92 and name c  )    (resid 96 and name hn)    3.38 0.4 0.2

assign (resid 93 and name o  )    (resid 97 and name hn)    2.15 0.4 0.2
assign (resid 93 and name c  )    (resid 97 and name  n)    4.35 0.4 0.2
assign (resid 93 and name o  )    (resid 97 and name  n)    3.14 0.4 0.2
assign (resid 93 and name c  )    (resid 97 and name hn)    3.38 0.4 0.2

assign (resid 94 and name o  )    (resid 98 and name hn)    2.15 0.4 0.2
assign (resid 94 and name c  )    (resid 98 and name  n)    4.35 0.4 0.2
assign (resid 94 and name o  )    (resid 98 and name  n)    3.14 0.4 0.2
assign (resid 94 and name c  )    (resid 98 and name hn)    3.38 0.4 0.2

assign (resid 95 and name o  )    (resid 99 and name hn)    2.15 0.4 0.2
assign (resid 95 and name c  )    (resid 99 and name  n)    4.35 0.4 0.2
assign (resid 95 and name o  )    (resid 99 and name  n)    3.14 0.4 0.2
assign (resid 95 and name c  )    (resid 99 and name hn)    3.38 0.4 0.2

assign (resid 96 and name o  )    (resid 100 and name hn)    2.15 0.4 0.2
assign (resid 96 and name c  )    (resid 100 and name  n)    4.35 0.4 0.2
assign (resid 96 and name o  )    (resid 100 and name  n)    3.14 0.4 0.2
assign (resid 96 and name c  )    (resid 100 and name hn)    3.38 0.4 0.2



{  ***** beta strands  ******* }

{  ***** beta 1 ***** }

 { psi }

 assign (resid  22 and name  n)   (resid  22 and name ca)
        (resid  22 and name  c)   (resid  23 and name n )  1.0  140.0 20.0 2

 { phi }

 assign (resid  21 and name  c)   (resid   22 and name n)
        (resid  22 and name ca)   (resid   22 and name c ) 1.0 -120.0 20.0 2


 assign (resid  23 and name  n)   (resid  23 and name ca)
        (resid  23 and name  c)   (resid  24 and name n )  1.0  140.0 20.0 2

 assign (resid  22 and name  c)   (resid   23 and name n)
        (resid  23 and name ca)   (resid   23 and name c ) 1.0 -120.0 20.0 2
  
 assign (resid  24 and name  n)   (resid  24 and name ca)
        (resid  24 and name  c)   (resid  25 and name n )  1.0  140.0 20.0 2

 assign (resid  23 and name  c)   (resid   24 and name n)
        (resid  24 and name ca)   (resid   24 and name c ) 1.0 -120.0 20.0 2

 assign (resid  25 and name  n)   (resid  25 and name ca)
        (resid  25 and name  c)   (resid  26 and name n )  1.0  140.0 20.0 2

 assign (resid  24 and name  c)   (resid   25 and name n)
        (resid  25 and name ca)   (resid   25 and name c ) 1.0 -120.0 20.0 2

 assign (resid  26 and name  n)   (resid  26 and name ca)
        (resid  26 and name  c)   (resid  27 and name n )  1.0  140.0 20.0 2

 assign (resid  25 and name  c)   (resid   26 and name n)
        (resid  26 and name ca)   (resid   26 and name c ) 1.0 -120.0 20.0 2

 assign (resid  27 and name  n)   (resid  27 and name ca)
        (resid  27 and name  c)   (resid  28 and name n )  1.0  140.0 20.0 2

 assign (resid  26 and name  c)   (resid   27 and name n)
        (resid  27 and name ca)   (resid   27 and name c ) 1.0 -120.0 20.0 2

 
{ ***** beta 2 ***** }


 assign (resid  34 and name  n)   (resid  34 and name ca)
        (resid  34 and name  c)   (resid  35 and name n )  1.0  140.0 20.0 2

 assign (resid  33 and name  c)   (resid   34 and name n)
        (resid  34 and name ca)   (resid   34 and name c ) 1.0 -120.0 20.0 2

 assign (resid  35 and name  n)   (resid  35 and name ca)
        (resid  35 and name  c)   (resid  36 and name n )  1.0  140.0 20.0 2

 assign (resid  34 and name  c)   (resid   35 and name n)
        (resid  35 and name ca)   (resid   35 and name c ) 1.0 -120.0 20.0 2

 assign (resid  36 and name  n)   (resid  36 and name ca)
        (resid  36 and name  c)   (resid  37 and name n )  1.0  140.0 20.0 2

 assign (resid  35 and name  c)   (resid   36 and name n)
        (resid  36 and name ca)   (resid   36 and name c ) 1.0 -120.0 20.0 2

 assign (resid  37 and name  n)   (resid  37 and name ca)
        (resid  37 and name  c)   (resid  38 and name n )  1.0  140.0 20.0 2

 assign (resid  36 and name  c)   (resid   37 and name n)
        (resid  37 and name ca)   (resid   37 and name c ) 1.0 -120.0 20.0 2

 assign (resid  38 and name  n)   (resid  38 and name ca)
        (resid  38 and name  c)   (resid  39 and name n )  1.0  140.0 20.0 2

 assign (resid  37 and name  c)   (resid   38 and name n)
        (resid  38 and name ca)   (resid   38 and name c ) 1.0 -120.0 20.0 2

 assign (resid  39 and name  n)   (resid  39 and name ca)
        (resid  39 and name  c)   (resid  40 and name n )  1.0  140.0 20.0 2

 assign (resid  38 and name  c)   (resid   39 and name n)
        (resid  39 and name ca)   (resid   39 and name c ) 1.0 -120.0 20.0 2

 assign (resid  39 and name  c)   (resid   40 and name n)
        (resid  40 and name ca)   (resid   40 and name c ) 1.0 -120.0 20.0 2


{ ***** beta 3 ***** }

 assign (resid  43 and name  n)   (resid  43 and name ca)
        (resid  43 and name  c)   (resid  44 and name n )  1.0  140.0 20.0 2

 assign (resid  42 and name  c)   (resid  43 and name n)
        (resid  43 and name ca)   (resid  43 and name c ) 1.0 -120.0 20.0 2

 assign (resid  44 and name  n)   (resid  44 and name ca)
        (resid  44 and name  c)   (resid  45 and name n )  1.0  140.0 20.0 2

 assign (resid  43 and name  c)   (resid  44 and name n)
        (resid  44 and name ca)   (resid  44 and name c ) 1.0 -120.0 20.0 2

 assign (resid  45 and name  n)   (resid  45 and name ca)
        (resid  45 and name  c)   (resid  46 and name n )  1.0  140.0 20.0 2

 assign (resid  44 and name  c)   (resid  45 and name n)
        (resid  45 and name ca)   (resid  45 and name c ) 1.0 -120.0 20.0 2

 assign (resid  46 and name  n)   (resid  46 and name ca)
        (resid  46 and name  c)   (resid  47 and name n )  1.0  140.0 20.0 2

 assign (resid  45 and name  c)   (resid  46 and name n)
        (resid  46 and name ca)   (resid  46 and name c ) 1.0 -120.0 20.0 2

 assign (resid  47 and name  n)   (resid  47 and name ca)
        (resid  47 and name  c)   (resid  48 and name n )  1.0  140.0 20.0 2

 assign (resid  46 and name  c)   (resid  47 and name n)
        (resid  47 and name ca)   (resid  47 and name c ) 1.0 -120.0 20.0 2

 assign (resid  48 and name  n)   (resid  48 and name ca)
        (resid  48 and name  c)   (resid  49 and name n )  1.0  140.0 20.0 2

 assign (resid  47 and name  c)   (resid  48 and name n)
        (resid  48 and name ca)   (resid  48 and name c ) 1.0 -120.0 20.0 2

 assign (resid  48 and name  c)   (resid  49 and name n)
        (resid  49 and name ca)   (resid  49 and name c ) 1.0 -120.0 20.0 2


{ ***** beta 4 ***** }

 assign (resid  62 and name  c)   (resid  63 and name n)
        (resid  63 and name ca)   (resid  63 and name c ) 1.0 -120.0 20.0 2

 assign (resid  63 and name  n)   (resid  63 and name ca)
        (resid  63 and name  c)   (resid  64 and name n )  1.0  140.0 20.0 2

 assign (resid  63 and name  c)   (resid  64 and name n)
        (resid  64 and name ca)   (resid  64 and name c ) 1.0 -120.0 20.0 2

 assign (resid  64 and name  n)   (resid  64 and name ca)
        (resid  64 and name  c)   (resid  65 and name n )  1.0  140.0 20.0 2

 assign (resid  64 and name  c)   (resid  65 and name n)
        (resid  65 and name ca)   (resid  65 and name c ) 1.0 -120.0 20.0 2

 assign (resid  65 and name  n)   (resid  65 and name ca)
        (resid  65 and name  c)   (resid  66 and name n )  1.0  140.0 20.0 2

 assign (resid  65 and name  c)   (resid  66 and name n)
        (resid  66 and name ca)   (resid  66 and name c ) 1.0 -120.0 20.0 2

 assign (resid  66 and name  n)   (resid  66 and name ca)
        (resid  66 and name  c)   (resid  67 and name n )  1.0  140.0 20.0 2

 assign (resid  65 and name  c)   (resid  66 and name n)
        (resid  66 and name ca)   (resid  66 and name c ) 1.0 -120.0 20.0 2

 assign (resid  67 and name  n)   (resid  67 and name ca)
        (resid  67 and name  c)   (resid  68 and name n )  1.0  140.0 20.0 2

 assign (resid  66 and name  c)   (resid  67 and name n)
        (resid  67 and name ca)   (resid  67 and name c ) 1.0 -120.0 20.0 2

 assign (resid  68 and name  n)   (resid  68 and name ca)
        (resid  68 and name  c)   (resid  69 and name n )  1.0  140.0 20.0 2

 assign (resid  67 and name  c)   (resid  68 and name n)
        (resid  68 and name ca)   (resid  68 and name c ) 1.0 -120.0 20.0 2

 assign (resid  69 and name  n)   (resid  69 and name ca)
        (resid  69 and name  c)   (resid  70 and name n )  1.0  140.0 20.0 2

 assign (resid  68 and name  c)   (resid  69 and name n)
        (resid  69 and name ca)   (resid  69 and name c ) 1.0 -120.0 20.0 2

 assign (resid  70 and name  n)   (resid  70 and name ca)
        (resid  70 and name  c)   (resid  71 and name n )  1.0  140.0 20.0 2

 assign (resid  69 and name  c)   (resid  70 and name n)
        (resid  70 and name ca)   (resid  70 and name c ) 1.0 -120.0 20.0 2


{ ***** beta 5 ***** }


 assign (resid  76 and name  n)   (resid  76 and name ca)
        (resid  76 and name  c)   (resid  77 and name n )  1.0  140.0 20.0 2

  assign (resid  77 and name  n)   (resid  77 and name ca)
        (resid  77 and name  c)   (resid  78 and name n )  1.0  140.0 20.0 2

 assign (resid  76 and name  c)   (resid  77 and name n)
        (resid  77 and name ca)   (resid  77 and name c ) 1.0 -120.0 20.0 2

 assign (resid  78 and name  n)   (resid  78 and name ca)
        (resid  78 and name  c)   (resid  79 and name n )  1.0  140.0 20.0 2

 assign (resid  77 and name  c)   (resid  78 and name n)
        (resid  78 and name ca)   (resid  78 and name c ) 1.0 -120.0 20.0 2

 assign (resid  79 and name  n)   (resid  79 and name ca)
        (resid  79 and name  c)   (resid  80 and name n )  1.0  140.0 20.0 2

 assign (resid  78 and name  c)   (resid  79 and name n)
        (resid  79 and name ca)   (resid  79 and name c ) 1.0 -120.0 20.0 2

 assign (resid  80 and name  n)   (resid  80 and name ca)
        (resid  80 and name  c)   (resid  81 and name n )  1.0  140.0 20.0 2

 assign (resid  79 and name  c)   (resid  80 and name n)
        (resid  80 and name ca)   (resid  80 and name c ) 1.0 -120.0 20.0 2

 assign (resid  81 and name  n)   (resid  81 and name ca)
        (resid  81 and name  c)   (resid  82 and name n )  1.0  140.0 20.0 2

 assign (resid  80 and name  c)   (resid  81 and name n)
        (resid  81 and name ca)   (resid  81 and name c ) 1.0 -120.0 20.0 2

 assign (resid  82 and name  n)   (resid  82 and name ca)
        (resid  82 and name  c)   (resid  83 and name n )  1.0  140.0 20.0 2

 assign (resid  81 and name  c)   (resid  82 and name n)
        (resid  82 and name ca)   (resid  82 and name c ) 1.0 -120.0 20.0 2



{ ********* cterm helix ******** }

 assign (resid  88 and name c )   (resid  89 and name n)
        (resid  89 and name ca)   (resid  89 and name c )  1.0 -55.0 10.0 2  

 assign (resid  89 and name n )   (resid  89 and name ca)
        (resid  89 and name c )   (resid  90 and name n )  1.0 -45.0 10.0 2  



 assign (resid  89 and name c )   (resid  90 and name n)
        (resid  90 and name ca)   (resid  90 and name c )  1.0 -55.0 10.0 2  

 assign (resid  90 and name n )   (resid  90 and name ca)
        (resid  90 and name c )   (resid  91 and name n )  1.0 -45.0 10.0 2  



 assign (resid  90 and name c )   (resid  91 and name n)
        (resid  91 and name ca)   (resid  91 and name c )  1.0 -55.0 10.0 2  

 assign (resid  91 and name n )   (resid  91 and name ca)
        (resid  91 and name c )   (resid  92 and name n )  1.0 -45.0 10.0 2  



 assign (resid  91 and name c )   (resid  92 and name n)
        (resid  92 and name ca)   (resid  92 and name c )  1.0 -55.0 10.0 2  

 assign (resid  92 and name n )   (resid  92 and name ca)
        (resid  92 and name c )   (resid  93 and name n )  1.0 -45.0 10.0 2  



 assign (resid  92 and name c )   (resid  93 and name n)
        (resid  93 and name ca)   (resid  93 and name c )  1.0 -55.0 10.0 2  

 assign (resid  93 and name n )   (resid  93 and name ca)
        (resid  93 and name c )   (resid  94 and name n )  1.0 -45.0 10.0 2  



 assign (resid  93 and name c )   (resid  94 and name n)
        (resid  94 and name ca)   (resid  94 and name c )  1.0 -55.0 10.0 2  

assign (resid  94 and name n )   (resid  94 and name ca)
        (resid  94 and name c )   (resid  95 and name n )  1.0 -45.0 10.0 2  



 assign (resid  94 and name c )   (resid  95 and name n)
        (resid  95 and name ca)   (resid  95 and name c )  1.0 -55.0 10.0 2  

 assign (resid  95 and name n )   (resid  95 and name ca)
        (resid  95 and name c )   (resid  96 and name n )  1.0 -45.0 10.0 2  



 assign (resid  95 and name c )   (resid  96 and name n)
        (resid  96 and name ca)   (resid  96 and name c )  1.0 -55.0 10.0 2  

 assign (resid  96 and name n )   (resid  96 and name ca)
        (resid  96 and name c )   (resid  97 and name n )  1.0 -45.0 10.0 2  



 assign (resid  96 and name c )   (resid  97 and name n)
        (resid  97 and name ca)   (resid  97 and name c )  1.0 -55.0 10.0 2 

assign (resid  97 and name n )   (resid  97 and name ca)
        (resid  97 and name c )   (resid  98 and name n )  1.0 -45.0 10.0 2  




 assign (resid  97 and name c )   (resid  98 and name n)
        (resid  98 and name ca)   (resid  98 and name c )  1.0 -55.0 10.0 2  

assign (resid  98 and name n )   (resid  98 and name ca)
        (resid  98 and name c )   (resid  99 and name n )  1.0 -45.0 10.0 2  



 assign (resid  98 and name c )   (resid  99 and name n)
        (resid  99 and name ca)   (resid  99 and name c )  1.0 -55.0 10.0 2  

 assign (resid  99 and name n )   (resid  99 and name ca)
        (resid  99 and name c )   (resid  100 and name n )  1.0 -45.0 10.0 2  



 assign (resid  99 and name c )   (resid  100 and name n)
        (resid  100 and name ca)   (resid  100 and name c )  1.0 -55.0 10.0 2  

assign (resid  100 and name n )   (resid  100 and name ca)
        (resid  100 and name c )   (resid  101 and name n )  1.0 -45.0 10.0 2  


{ ********* loop 3 helix ******** }


 assign (resid  51 and name c )   (resid  52 and name n)
        (resid  52 and name ca)   (resid  52 and name c )  1.0 -55.0 10.0 2  

assign (resid  52 and name n )   (resid  52 and name ca)
        (resid  52 and name c )   (resid  53 and name n )  1.0 -45.0 10.0 2  

 assign (resid  52 and name c )   (resid  53 and name n)
        (resid  53 and name ca)   (resid  53 and name c )  1.0 -55.0 10.0 2  

assign (resid  53 and name n )   (resid  53 and name ca)
        (resid  53 and name c )   (resid  54 and name n )  1.0 -45.0 10.0 2  

 assign (resid  53 and name c )   (resid  54 and name n)
        (resid  54 and name ca)   (resid  54 and name c )  1.0 -55.0 10.0 2  


{ end }



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          HT1       MET   1 -13.125  -4.416 -21.208
    2   2H    MET   1          HT2       MET   1 -12.172  -5.818 -21.129
    3   3H    MET   1          HT3       MET   1 -13.177  -5.398 -19.825
    4    HA   MET   1           HA       MET   1 -14.278  -5.942 -22.516
    5   1HB   MET   1          HB2       MET   1 -12.826  -7.831 -21.274
    6   2HB   MET   1          HB1       MET   1 -14.344  -8.052 -20.405
    7   1HG   MET   1          HG2       MET   1 -15.483  -8.750 -22.291
    8   2HG   MET   1          HG1       MET   1 -14.464  -7.812 -23.383
    9   1HE   MET   1          HE1       MET   1 -14.035 -11.506 -24.526
   10   2HE   MET   1          HE2       MET   1 -14.827  -9.956 -24.796
   11   3HE   MET   1          HE3       MET   1 -15.441 -11.047 -23.556
   12    H    ALA   2           HN       ALA   2 -15.015  -3.934 -20.534
   13    HA   ALA   2           HA       ALA   2 -17.822  -4.618 -20.222
   14   1HB   ALA   2          HB1       ALA   2 -16.190  -4.259 -17.689
   15   2HB   ALA   2          HB2       ALA   2 -16.802  -5.808 -18.267
   16   3HB   ALA   2          HB3       ALA   2 -17.928  -4.538 -17.789
   17    H    GLU   3           HN       GLU   3 -18.774  -2.714 -20.726
   18    HA   GLU   3           HA       GLU   3 -17.727  -0.212 -19.496
   19   1HB   GLU   3          HB2       GLU   3 -18.170  -0.729 -22.441
   20   2HB   GLU   3          HB1       GLU   3 -18.222   0.904 -21.777
   21   1HG   GLU   3          HG2       GLU   3 -15.891  -0.959 -21.279
   22   2HG   GLU   3          HG1       GLU   3 -15.952   0.115 -22.675
   23    H    GLN   4           HN       GLN   4 -19.638  -0.637 -18.128
   24    HA   GLN   4           HA       GLN   4 -22.142   0.345 -19.432
   25   1HB   GLN   4          HB2       GLN   4 -21.838  -2.231 -18.563
   26   2HB   GLN   4          HB1       GLN   4 -22.488  -1.460 -17.116
   27   1HG   GLN   4          HG2       GLN   4 -24.452  -2.024 -18.230
   28   2HG   GLN   4          HG1       GLN   4 -24.193  -0.385 -18.824
   29   1HE2  GLN   4          HE21      GLN   4 -24.131  -3.796 -19.735
   30   2HE2  GLN   4          HE22      GLN   4 -23.883  -3.535 -21.394
   31    H    GLN   5           HN       GLN   5 -23.651   1.364 -17.849
   32    HA   GLN   5           HA       GLN   5 -22.288   3.246 -16.149
   33   1HB   GLN   5          HB2       GLN   5 -25.193   2.515 -16.535
   34   2HB   GLN   5          HB1       GLN   5 -24.694   3.717 -15.345
   35   1HG   GLN   5          HG2       GLN   5 -24.844   5.185 -17.074
   36   2HG   GLN   5          HG1       GLN   5 -23.282   4.523 -17.553
   37   1HE2  GLN   5          HE21      GLN   5 -26.775   4.378 -18.223
   38   2HE2  GLN   5          HE22      GLN   5 -26.627   3.571 -19.708
   39    H    GLN   6           HN       GLN   6 -22.222   3.357 -13.866
   40    HA   GLN   6           HA       GLN   6 -22.005   2.501 -11.701
   41   1HB   GLN   6          HB2       GLN   6 -24.560   2.240 -12.170
   42   2HB   GLN   6          HB1       GLN   6 -24.192   0.523 -12.334
   43   1HG   GLN   6          HG2       GLN   6 -23.203   0.494 -10.089
   44   2HG   GLN   6          HG1       GLN   6 -23.494   2.226  -9.922
   45   1HE2  GLN   6          HE21      GLN   6 -25.155  -0.931 -10.193
   46   2HE2  GLN   6          HE22      GLN   6 -26.627  -0.392  -9.543
   47    H    GLU   7           HN       GLU   7 -19.980   1.614 -12.920
   48    HA   GLU   7           HA       GLU   7 -19.935  -1.364 -12.608
   49   1HB   GLU   7          HB2       GLU   7 -19.693  -0.236 -15.001
   50   2HB   GLU   7          HB1       GLU   7 -18.034   0.022 -14.463
   51   1HG   GLU   7          HG2       GLU   7 -17.845  -2.401 -13.945
   52   2HG   GLU   7          HG1       GLU   7 -19.482  -2.642 -14.558
   53    H    GLN   8           HN       GLN   8 -18.295  -2.157 -11.330
   54    HA   GLN   8           HA       GLN   8 -16.635  -0.209  -9.879
   55   1HB   GLN   8          HB2       GLN   8 -17.812  -2.385  -8.960
   56   2HB   GLN   8          HB1       GLN   8 -16.359  -3.185  -9.561
   57   1HG   GLN   8          HG2       GLN   8 -14.973  -2.117  -8.045
   58   2HG   GLN   8          HG1       GLN   8 -16.023  -0.705  -7.921
   59   1HE2  GLN   8          HE21      GLN   8 -15.646  -4.084  -6.828
   60   2HE2  GLN   8          HE22      GLN   8 -16.716  -3.950  -5.517
   61    H    GLN   9           HN       GLN   9 -14.805   0.481 -10.870
   62    HA   GLN   9           HA       GLN   9 -13.404  -1.265 -12.799
   63   1HB   GLN   9          HB2       GLN   9 -13.090   1.624 -11.976
   64   2HB   GLN   9          HB1       GLN   9 -11.912   0.819 -13.012
   65   1HG   GLN   9          HG2       GLN   9 -13.258   1.019 -14.806
   66   2HG   GLN   9          HG1       GLN   9 -14.601   0.272 -13.940
   67   1HE2  GLN   9          HE21      GLN   9 -16.043   1.724 -12.687
   68   2HE2  GLN   9          HE22      GLN   9 -16.100   3.383 -13.037
   69    H    ILE  10           HN       ILE  10 -11.195  -1.855 -12.578
   70    HA   ILE  10           HA       ILE  10 -10.375  -2.591  -9.921
   71    HB   ILE  10           HB       ILE  10  -8.248  -3.299 -11.041
   72   1HG1  ILE  10          HG12      ILE  10  -9.575  -2.310 -13.585
   73   2HG1  ILE  10          HG11      ILE  10  -8.314  -1.409 -12.747
   74   1HG2  ILE  10          HG21      ILE  10 -10.651  -4.115 -12.683
   75   2HG2  ILE  10          HG22      ILE  10 -10.444  -4.632 -11.010
   76   3HG2  ILE  10          HG23      ILE  10  -9.258  -5.097 -12.229
   77   1HD1  ILE  10          HD11      ILE  10  -7.044  -3.741 -12.872
   78   2HD1  ILE  10          HD12      ILE  10  -7.016  -2.618 -14.232
   79   3HD1  ILE  10          HD13      ILE  10  -8.123  -3.990 -14.244
   80    H    ARG  11           HN       ARG  11  -9.528   0.132 -12.032
   81    HA   ARG  11           HA       ARG  11  -8.359   2.106 -11.578
   82   1HB   ARG  11          HB2       ARG  11  -9.590   1.296  -9.114
   83   2HB   ARG  11          HB1       ARG  11  -8.032   2.040  -8.770
   84   1HG   ARG  11          HG2       ARG  11  -9.755   3.407 -10.781
   85   2HG   ARG  11          HG1       ARG  11 -10.274   3.496  -9.099
   86   1HD   ARG  11          HD2       ARG  11  -7.538   4.282 -10.149
   87   2HD   ARG  11          HD1       ARG  11  -8.809   5.397  -9.653
   88    HE   ARG  11           HE       ARG  11  -7.017   3.964  -7.872
   89   1HH1  ARG  11          HH11      ARG  11  -8.170   6.659  -7.277
   90   2HH1  ARG  11          HH12      ARG  11  -9.315   6.302  -6.027
   91   1HH2  ARG  11          HH21      ARG  11  -9.364   2.889  -6.678
   92   2HH2  ARG  11          HH22      ARG  11  -9.992   4.163  -5.686
   93    H    VAL  12           HN       VAL  12  -7.012  -0.663 -11.581
   94    HA   VAL  12           HA       VAL  12  -4.573  -0.210 -10.013
   95    HB   VAL  12           HB       VAL  12  -5.787  -2.486 -10.686
   96   1HG1  VAL  12          HG11      VAL  12  -5.319  -1.900 -13.169
   97   2HG1  VAL  12          HG12      VAL  12  -4.975  -3.543 -12.628
   98   3HG1  VAL  12          HG13      VAL  12  -3.659  -2.385 -12.819
   99   1HG2  VAL  12          HG21      VAL  12  -3.414  -1.821  -9.510
  100   2HG2  VAL  12          HG22      VAL  12  -2.850  -2.772 -10.884
  101   3HG2  VAL  12          HG23      VAL  12  -3.977  -3.478  -9.726
  102    H    ARG  13           HN       ARG  13  -2.436  -0.748 -11.457
  103    HA   ARG  13           HA       ARG  13  -0.946   0.022 -13.089
  104   1HB   ARG  13          HB2       ARG  13  -2.973  -0.781 -14.573
  105   2HB   ARG  13          HB1       ARG  13  -3.235   0.947 -14.807
  106   1HG   ARG  13          HG2       ARG  13  -0.734   1.071 -15.406
  107   2HG   ARG  13          HG1       ARG  13  -0.802  -0.687 -15.535
  108   1HD   ARG  13          HD2       ARG  13  -2.850  -0.285 -17.077
  109   2HD   ARG  13          HD1       ARG  13  -2.260   1.373 -17.184
  110    HE   ARG  13           HE       ARG  13  -0.034   0.203 -17.924
  111   1HH1  ARG  13          HH21      ARG  13  -1.762   0.738 -20.215
  112   2HH1  ARG  13          HH22      ARG  13  -2.010  -0.826 -20.916
  113   1HH2  ARG  13          HH11      ARG  13  -0.983  -2.552 -18.079
  114   2HH2  ARG  13          HH12      ARG  13  -1.568  -2.694 -19.703
  115    H    ILE  14           HN       ILE  14  -0.808   1.682 -11.228
  116    HA   ILE  14           HA       ILE  14  -1.845   4.361 -11.934
  117    HB   ILE  14           HB       ILE  14  -1.888   3.476  -9.564
  118   1HG1  ILE  14          HG12      ILE  14  -0.747   5.634  -8.621
  119   2HG1  ILE  14          HG11      ILE  14  -0.516   6.049 -10.319
  120   1HG2  ILE  14          HG21      ILE  14   0.462   2.447  -9.826
  121   2HG2  ILE  14          HG22      ILE  14   0.103   3.258  -8.302
  122   3HG2  ILE  14          HG23      ILE  14   1.071   4.075  -9.528
  123   1HD1  ILE  14          HD11      ILE  14  -2.962   5.729 -10.694
  124   2HD1  ILE  14          HD12      ILE  14  -2.620   7.009  -9.530
  125   3HD1  ILE  14          HD13      ILE  14  -3.159   5.426  -8.968
  126    HA   PRO  15           HA       PRO  15   1.968   5.426 -13.925
  127   1HB   PRO  15          HB2       PRO  15   1.434   8.112 -14.193
  128   2HB   PRO  15          HB1       PRO  15   0.735   6.861 -15.234
  129   1HG   PRO  15          HG2       PRO  15  -0.552   8.401 -13.026
  130   2HG   PRO  15          HG1       PRO  15  -1.288   7.670 -14.462
  131   1HD   PRO  15          HD2       PRO  15  -1.357   6.597 -11.854
  132   2HD   PRO  15          HD1       PRO  15  -1.755   5.722 -13.347
  133    H    ARG  16           HN       ARG  16   3.649   7.351 -13.630
  134    HA   ARG  16           HA       ARG  16   5.206   8.438 -12.269
  135   1HB   ARG  16          HB2       ARG  16   2.649   8.771 -10.789
  136   2HB   ARG  16          HB1       ARG  16   4.123   9.001  -9.850
  137   1HG   ARG  16          HG2       ARG  16   4.623  10.343 -12.250
  138   2HG   ARG  16          HG1       ARG  16   2.942  10.727 -11.878
  139   1HD   ARG  16          HD2       ARG  16   3.638  11.373  -9.570
  140   2HD   ARG  16          HD1       ARG  16   5.317  11.088 -10.028
  141    HE   ARG  16           HE       ARG  16   5.152  12.988 -11.573
  142   1HH1  ARG  16          HH11      ARG  16   2.253  13.053 -12.134
  143   2HH1  ARG  16          HH12      ARG  16   1.695  14.366 -11.151
  144   1HH2  ARG  16          HH21      ARG  16   4.536  14.424  -9.151
  145   2HH2  ARG  16          HH22      ARG  16   2.991  15.144  -9.458
  146    H    LYS  17           HN       LYS  17   6.711   6.855 -11.888
  147    HA   LYS  17           HA       LYS  17   6.786   5.627  -9.254
  148   1HB   LYS  17          HB2       LYS  17   6.947   3.259 -10.204
  149   2HB   LYS  17          HB1       LYS  17   5.334   3.967 -10.185
  150   1HG   LYS  17          HG2       LYS  17   6.708   4.655 -12.645
  151   2HG   LYS  17          HG1       LYS  17   6.686   2.907 -12.417
  152   1HD   LYS  17          HD2       LYS  17   4.180   3.213 -11.838
  153   2HD   LYS  17          HD1       LYS  17   4.347   4.804 -12.581
  154   1HE   LYS  17          HE2       LYS  17   4.872   3.898 -14.695
  155   2HE   LYS  17          HE1       LYS  17   5.283   2.323 -14.017
  156   1HZ   LYS  17          HZ1       LYS  17   3.162   2.140 -15.028
  157   2HZ   LYS  17          HZ2       LYS  17   2.585   3.535 -14.248
  158   3HZ   LYS  17          HZ3       LYS  17   2.906   2.128 -13.351
  159    H    GLU  18           HN       GLU  18   8.689   7.118  -9.624
  160    HA   GLU  18           HA       GLU  18  10.787   6.387 -11.469
  161   1HB   GLU  18          HB2       GLU  18  10.423   8.653 -10.300
  162   2HB   GLU  18          HB1       GLU  18  11.194   7.918  -8.895
  163   1HG   GLU  18          HG2       GLU  18  13.252   7.671  -9.986
  164   2HG   GLU  18          HG1       GLU  18  12.521   7.748 -11.590
  165    H    GLU  19           HN       GLU  19  10.465   5.930  -7.921
  166    HA   GLU  19           HA       GLU  19  12.519   3.760  -8.125
  167   1HB   GLU  19          HB2       GLU  19  12.610   5.999  -6.542
  168   2HB   GLU  19          HB1       GLU  19  11.884   4.827  -5.444
  169   1HG   GLU  19          HG2       GLU  19  14.106   3.678  -6.953
  170   2HG   GLU  19          HG1       GLU  19  14.604   5.079  -6.006
  171    H    ASN  20           HN       ASN  20   9.501   3.620  -8.514
  172    HA   ASN  20           HA       ASN  20   7.802   2.095  -8.003
  173   1HB   ASN  20          HB2       ASN  20  10.186   0.712  -7.604
  174   2HB   ASN  20          HB1       ASN  20   9.298   0.447  -6.105
  175   1HD2  ASN  20          HD21      ASN  20   7.600  -1.073  -6.165
  176   2HD2  ASN  20          HD22      ASN  20   7.000  -1.775  -7.589
  177    H    GLU  21           HN       GLU  21   6.657   1.065  -5.972
  178    HA   GLU  21           HA       GLU  21   6.922   2.943  -3.655
  179   1HB   GLU  21          HB2       GLU  21   4.426   1.973  -5.065
  180   2HB   GLU  21          HB1       GLU  21   4.386   2.654  -3.438
  181   1HG   GLU  21          HG2       GLU  21   5.806   4.588  -4.582
  182   2HG   GLU  21          HG1       GLU  21   5.012   3.995  -6.041
  183    H    ILE  22           HN       ILE  22   5.670   1.967  -1.677
  184    HA   ILE  22           HA       ILE  22   6.382  -0.925  -1.502
  185    HB   ILE  22           HB       ILE  22   6.642   1.435   0.278
  186   1HG1  ILE  22          HG12      ILE  22   8.456  -0.438   1.063
  187   2HG1  ILE  22          HG11      ILE  22   8.162  -0.950  -0.593
  188   1HG2  ILE  22          HG21      ILE  22   4.974   0.083   1.489
  189   2HG2  ILE  22          HG22      ILE  22   6.528   0.118   2.319
  190   3HG2  ILE  22          HG23      ILE  22   6.053  -1.307   1.395
  191   1HD1  ILE  22          HD11      ILE  22   8.820   1.157  -1.475
  192   2HD1  ILE  22          HD12      ILE  22  10.027   0.778  -0.246
  193   3HD1  ILE  22          HD13      ILE  22   8.740   1.930   0.107
  194    H    LEU  23           HN       LEU  23   4.815  -2.249  -0.067
  195    HA   LEU  23           HA       LEU  23   2.059  -0.980  -0.216
  196   1HB   LEU  23          HB2       LEU  23   1.625  -3.754  -0.353
  197   2HB   LEU  23          HB1       LEU  23   1.372  -2.580  -1.629
  198    HG   LEU  23           HG       LEU  23   2.751  -4.442  -2.418
  199   1HD1  LEU  23          HD11      LEU  23   3.350  -1.732  -2.692
  200   2HD1  LEU  23          HD12      LEU  23   3.909  -3.043  -3.730
  201   3HD1  LEU  23          HD13      LEU  23   4.909  -2.499  -2.383
  202   1HD2  LEU  23          HD21      LEU  23   5.196  -3.847  -0.993
  203   2HD2  LEU  23          HD22      LEU  23   4.359  -5.387  -1.177
  204   3HD2  LEU  23          HD23      LEU  23   3.917  -4.298   0.134
  205    H    GLY  24           HN       GLY  24   1.132  -0.820   1.849
  206   1HA   GLY  24          HA2       GLY  24   1.816  -3.037   3.729
  207   2HA   GLY  24          HA1       GLY  24   2.136  -1.383   4.228
  208    H    ILE  25           HN       ILE  25   0.488  -3.087   5.667
  209    HA   ILE  25           HA       ILE  25  -2.285  -2.169   5.089
  210    HB   ILE  25           HB       ILE  25  -2.937  -3.783   6.876
  211   1HG1  ILE  25          HG12      ILE  25  -0.121  -4.842   6.891
  212   2HG1  ILE  25          HG11      ILE  25  -0.546  -3.515   7.971
  213   1HG2  ILE  25          HG21      ILE  25  -1.237  -4.719   4.568
  214   2HG2  ILE  25          HG22      ILE  25  -2.994  -4.727   4.720
  215   3HG2  ILE  25          HG23      ILE  25  -2.025  -5.872   5.645
  216   1HD1  ILE  25          HD11      ILE  25  -2.290  -4.821   9.008
  217   2HD1  ILE  25          HD12      ILE  25  -0.827  -5.807   8.990
  218   3HD1  ILE  25          HD13      ILE  25  -2.107  -6.106   7.813
  219    H    ILE  26           HN       ILE  26  -3.315  -0.741   6.494
  220    HA   ILE  26           HA       ILE  26  -1.580   0.588   8.496
  221    HB   ILE  26           HB       ILE  26  -2.812   1.863   6.628
  222   1HG1  ILE  26          HG12      ILE  26  -3.304   3.759   8.126
  223   2HG1  ILE  26          HG11      ILE  26  -3.271   2.678   9.517
  224   1HG2  ILE  26          HG21      ILE  26  -4.967   0.557   7.154
  225   2HG2  ILE  26          HG22      ILE  26  -5.127   2.297   6.913
  226   3HG2  ILE  26          HG23      ILE  26  -5.130   1.629   8.545
  227   1HD1  ILE  26          HD11      ILE  26  -0.999   3.624   7.798
  228   2HD1  ILE  26          HD12      ILE  26  -0.872   2.072   8.621
  229   3HD1  ILE  26          HD13      ILE  26  -1.107   3.542   9.555
  230    H    GLU  27           HN       GLU  27  -2.298   1.084  10.535
  231    HA   GLU  27           HA       GLU  27  -4.742  -0.202  11.593
  232   1HB   GLU  27          HB2       GLU  27  -1.938  -0.971  12.241
  233   2HB   GLU  27          HB1       GLU  27  -3.058  -0.845  13.599
  234   1HG   GLU  27          HG2       GLU  27  -4.649  -2.227  11.991
  235   2HG   GLU  27          HG1       GLU  27  -3.122  -2.714  11.258
  236    H    GLN  28           HN       GLN  28  -5.657   1.001  13.233
  237    HA   GLN  28           HA       GLN  28  -4.485   2.611  15.155
  238   1HB   GLN  28          HB2       GLN  28  -4.182   3.833  12.579
  239   2HB   GLN  28          HB1       GLN  28  -5.299   4.808  13.535
  240   1HG   GLN  28          HG2       GLN  28  -2.951   3.826  15.030
  241   2HG   GLN  28          HG1       GLN  28  -2.572   4.950  13.732
  242   1HE2  GLN  28          HE21      GLN  28  -2.190   6.877  14.936
  243   2HE2  GLN  28          HE22      GLN  28  -3.346   7.586  15.957
  244    H    MET  29           HN       MET  29  -6.116   2.886  16.562
  245    HA   MET  29           HA       MET  29  -8.899   3.169  15.501
  246   1HB   MET  29          HB2       MET  29  -8.410   1.164  16.938
  247   2HB   MET  29          HB1       MET  29  -8.034   2.262  18.263
  248   1HG   MET  29          HG2       MET  29 -10.358   1.477  18.431
  249   2HG   MET  29          HG1       MET  29 -10.316   3.210  18.113
  250   1HE   MET  29          HE1       MET  29 -12.959   3.381  15.661
  251   2HE   MET  29          HE2       MET  29 -11.559   4.331  16.151
  252   3HE   MET  29          HE3       MET  29 -12.525   3.507  17.372
  253    H    LEU  30           HN       LEU  30  -6.470   4.580  17.636
  254    HA   LEU  30           HA       LEU  30  -8.052   6.393  19.117
  255   1HB   LEU  30          HB2       LEU  30  -5.265   6.860  18.003
  256   2HB   LEU  30          HB1       LEU  30  -6.008   7.755  19.328
  257    HG   LEU  30           HG       LEU  30  -6.208   4.930  19.864
  258   1HD1  LEU  30          HD11      LEU  30  -3.421   5.976  19.275
  259   2HD1  LEU  30          HD12      LEU  30  -4.253   4.690  18.401
  260   3HD1  LEU  30          HD13      LEU  30  -3.780   4.449  20.083
  261   1HD2  LEU  30          HD21      LEU  30  -6.282   6.726  21.549
  262   2HD2  LEU  30          HD22      LEU  30  -4.620   7.172  21.159
  263   3HD2  LEU  30          HD23      LEU  30  -4.963   5.609  21.901
  264    H    GLY  31           HN       GLY  31  -6.333   7.065  16.030
  265   1HA   GLY  31          HA2       GLY  31  -7.149   8.334  14.190
  266   2HA   GLY  31          HA1       GLY  31  -8.579   8.745  15.136
  267    H    ALA  32           HN       ALA  32  -5.086   9.427  14.887
  268    HA   ALA  32           HA       ALA  32  -5.642  12.159  15.987
  269   1HB   ALA  32          HB1       ALA  32  -4.230  10.763  17.491
  270   2HB   ALA  32          HB2       ALA  32  -3.353  12.163  16.871
  271   3HB   ALA  32          HB3       ALA  32  -3.065  10.565  16.182
  272    H    SER  33           HN       SER  33  -5.885  11.424  13.211
  273    HA   SER  33           HA       SER  33  -5.321  12.331  11.131
  274   1HB   SER  33          HB2       SER  33  -4.396  14.245  12.996
  275   2HB   SER  33          HB1       SER  33  -3.089  14.020  11.838
  276    HG   SER  33           HG       SER  33  -4.317  14.809  10.290
  277    H    ARG  34           HN       ARG  34  -3.344  10.383  12.937
  278    HA   ARG  34           HA       ARG  34  -1.560   9.903  10.609
  279   1HB   ARG  34          HB2       ARG  34   0.401   9.688  12.095
  280   2HB   ARG  34          HB1       ARG  34  -0.274  11.314  12.172
  281   1HG   ARG  34          HG2       ARG  34  -1.668   9.925  14.149
  282   2HG   ARG  34          HG1       ARG  34  -0.018   9.318  14.287
  283   1HD   ARG  34          HD2       ARG  34  -0.797  12.250  14.238
  284   2HD   ARG  34          HD1       ARG  34  -0.368  11.337  15.685
  285    HE   ARG  34           HE       ARG  34   1.500  12.298  13.634
  286   1HH1  ARG  34          HH21      ARG  34   2.092  12.478  16.537
  287   2HH1  ARG  34          HH22      ARG  34   3.212  11.179  16.780
  288   1HH2  ARG  34          HH11      ARG  34   2.415   9.586  13.796
  289   2HH2  ARG  34          HH12      ARG  34   3.395   9.537  15.223
  290    H    VAL  35           HN       VAL  35  -0.703   7.722  10.581
  291    HA   VAL  35           HA       VAL  35  -1.888   5.803  12.509
  292    HB   VAL  35           HB       VAL  35  -2.443   4.279  10.566
  293   1HG1  VAL  35          HG11      VAL  35  -3.976   5.934  11.953
  294   2HG1  VAL  35          HG12      VAL  35  -4.610   5.023  10.583
  295   3HG1  VAL  35          HG13      VAL  35  -4.146   6.713  10.381
  296   1HG2  VAL  35          HG21      VAL  35  -2.894   5.461   8.427
  297   2HG2  VAL  35          HG22      VAL  35  -1.182   5.425   8.849
  298   3HG2  VAL  35          HG23      VAL  35  -2.121   6.897   9.096
  299    H    ARG  36           HN       ARG  36  -1.019   3.566  12.074
  300    HA   ARG  36           HA       ARG  36   1.896   3.810  11.340
  301   1HB   ARG  36          HB2       ARG  36   2.116   1.702  12.845
  302   2HB   ARG  36          HB1       ARG  36   1.940   3.277  13.607
  303   1HG   ARG  36          HG2       ARG  36  -0.148   2.798  14.419
  304   2HG   ARG  36          HG1       ARG  36  -0.595   1.869  12.989
  305   1HD   ARG  36          HD2       ARG  36  -0.444   0.230  14.675
  306   2HD   ARG  36          HD1       ARG  36   1.109   0.113  13.849
  307    HE   ARG  36           HE       ARG  36   0.809   1.715  16.358
  308   1HH1  ARG  36          HH21      ARG  36   3.457   1.698  15.007
  309   2HH1  ARG  36          HH22      ARG  36   4.289   0.414  15.818
  310   1HH2  ARG  36          HH11      ARG  36   1.395  -0.971  17.155
  311   2HH2  ARG  36          HH12      ARG  36   3.119  -1.101  17.038
  312    H    VAL  37           HN       VAL  37   2.607   2.589   9.655
  313    HA   VAL  37           HA       VAL  37   0.901   0.317   8.791
  314    HB   VAL  37           HB       VAL  37   2.319   0.990   6.541
  315   1HG1  VAL  37          HG11      VAL  37  -0.308   0.867   7.466
  316   2HG1  VAL  37          HG12      VAL  37   0.230   0.966   5.792
  317   3HG1  VAL  37          HG13      VAL  37  -0.162   2.437   6.682
  318   1HG2  VAL  37          HG21      VAL  37   1.741   3.492   8.128
  319   2HG2  VAL  37          HG22      VAL  37   1.722   3.509   6.366
  320   3HG2  VAL  37          HG23      VAL  37   3.195   3.069   7.226
  321    H    ARG  38           HN       ARG  38   1.823  -1.451   7.990
  322    HA   ARG  38           HA       ARG  38   4.795  -1.820   8.284
  323   1HB   ARG  38          HB2       ARG  38   4.014  -4.350   8.552
  324   2HB   ARG  38          HB1       ARG  38   4.057  -3.289   9.954
  325   1HG   ARG  38          HG2       ARG  38   1.530  -3.322   8.370
  326   2HG   ARG  38          HG1       ARG  38   1.888  -4.756   9.329
  327   1HD   ARG  38          HD2       ARG  38   2.018  -1.966  10.489
  328   2HD   ARG  38          HD1       ARG  38   0.540  -2.928  10.508
  329    HE   ARG  38           HE       ARG  38   3.017  -3.535  12.026
  330   1HH1  ARG  38          HH11      ARG  38   1.944  -6.119  11.185
  331   2HH1  ARG  38          HH12      ARG  38   0.754  -6.479  12.390
  332   1HH2  ARG  38          HH21      ARG  38   0.555  -3.209  13.548
  333   2HH2  ARG  38          HH22      ARG  38  -0.035  -4.827  13.731
  334    H    CYS  39           HN       CYS  39   5.701  -2.633   6.312
  335    HA   CYS  39           HA       CYS  39   3.674  -3.490   4.291
  336   1HB   CYS  39          HB2       CYS  39   5.878  -1.668   3.447
  337   2HB   CYS  39          HB1       CYS  39   4.259  -1.845   2.785
  338    HG   CYS  39           HG       CYS  39   4.003   0.302   4.098
  339    H    LEU  40           HN       LEU  40   4.461  -4.449   2.416
  340    HA   LEU  40           HA       LEU  40   6.883  -6.071   2.750
  341   1HB   LEU  40          HB2       LEU  40   4.378  -6.692   1.861
  342   2HB   LEU  40          HB1       LEU  40   5.187  -6.351   0.341
  343    HG   LEU  40           HG       LEU  40   6.852  -8.026   0.765
  344   1HD1  LEU  40          HD11      LEU  40   6.498  -9.404   2.986
  345   2HD1  LEU  40          HD12      LEU  40   5.737  -7.919   3.557
  346   3HD1  LEU  40          HD13      LEU  40   7.421  -7.902   3.032
  347   1HD2  LEU  40          HD21      LEU  40   5.405 -10.039   1.072
  348   2HD2  LEU  40          HD22      LEU  40   4.730  -8.874  -0.068
  349   3HD2  LEU  40          HD23      LEU  40   4.092  -8.974   1.573
  350    H    ASP  41           HN       ASP  41   7.885  -6.352   0.401
  351    HA   ASP  41           HA       ASP  41   9.121  -5.343  -1.330
  352   1HB   ASP  41          HB2       ASP  41   6.937  -3.908  -1.673
  353   2HB   ASP  41          HB1       ASP  41   7.784  -2.688  -0.725
  354    H    GLY  42           HN       GLY  42   9.336  -5.469   1.676
  355   1HA   GLY  42          HA2       GLY  42  10.952  -5.055   3.273
  356   2HA   GLY  42          HA1       GLY  42  11.918  -4.328   2.003
  357    H    LYS  43           HN       LYS  43   8.858  -3.303   3.794
  358    HA   LYS  43           HA       LYS  43  10.456  -0.949   4.615
  359   1HB   LYS  43          HB2       LYS  43   8.348  -0.846   2.597
  360   2HB   LYS  43          HB1       LYS  43   8.150   0.328   3.894
  361   1HG   LYS  43          HG2       LYS  43  10.627  -0.061   2.196
  362   2HG   LYS  43          HG1       LYS  43   9.520   1.306   2.130
  363   1HD   LYS  43          HD2       LYS  43  10.519   2.318   3.880
  364   2HD   LYS  43          HD1       LYS  43  10.519   0.838   4.830
  365   1HE   LYS  43          HE2       LYS  43  12.419   0.757   2.601
  366   2HE   LYS  43          HE1       LYS  43  12.762   2.047   3.752
  367   1HZ   LYS  43          HZ1       LYS  43  12.488  -0.850   4.317
  368   2HZ   LYS  43          HZ2       LYS  43  12.527   0.335   5.535
  369   3HZ   LYS  43          HZ3       LYS  43  13.866   0.118   4.513
  370    H    THR  44           HN       THR  44   9.602   0.308   6.233
  371    HA   THR  44           HA       THR  44   7.130  -0.542   7.630
  372    HB   THR  44           HB       THR  44   9.279   0.068   9.536
  373    HG1  THR  44           HG1      THR  44  10.545  -1.170   8.182
  374   1HG2  THR  44          HG21      THR  44   8.250  -1.860  10.692
  375   2HG2  THR  44          HG22      THR  44   7.277  -2.182   9.257
  376   3HG2  THR  44          HG23      THR  44   7.041  -0.689  10.165
  377    H    ARG  45           HN       ARG  45   6.014   1.362   7.768
  378    HA   ARG  45           HA       ARG  45   7.563   3.825   8.380
  379   1HB   ARG  45          HB2       ARG  45   6.218   4.932   6.457
  380   2HB   ARG  45          HB1       ARG  45   7.635   3.965   6.057
  381   1HG   ARG  45          HG2       ARG  45   5.056   2.490   6.219
  382   2HG   ARG  45          HG1       ARG  45   5.225   3.606   4.868
  383   1HD   ARG  45          HD2       ARG  45   6.980   1.242   5.550
  384   2HD   ARG  45          HD1       ARG  45   6.067   1.525   4.070
  385    HE   ARG  45           HE       ARG  45   8.724   2.468   4.574
  386   1HH1  ARG  45          HH21      ARG  45   7.541   2.234   1.843
  387   2HH1  ARG  45          HH22      ARG  45   7.386   3.890   1.362
  388   1HH2  ARG  45          HH11      ARG  45   7.755   5.128   4.587
  389   2HH2  ARG  45          HH12      ARG  45   7.473   5.533   2.933
  390    H    LEU  46           HN       LEU  46   6.219   5.722   8.732
  391    HA   LEU  46           HA       LEU  46   3.628   5.003  10.053
  392   1HB   LEU  46          HB2       LEU  46   3.782   7.339  11.011
  393   2HB   LEU  46          HB1       LEU  46   5.112   6.297  11.510
  394    HG   LEU  46           HG       LEU  46   5.709   7.689   9.013
  395   1HD1  LEU  46          HD11      LEU  46   4.413   9.523   9.764
  396   2HD1  LEU  46          HD12      LEU  46   6.053   9.911  10.284
  397   3HD1  LEU  46          HD13      LEU  46   4.887   9.277  11.445
  398   1HD2  LEU  46          HD21      LEU  46   7.055   7.850  11.723
  399   2HD2  LEU  46          HD22      LEU  46   7.788   8.128  10.143
  400   3HD2  LEU  46          HD23      LEU  46   7.289   6.502  10.610
  401    H    GLY  47           HN       GLY  47   1.797   5.489   8.849
  402   1HA   GLY  47          HA2       GLY  47   2.214   6.974   6.328
  403   2HA   GLY  47          HA1       GLY  47   0.826   5.967   6.708
  404    H    ARG  48           HN       ARG  48   1.146   8.778   5.712
  405    HA   ARG  48           HA       ARG  48  -0.558  10.121   7.753
  406   1HB   ARG  48          HB2       ARG  48   0.341  12.277   6.951
  407   2HB   ARG  48          HB1       ARG  48   1.626  11.240   7.568
  408   1HG   ARG  48          HG2       ARG  48   2.316  10.629   5.347
  409   2HG   ARG  48          HG1       ARG  48   0.889  11.379   4.633
  410   1HD   ARG  48          HD2       ARG  48   3.049  12.869   6.152
  411   2HD   ARG  48          HD1       ARG  48   2.913  12.804   4.396
  412    HE   ARG  48           HE       ARG  48   1.299  14.452   6.168
  413   1HH1  ARG  48          HH11      ARG  48   2.025  15.392   3.479
  414   2HH1  ARG  48          HH12      ARG  48   0.560  15.191   2.578
  415   1HH2  ARG  48          HH21      ARG  48  -0.877  13.030   4.888
  416   2HH2  ARG  48          HH22      ARG  48  -1.087  13.849   3.377
  417    H    ILE  49           HN       ILE  49  -2.330  11.334   6.958
  418    HA   ILE  49           HA       ILE  49  -2.983  10.904   4.072
  419    HB   ILE  49           HB       ILE  49  -4.306   9.845   6.380
  420   1HG1  ILE  49          HG12      ILE  49  -5.894   9.472   4.060
  421   2HG1  ILE  49          HG11      ILE  49  -4.217   9.530   3.520
  422   1HG2  ILE  49          HG21      ILE  49  -5.535  12.010   6.457
  423   2HG2  ILE  49          HG22      ILE  49  -6.587  10.646   6.080
  424   3HG2  ILE  49          HG23      ILE  49  -6.067  11.737   4.797
  425   1HD1  ILE  49          HD11      ILE  49  -3.648   7.862   5.309
  426   2HD1  ILE  49          HD12      ILE  49  -4.754   7.233   4.088
  427   3HD1  ILE  49          HD13      ILE  49  -5.370   7.726   5.666
  428    HA   PRO  50           HA       PRO  50  -3.800  15.233   3.967
  429   1HB   PRO  50          HB2       PRO  50  -5.725  15.318   2.000
  430   2HB   PRO  50          HB1       PRO  50  -4.001  15.059   1.684
  431   1HG   PRO  50          HG2       PRO  50  -6.237  13.080   1.647
  432   2HG   PRO  50          HG1       PRO  50  -4.717  13.072   0.739
  433   1HD   PRO  50          HD2       PRO  50  -5.251  11.523   3.027
  434   2HD   PRO  50          HD1       PRO  50  -3.639  11.846   2.354
  435    H    GLY  51           HN       GLY  51  -5.618  16.880   4.190
  436   1HA   GLY  51          HA2       GLY  51  -7.264  16.357   6.433
  437   2HA   GLY  51          HA1       GLY  51  -7.488  17.713   5.330
  438    H    ARG  52           HN       ARG  52  -8.146  16.383   2.962
  439    HA   ARG  52           HA       ARG  52 -10.924  15.883   3.268
  440   1HB   ARG  52          HB2       ARG  52  -8.916  15.487   1.101
  441   2HB   ARG  52          HB1       ARG  52 -10.430  14.594   0.952
  442   1HG   ARG  52          HG2       ARG  52 -10.584  17.488   1.687
  443   2HG   ARG  52          HG1       ARG  52 -10.195  17.080   0.016
  444   1HD   ARG  52          HD2       ARG  52 -12.421  15.521   1.170
  445   2HD   ARG  52          HD1       ARG  52 -12.743  17.246   1.002
  446    HE   ARG  52           HE       ARG  52 -12.060  16.942  -1.440
  447   1HH1  ARG  52          HH21      ARG  52 -11.247  14.041  -1.098
  448   2HH1  ARG  52          HH22      ARG  52 -12.639  13.217  -1.714
  449   1HH2  ARG  52          HH11      ARG  52 -14.699  16.012  -1.542
  450   2HH2  ARG  52          HH12      ARG  52 -14.599  14.336  -1.967
  451    H    LEU  53           HN       LEU  53  -8.317  13.493   2.650
  452    HA   LEU  53           HA       LEU  53  -9.994  11.195   3.017
  453   1HB   LEU  53          HB2       LEU  53  -7.123  11.734   2.675
  454   2HB   LEU  53          HB1       LEU  53  -7.468  10.311   3.656
  455    HG   LEU  53           HG       LEU  53  -9.169   9.714   1.773
  456   1HD1  LEU  53          HD11      LEU  53  -9.043  11.871   0.601
  457   2HD1  LEU  53          HD12      LEU  53  -8.479  10.572  -0.450
  458   3HD1  LEU  53          HD13      LEU  53  -7.315  11.639   0.335
  459   1HD2  LEU  53          HD21      LEU  53  -7.124   8.433   2.232
  460   2HD2  LEU  53          HD22      LEU  53  -6.169   9.602   1.321
  461   3HD2  LEU  53          HD23      LEU  53  -7.355   8.595   0.491
  462    H    LYS  54           HN       LYS  54  -8.069  13.123   5.287
  463    HA   LYS  54           HA       LYS  54  -7.963  11.413   7.506
  464   1HB   LYS  54          HB2       LYS  54  -7.098  13.868   7.175
  465   2HB   LYS  54          HB1       LYS  54  -8.642  14.313   7.900
  466   1HG   LYS  54          HG2       LYS  54  -7.409  12.150   9.385
  467   2HG   LYS  54          HG1       LYS  54  -6.306  13.520   9.256
  468   1HD   LYS  54          HD2       LYS  54  -7.750  14.965  10.377
  469   2HD   LYS  54          HD1       LYS  54  -9.180  14.016   9.969
  470   1HE   LYS  54          HE2       LYS  54  -8.105  12.163  11.437
  471   2HE   LYS  54          HE1       LYS  54  -7.092  13.459  12.072
  472   1HZ   LYS  54          HZ1       LYS  54  -9.090  14.681  12.667
  473   2HZ   LYS  54          HZ2       LYS  54  -9.076  13.154  13.411
  474   3HZ   LYS  54          HZ3       LYS  54 -10.063  13.433  12.057
  475    H    ASN  55           HN       ASN  55 -10.641  13.653   6.666
  476    HA   ASN  55           HA       ASN  55 -12.300  12.515   8.830
  477   1HB   ASN  55          HB2       ASN  55 -12.183  14.998   7.502
  478   2HB   ASN  55          HB1       ASN  55 -13.727  14.284   7.039
  479   1HD2  ASN  55          HD21      ASN  55 -15.128  13.484   8.916
  480   2HD2  ASN  55          HD22      ASN  55 -15.023  14.304  10.398
  481    H    ARG  56           HN       ARG  56 -11.547  11.414   5.824
  482    HA   ARG  56           HA       ARG  56 -14.300  10.361   5.319
  483   1HB   ARG  56          HB2       ARG  56 -12.945  11.845   3.584
  484   2HB   ARG  56          HB1       ARG  56 -12.169  10.304   3.218
  485   1HG   ARG  56          HG2       ARG  56 -14.604   9.376   3.097
  486   2HG   ARG  56          HG1       ARG  56 -15.068  11.070   2.932
  487   1HD   ARG  56          HD2       ARG  56 -12.937   9.815   1.194
  488   2HD   ARG  56          HD1       ARG  56 -14.643   9.789   0.750
  489    HE   ARG  56           HE       ARG  56 -12.978  12.251   0.997
  490   1HH1  ARG  56          HH21      ARG  56 -14.252  11.132  -1.573
  491   2HH1  ARG  56          HH22      ARG  56 -15.599  12.204  -1.758
  492   1HH2  ARG  56          HH11      ARG  56 -15.417  13.420   1.493
  493   2HH2  ARG  56          HH12      ARG  56 -16.260  13.504  -0.017
  494    H    ILE  57           HN       ILE  57 -11.059   9.474   6.160
  495    HA   ILE  57           HA       ILE  57 -11.254   6.747   5.124
  496    HB   ILE  57           HB       ILE  57  -9.138   6.383   6.483
  497   1HG1  ILE  57          HG12      ILE  57  -8.351   9.084   6.795
  498   2HG1  ILE  57          HG11      ILE  57  -9.934   8.957   7.554
  499   1HG2  ILE  57          HG21      ILE  57  -9.451   8.443   4.322
  500   2HG2  ILE  57          HG22      ILE  57  -8.742   6.832   4.233
  501   3HG2  ILE  57          HG23      ILE  57  -7.857   8.142   5.012
  502   1HD1  ILE  57          HD11      ILE  57  -9.206   7.433   9.140
  503   2HD1  ILE  57          HD12      ILE  57  -7.726   8.362   8.903
  504   3HD1  ILE  57          HD13      ILE  57  -7.928   6.805   8.100
  505    H    TRP  58           HN       TRP  58 -11.238   8.151   8.436
  506    HA   TRP  58           HA       TRP  58 -11.889   7.191  10.473
  507   1HB   TRP  58          HB2       TRP  58 -14.117   6.622   8.530
  508   2HB   TRP  58          HB1       TRP  58 -14.241   6.122  10.214
  509    HD1  TRP  58           HD1      TRP  58 -13.676   9.299   8.110
  510    HE1  TRP  58           HE1      TRP  58 -14.506  11.327   9.467
  511    HE3  TRP  58           HE3      TRP  58 -14.887   6.988  12.501
  512    HZ2  TRP  58           HZ2      TRP  58 -15.546  11.894  12.071
  513    HZ3  TRP  58           HZ3      TRP  58 -15.794   8.294  14.400
  514    HH2  TRP  58           HH2      TRP  58 -16.125  10.742  14.191
  515    H    VAL  59           HN       VAL  59  -9.933   5.611   9.563
  516    HA   VAL  59           HA       VAL  59 -10.700   2.866   9.070
  517    HB   VAL  59           HB       VAL  59  -8.321   2.342   9.454
  518   1HG1  VAL  59          HG11      VAL  59  -9.321   3.697   7.382
  519   2HG1  VAL  59          HG12      VAL  59  -7.597   3.351   7.513
  520   3HG1  VAL  59          HG13      VAL  59  -8.216   4.935   7.978
  521   1HG2  VAL  59          HG21      VAL  59  -7.475   3.613  11.185
  522   2HG2  VAL  59          HG22      VAL  59  -8.393   5.047  10.724
  523   3HG2  VAL  59          HG23      VAL  59  -6.933   4.611   9.836
  524    H    ARG  60           HN       ARG  60 -11.138   1.251  10.504
  525    HA   ARG  60           HA       ARG  60 -11.241   1.967  13.378
  526   1HB   ARG  60          HB2       ARG  60 -13.195   0.882  12.153
  527   2HB   ARG  60          HB1       ARG  60 -12.220  -0.585  12.070
  528   1HG   ARG  60          HG2       ARG  60 -11.983   0.110  14.725
  529   2HG   ARG  60          HG1       ARG  60 -13.640   0.595  14.363
  530   1HD   ARG  60          HD2       ARG  60 -14.128  -1.639  13.481
  531   2HD   ARG  60          HD1       ARG  60 -12.458  -2.133  13.758
  532    HE   ARG  60           HE       ARG  60 -14.529  -1.804  15.825
  533   1HH1  ARG  60          HH11      ARG  60 -12.808  -4.199  15.774
  534   2HH1  ARG  60          HH12      ARG  60 -11.625  -3.859  16.992
  535   1HH2  ARG  60          HH21      ARG  60 -12.305  -0.452  17.075
  536   2HH2  ARG  60          HH22      ARG  60 -11.339  -1.731  17.730
  537    H    GLU  61           HN       GLU  61 -10.313  -1.031  11.616
  538    HA   GLU  61           HA       GLU  61  -7.643  -1.113  12.671
  539   1HB   GLU  61          HB2       GLU  61  -9.351  -1.631  14.679
  540   2HB   GLU  61          HB1       GLU  61  -9.271  -3.248  13.981
  541   1HG   GLU  61          HG2       GLU  61  -7.525  -3.176  15.600
  542   2HG   GLU  61          HG1       GLU  61  -6.723  -2.990  14.041
  543    H    GLY  62           HN       GLY  62  -6.722  -2.128  10.946
  544   1HA   GLY  62          HA2       GLY  62  -6.193  -4.193   9.794
  545   2HA   GLY  62          HA1       GLY  62  -7.832  -4.756  10.107
  546    H    ASP  63           HN       ASP  63  -6.174  -2.089   8.360
  547    HA   ASP  63           HA       ASP  63  -8.106  -2.534   6.103
  548   1HB   ASP  63          HB2       ASP  63  -7.088   0.053   7.287
  549   2HB   ASP  63          HB1       ASP  63  -7.721  -0.022   5.644
  550    H    VAL  64           HN       VAL  64  -7.123  -1.931   3.924
  551    HA   VAL  64           HA       VAL  64  -4.163  -2.386   4.035
  552    HB   VAL  64           HB       VAL  64  -5.255  -2.609   1.357
  553   1HG1  VAL  64          HG11      VAL  64  -3.872  -4.502   3.279
  554   2HG1  VAL  64          HG12      VAL  64  -3.096  -3.494   2.061
  555   3HG1  VAL  64          HG13      VAL  64  -4.131  -4.835   1.569
  556   1HG2  VAL  64          HG21      VAL  64  -6.500  -4.753   1.815
  557   2HG2  VAL  64          HG22      VAL  64  -7.331  -3.311   2.397
  558   3HG2  VAL  64          HG23      VAL  64  -6.463  -4.348   3.531
  559    H    VAL  65           HN       VAL  65  -2.757  -0.988   2.961
  560    HA   VAL  65           HA       VAL  65  -3.975   1.342   1.560
  561    HB   VAL  65           HB       VAL  65  -2.608   2.927   2.882
  562   1HG1  VAL  65          HG11      VAL  65  -4.985   1.974   3.575
  563   2HG1  VAL  65          HG12      VAL  65  -4.102   3.058   4.649
  564   3HG1  VAL  65          HG13      VAL  65  -4.078   1.318   4.936
  565   1HG2  VAL  65          HG21      VAL  65  -1.456   2.168   4.904
  566   2HG2  VAL  65          HG22      VAL  65  -0.823   1.298   3.507
  567   3HG2  VAL  65          HG23      VAL  65  -1.962   0.507   4.598
  568    H    ILE  66           HN       ILE  66  -2.495   2.541   0.248
  569    HA   ILE  66           HA       ILE  66  -0.077   0.959  -0.560
  570    HB   ILE  66           HB       ILE  66  -1.736   1.517  -2.346
  571   1HG1  ILE  66          HG12      ILE  66   0.860   1.409  -2.637
  572   2HG1  ILE  66          HG11      ILE  66  -0.123   2.030  -3.959
  573   1HG2  ILE  66          HG21      ILE  66  -2.590   3.625  -1.490
  574   2HG2  ILE  66          HG22      ILE  66  -1.907   3.891  -3.093
  575   3HG2  ILE  66          HG23      ILE  66  -1.004   4.378  -1.659
  576   1HD1  ILE  66          HD11      ILE  66   0.623   4.131  -2.067
  577   2HD1  ILE  66          HD12      ILE  66   0.820   4.078  -3.817
  578   3HD1  ILE  66          HD13      ILE  66   2.029   3.336  -2.771
  579    H    VAL  67           HN       VAL  67   1.985   1.898  -0.146
  580    HA   VAL  67           HA       VAL  67   1.833   4.623   1.073
  581    HB   VAL  67           HB       VAL  67   3.313   4.034   2.748
  582   1HG1  VAL  67          HG11      VAL  67   1.133   2.550   2.568
  583   2HG1  VAL  67          HG12      VAL  67   2.351   2.203   3.794
  584   3HG1  VAL  67          HG13      VAL  67   2.296   1.252   2.310
  585   1HG2  VAL  67          HG21      VAL  67   4.763   1.952   2.576
  586   2HG2  VAL  67          HG22      VAL  67   5.166   3.242   1.444
  587   3HG2  VAL  67          HG23      VAL  67   4.257   1.836   0.891
  588    H    LYS  68           HN       LYS  68   3.522   6.001   0.932
  589    HA   LYS  68           HA       LYS  68   5.318   5.771  -1.428
  590   1HB   LYS  68          HB2       LYS  68   3.485   7.735  -0.848
  591   2HB   LYS  68          HB1       LYS  68   4.953   8.403  -0.138
  592   1HG   LYS  68          HG2       LYS  68   6.128   8.236  -2.245
  593   2HG   LYS  68          HG1       LYS  68   4.786   7.356  -2.976
  594   1HD   LYS  68          HD2       LYS  68   4.089   9.392  -3.697
  595   2HD   LYS  68          HD1       LYS  68   3.538   9.625  -2.038
  596   1HE   LYS  68          HE2       LYS  68   4.872  11.527  -2.439
  597   2HE   LYS  68          HE1       LYS  68   5.958  10.442  -1.571
  598   1HZ   LYS  68          HZ1       LYS  68   5.815  10.551  -4.531
  599   2HZ   LYS  68          HZ2       LYS  68   7.001   9.804  -3.571
  600   3HZ   LYS  68          HZ3       LYS  68   6.892  11.499  -3.626
  601    HA   PRO  69           HA       PRO  69   8.528   5.745   1.645
  602   1HB   PRO  69          HB2       PRO  69  10.654   6.103  -0.004
  603   2HB   PRO  69          HB1       PRO  69   9.753   4.583   0.099
  604   1HG   PRO  69          HG2       PRO  69   9.778   6.590  -2.090
  605   2HG   PRO  69          HG1       PRO  69   9.310   4.884  -2.143
  606   1HD   PRO  69          HD2       PRO  69   7.560   7.161  -2.026
  607   2HD   PRO  69          HD1       PRO  69   7.102   5.444  -1.979
  608    H    TRP  70           HN       TRP  70   9.527   7.182   2.950
  609    HA   TRP  70           HA       TRP  70   9.964   9.981   1.987
  610   1HB   TRP  70          HB2       TRP  70   9.088   8.980   4.684
  611   2HB   TRP  70          HB1       TRP  70   9.761  10.584   4.459
  612    HD1  TRP  70           HD1      TRP  70   7.505   8.615   2.183
  613    HE1  TRP  70           HE1      TRP  70   5.444   9.934   1.860
  614    HE3  TRP  70           HE3      TRP  70   8.419  12.521   5.317
  615    HZ2  TRP  70           HZ2      TRP  70   4.225  12.313   2.751
  616    HZ3  TRP  70           HZ3      TRP  70   6.742  14.337   5.554
  617    HH2  TRP  70           HH2      TRP  70   4.624  14.242   4.260
  618    H    GLU  71           HN       GLU  71  12.289  10.296   1.986
  619    HA   GLU  71           HA       GLU  71  14.558  10.004   2.559
  620   1HB   GLU  71          HB2       GLU  71  13.114  11.037   4.686
  621   2HB   GLU  71          HB1       GLU  71  14.013   9.715   5.429
  622   1HG   GLU  71          HG2       GLU  71  16.059  10.677   4.141
  623   2HG   GLU  71          HG1       GLU  71  15.076  12.132   3.973
  624    H    VAL  72           HN       VAL  72  15.423   8.522   5.078
  625    HA   VAL  72           HA       VAL  72  14.602   5.742   4.501
  626    HB   VAL  72           HB       VAL  72  17.284   5.315   4.589
  627   1HG1  VAL  72          HG11      VAL  72  15.728   4.374   2.949
  628   2HG1  VAL  72          HG12      VAL  72  17.145   5.032   2.131
  629   3HG1  VAL  72          HG13      VAL  72  15.628   5.931   2.125
  630   1HG2  VAL  72          HG21      VAL  72  18.505   6.941   3.370
  631   2HG2  VAL  72          HG22      VAL  72  17.544   7.894   4.501
  632   3HG2  VAL  72          HG23      VAL  72  17.040   7.752   2.817
  633    H    GLN  73           HN       GLN  73  17.590   6.735   6.153
  634    HA   GLN  73           HA       GLN  73  18.282   6.387   8.365
  635   1HB   GLN  73          HB2       GLN  73  15.413   7.132   9.015
  636   2HB   GLN  73          HB1       GLN  73  16.822   7.315  10.056
  637   1HG   GLN  73          HG2       GLN  73  17.703   9.077   8.774
  638   2HG   GLN  73          HG1       GLN  73  16.727   8.662   7.365
  639   1HE2  GLN  73          HE21      GLN  73  16.759  10.476  10.357
  640   2HE2  GLN  73          HE22      GLN  73  15.198  11.125  10.208
  641    H    GLY  74           HN       GLY  74  16.736   5.439  10.610
  642   1HA   GLY  74          HA2       GLY  74  16.512   2.576   9.863
  643   2HA   GLY  74          HA1       GLY  74  16.588   3.210  11.508
  644    H    ASP  75           HN       ASP  75  14.462   4.694   9.170
  645    HA   ASP  75           HA       ASP  75  12.075   3.189   9.610
  646   1HB   ASP  75          HB2       ASP  75  10.937   5.061  11.018
  647   2HB   ASP  75          HB1       ASP  75  11.944   3.893  11.864
  648    H    GLN  76           HN       GLN  76  10.583   3.914   8.066
  649    HA   GLN  76           HA       GLN  76  11.389   6.451   6.690
  650   1HB   GLN  76          HB2       GLN  76   9.956   4.005   5.635
  651   2HB   GLN  76          HB1       GLN  76  10.175   5.491   4.712
  652   1HG   GLN  76          HG2       GLN  76  12.726   5.069   5.544
  653   2HG   GLN  76          HG1       GLN  76  12.157   3.405   5.438
  654   1HE2  GLN  76          HE21      GLN  76  10.220   4.204   3.173
  655   2HE2  GLN  76          HE22      GLN  76  11.219   4.353   1.812
  656    H    LYS  77           HN       LYS  77   9.782   7.855   5.876
  657    HA   LYS  77           HA       LYS  77   7.197   7.751   7.401
  658   1HB   LYS  77          HB2       LYS  77   8.917   9.927   6.422
  659   2HB   LYS  77          HB1       LYS  77   7.211  10.147   6.031
  660   1HG   LYS  77          HG2       LYS  77   6.561  10.078   8.307
  661   2HG   LYS  77          HG1       LYS  77   8.100   9.380   8.809
  662   1HD   LYS  77          HD2       LYS  77   9.131  11.586   7.863
  663   2HD   LYS  77          HD1       LYS  77   7.490  12.216   8.011
  664   1HE   LYS  77          HE2       LYS  77   8.496  10.731  10.371
  665   2HE   LYS  77          HE1       LYS  77   9.307  12.261  10.038
  666   1HZ   LYS  77          HZ1       LYS  77   7.186  13.376  10.033
  667   2HZ   LYS  77          HZ2       LYS  77   7.371  12.521  11.489
  668   3HZ   LYS  77          HZ3       LYS  77   6.365  11.910  10.264
  669    H    CYS  78           HN       CYS  78   5.188   7.915   6.114
  670    HA   CYS  78           HA       CYS  78   5.692   7.550   3.213
  671   1HB   CYS  78          HB2       CYS  78   4.452   5.503   3.063
  672   2HB   CYS  78          HB1       CYS  78   5.651   5.295   4.334
  673    HG   CYS  78           HG       CYS  78   3.177   4.515   5.087
  674    H    ASP  79           HN       ASP  79   3.924   7.905   1.851
  675    HA   ASP  79           HA       ASP  79   1.681   9.437   3.206
  676   1HB   ASP  79          HB2       ASP  79   3.198  10.253   1.076
  677   2HB   ASP  79          HB1       ASP  79   1.899   9.418   0.224
  678    H    ILE  80           HN       ILE  80  -0.118   8.149   3.469
  679    HA   ILE  80           HA       ILE  80  -0.293   5.781   1.662
  680    HB   ILE  80           HB       ILE  80  -1.769   4.858   3.558
  681   1HG1  ILE  80          HG12      ILE  80  -0.208   6.694   5.331
  682   2HG1  ILE  80          HG11      ILE  80  -1.675   7.328   4.587
  683   1HG2  ILE  80          HG21      ILE  80   1.132   5.346   4.227
  684   2HG2  ILE  80          HG22      ILE  80   0.633   4.272   2.922
  685   3HG2  ILE  80          HG23      ILE  80   0.156   3.920   4.583
  686   1HD1  ILE  80          HD11      ILE  80  -2.846   5.216   5.431
  687   2HD1  ILE  80          HD12      ILE  80  -2.375   6.389   6.661
  688   3HD1  ILE  80          HD13      ILE  80  -1.407   4.936   6.412
  689    H    ILE  81           HN       ILE  81  -2.198   4.922   1.038
  690    HA   ILE  81           HA       ILE  81  -4.548   6.771   0.936
  691    HB   ILE  81           HB       ILE  81  -3.098   5.354  -1.183
  692   1HG1  ILE  81          HG12      ILE  81  -4.774   6.849  -2.528
  693   2HG1  ILE  81          HG11      ILE  81  -5.176   7.514  -0.945
  694   1HG2  ILE  81          HG21      ILE  81  -5.182   4.641  -2.404
  695   2HG2  ILE  81          HG22      ILE  81  -6.070   4.847  -0.894
  696   3HG2  ILE  81          HG23      ILE  81  -4.787   3.641  -1.007
  697   1HD1  ILE  81          HD11      ILE  81  -2.823   8.085  -0.559
  698   2HD1  ILE  81          HD12      ILE  81  -3.381   8.817  -2.062
  699   3HD1  ILE  81          HD13      ILE  81  -2.378   7.367  -2.107
  700    H    TRP  82           HN       TRP  82  -6.333   5.883   1.938
  701    HA   TRP  82           HA       TRP  82  -6.057   3.114   2.950
  702   1HB   TRP  82          HB2       TRP  82  -6.626   4.386   4.769
  703   2HB   TRP  82          HB1       TRP  82  -7.501   5.568   3.804
  704    HD1  TRP  82           HD1      TRP  82  -7.927   2.174   5.511
  705    HE1  TRP  82           HE1      TRP  82 -10.446   1.664   5.719
  706    HE3  TRP  82           HE3      TRP  82  -9.839   6.042   2.782
  707    HZ2  TRP  82           HZ2      TRP  82 -12.942   2.753   4.842
  708    HZ3  TRP  82           HZ3      TRP  82 -12.286   6.282   2.483
  709    HH2  TRP  82           HH2      TRP  82 -13.839   4.644   3.509
  710    H    ARG  83           HN       ARG  83  -7.482   1.495   2.571
  711    HA   ARG  83           HA       ARG  83 -10.035   1.813   1.258
  712   1HB   ARG  83          HB2       ARG  83  -7.744   1.659  -0.442
  713   2HB   ARG  83          HB1       ARG  83  -8.605   0.125  -0.569
  714   1HG   ARG  83          HG2       ARG  83 -10.190   2.667  -0.633
  715   2HG   ARG  83          HG1       ARG  83  -9.306   2.188  -2.080
  716   1HD   ARG  83          HD2       ARG  83 -10.853   0.630  -2.568
  717   2HD   ARG  83          HD1       ARG  83 -10.672  -0.102  -0.974
  718    HE   ARG  83           HE       ARG  83 -12.426   1.415  -0.156
  719   1HH1  ARG  83          HH11      ARG  83 -13.608  -0.056  -2.540
  720   2HH1  ARG  83          HH12      ARG  83 -14.355   1.244  -3.407
  721   1HH2  ARG  83          HH21      ARG  83 -12.616   3.728  -1.709
  722   2HH2  ARG  83          HH22      ARG  83 -13.792   3.392  -2.936
  723    H    TYR  84           HN       TYR  84 -11.243  -0.096   1.489
  724    HA   TYR  84           HA       TYR  84  -9.850  -2.296   2.944
  725   1HB   TYR  84          HB2       TYR  84 -11.770  -1.102   4.066
  726   2HB   TYR  84          HB1       TYR  84 -12.823  -1.753   2.813
  727    HD1  TYR  84           HD1      TYR  84 -13.714  -3.923   3.008
  728    HD2  TYR  84           HD2      TYR  84 -10.348  -2.785   5.421
  729    HE1  TYR  84           HE1      TYR  84 -13.888  -6.058   4.255
  730    HE2  TYR  84           HE2      TYR  84 -10.522  -4.919   6.670
  731    HH   TYR  84           HH       TYR  84 -12.974  -6.706   6.926
  732    H    THR  85           HN       THR  85  -9.090  -3.457   1.131
  733    HA   THR  85           HA       THR  85  -9.174  -5.033  -0.579
  734    HB   THR  85           HB       THR  85 -12.062  -5.505   0.174
  735    HG1  THR  85           HG1      THR  85 -11.023  -5.534   2.111
  736   1HG2  THR  85          HG21      THR  85  -9.802  -7.282  -0.780
  737   2HG2  THR  85          HG22      THR  85 -11.179  -6.745  -1.742
  738   3HG2  THR  85          HG23      THR  85 -11.428  -7.837  -0.380
  739    H    LYS  86           HN       LYS  86  -9.038  -3.997  -2.526
  740    HA   LYS  86           HA       LYS  86 -11.604  -3.299  -3.856
  741   1HB   LYS  86          HB2       LYS  86 -10.184  -1.313  -4.901
  742   2HB   LYS  86          HB1       LYS  86 -11.036  -1.109  -3.375
  743   1HG   LYS  86          HG2       LYS  86  -9.099  -0.736  -2.282
  744   2HG   LYS  86          HG1       LYS  86  -8.411  -2.236  -2.897
  745   1HD   LYS  86          HD2       LYS  86  -6.972  -0.790  -3.944
  746   2HD   LYS  86          HD1       LYS  86  -8.265  -0.748  -5.141
  747   1HE   LYS  86          HE2       LYS  86  -9.229   1.237  -3.980
  748   2HE   LYS  86          HE1       LYS  86  -7.856   1.221  -2.874
  749   1HZ   LYS  86          HZ1       LYS  86  -7.564   2.766  -4.744
  750   2HZ   LYS  86          HZ2       LYS  86  -7.641   1.459  -5.827
  751   3HZ   LYS  86          HZ3       LYS  86  -6.368   1.565  -4.706
  752    H    THR  87           HN       THR  87  -8.176  -2.915  -4.809
  753    HA   THR  87           HA       THR  87  -8.035  -5.242  -6.462
  754    HB   THR  87           HB       THR  87  -7.936  -3.377  -8.556
  755    HG1  THR  87           HG1      THR  87  -9.138  -1.894  -7.405
  756   1HG2  THR  87          HG21      THR  87  -8.756  -5.397  -9.217
  757   2HG2  THR  87          HG22      THR  87 -10.311  -4.608  -8.953
  758   3HG2  THR  87          HG23      THR  87  -9.629  -5.654  -7.707
  759    H    GLN  88           HN       GLN  88  -7.013  -1.832  -6.166
  760    HA   GLN  88           HA       GLN  88  -4.435  -2.096  -7.338
  761   1HB   GLN  88          HB2       GLN  88  -5.700   0.041  -6.567
  762   2HB   GLN  88          HB1       GLN  88  -4.975  -0.278  -4.991
  763   1HG   GLN  88          HG2       GLN  88  -2.776  -0.024  -5.817
  764   2HG   GLN  88          HG1       GLN  88  -3.291  -0.214  -7.494
  765   1HE2  GLN  88          HE21      GLN  88  -4.390   1.635  -8.524
  766   2HE2  GLN  88          HE22      GLN  88  -4.278   3.192  -7.858
  767    H    VAL  89           HN       VAL  89  -5.275  -2.137  -3.830
  768    HA   VAL  89           HA       VAL  89  -2.667  -3.043  -3.020
  769    HB   VAL  89           HB       VAL  89  -5.299  -3.367  -1.542
  770   1HG1  VAL  89          HG11      VAL  89  -3.981  -4.586  -0.155
  771   2HG1  VAL  89          HG12      VAL  89  -3.238  -3.048   0.281
  772   3HG1  VAL  89          HG13      VAL  89  -2.504  -4.060  -0.961
  773   1HG2  VAL  89          HG21      VAL  89  -4.934  -1.015  -1.989
  774   2HG2  VAL  89          HG22      VAL  89  -3.226  -1.149  -1.570
  775   3HG2  VAL  89          HG23      VAL  89  -4.456  -1.309  -0.317
  776    H    GLU  90           HN       GLU  90  -5.631  -4.733  -3.972
  777    HA   GLU  90           HA       GLU  90  -4.872  -7.365  -3.138
  778   1HB   GLU  90          HB2       GLU  90  -7.138  -6.431  -4.133
  779   2HB   GLU  90          HB1       GLU  90  -6.427  -6.924  -5.671
  780   1HG   GLU  90          HG2       GLU  90  -6.019  -9.198  -4.679
  781   2HG   GLU  90          HG1       GLU  90  -6.914  -8.682  -3.250
  782    H    TRP  91           HN       TRP  91  -4.124  -5.462  -6.026
  783    HA   TRP  91           HA       TRP  91  -2.899  -7.549  -7.570
  784   1HB   TRP  91          HB2       TRP  91  -3.361  -4.752  -7.826
  785   2HB   TRP  91          HB1       TRP  91  -1.633  -5.008  -8.051
  786    HD1  TRP  91           HD1      TRP  91  -4.838  -6.859  -9.220
  787    HE1  TRP  91           HE1      TRP  91  -4.548  -7.442 -11.714
  788    HE3  TRP  91           HE3      TRP  91  -0.187  -4.916 -10.045
  789    HZ2  TRP  91           HZ2      TRP  91  -2.601  -7.124 -13.786
  790    HZ3  TRP  91           HZ3      TRP  91   0.859  -5.069 -12.287
  791    HH2  TRP  91           HH2      TRP  91  -0.342  -6.169 -14.156
  792    H    LEU  92           HN       LEU  92  -1.401  -4.970  -5.569
  793    HA   LEU  92           HA       LEU  92   1.258  -5.983  -5.766
  794   1HB   LEU  92          HB2       LEU  92   1.680  -4.614  -3.672
  795   2HB   LEU  92          HB1       LEU  92   0.995  -3.725  -5.025
  796    HG   LEU  92           HG       LEU  92  -1.293  -4.460  -3.816
  797   1HD1  LEU  92          HD11      LEU  92  -0.958  -5.310  -1.759
  798   2HD1  LEU  92          HD12      LEU  92  -0.252  -3.768  -1.283
  799   3HD1  LEU  92          HD13      LEU  92   0.781  -5.059  -1.898
  800   1HD2  LEU  92          HD21      LEU  92  -0.954  -2.216  -2.468
  801   2HD2  LEU  92          HD22      LEU  92  -1.019  -2.182  -4.230
  802   3HD2  LEU  92          HD23      LEU  92   0.538  -2.117  -3.403
  803    H    LYS  93           HN       LYS  93  -1.330  -6.700  -3.422
  804    HA   LYS  93           HA       LYS  93   0.294  -8.265  -1.637
  805   1HB   LYS  93          HB2       LYS  93  -2.405  -7.467  -1.762
  806   2HB   LYS  93          HB1       LYS  93  -2.442  -9.229  -1.793
  807   1HG   LYS  93          HG2       LYS  93  -2.483  -8.373   0.529
  808   2HG   LYS  93          HG1       LYS  93  -1.023  -9.309   0.217
  809   1HD   LYS  93          HD2       LYS  93   0.256  -7.541   0.757
  810   2HD   LYS  93          HD1       LYS  93  -0.523  -6.574  -0.495
  811   1HE   LYS  93          HE2       LYS  93  -2.430  -6.195   1.146
  812   2HE   LYS  93          HE1       LYS  93  -1.402  -6.921   2.381
  813   1HZ   LYS  93          HZ1       LYS  93  -0.714  -4.544   0.737
  814   2HZ   LYS  93          HZ2       LYS  93   0.276  -5.245   1.926
  815   3HZ   LYS  93          HZ3       LYS  93  -1.194  -4.515   2.363
  816    H    ARG  94           HN       ARG  94  -1.719  -9.154  -4.461
  817    HA   ARG  94           HA       ARG  94  -1.305 -11.969  -4.373
  818   1HB   ARG  94          HB2       ARG  94  -1.881 -10.020  -6.596
  819   2HB   ARG  94          HB1       ARG  94  -1.541 -11.710  -6.971
  820   1HG   ARG  94          HG2       ARG  94  -3.401 -12.475  -5.686
  821   2HG   ARG  94          HG1       ARG  94  -3.617 -10.898  -4.927
  822   1HD   ARG  94          HD2       ARG  94  -5.305 -11.011  -6.601
  823   2HD   ARG  94          HD1       ARG  94  -4.041  -9.994  -7.293
  824    HE   ARG  94           HE       ARG  94  -3.301 -12.000  -8.594
  825   1HH1  ARG  94          HH21      ARG  94  -4.874 -14.027  -6.987
  826   2HH1  ARG  94          HH22      ARG  94  -6.205 -14.355  -8.046
  827   1HH2  ARG  94          HH11      ARG  94  -5.676 -11.538 -10.012
  828   2HH2  ARG  94          HH12      ARG  94  -6.660 -12.941  -9.764
  829    H    LYS  95           HN       LYS  95   0.664  -9.340  -5.670
  830    HA   LYS  95           HA       LYS  95   2.660 -10.926  -6.980
  831   1HB   LYS  95          HB2       LYS  95   2.150  -8.221  -6.687
  832   2HB   LYS  95          HB1       LYS  95   3.626  -8.439  -5.748
  833   1HG   LYS  95          HG2       LYS  95   4.845  -8.608  -7.630
  834   2HG   LYS  95          HG1       LYS  95   3.832  -9.933  -8.203
  835   1HD   LYS  95          HD2       LYS  95   3.615  -8.228  -9.851
  836   2HD   LYS  95          HD1       LYS  95   2.137  -8.137  -8.894
  837   1HE   LYS  95          HE2       LYS  95   3.298  -6.360  -7.487
  838   2HE   LYS  95          HE1       LYS  95   4.565  -6.339  -8.713
  839   1HZ   LYS  95          HZ1       LYS  95   2.914  -5.785 -10.376
  840   2HZ   LYS  95          HZ2       LYS  95   2.887  -4.642  -9.119
  841   3HZ   LYS  95          HZ3       LYS  95   1.680  -5.834  -9.212
  842    H    GLY  96           HN       GLY  96   2.222  -9.901  -3.607
  843   1HA   GLY  96          HA2       GLY  96   4.845 -10.556  -2.664
  844   2HA   GLY  96          HA1       GLY  96   3.394 -10.484  -1.665
  845    H    TYR  97           HN       TYR  97   1.835 -12.465  -2.848
  846    HA   TYR  97           HA       TYR  97   2.952 -14.862  -1.689
  847   1HB   TYR  97          HB2       TYR  97   0.769 -15.060  -3.734
  848   2HB   TYR  97          HB1       TYR  97   0.942 -15.906  -2.199
  849    HD1  TYR  97           HD1      TYR  97  -1.278 -13.942  -3.649
  850    HD2  TYR  97           HD2      TYR  97   1.380 -13.714  -0.283
  851    HE1  TYR  97           HE1      TYR  97  -2.764 -12.272  -2.589
  852    HE2  TYR  97           HE2      TYR  97  -0.107 -12.041   0.779
  853    HH   TYR  97           HH       TYR  97  -3.220 -11.557  -0.079
  854    H    LEU  98           HN       LEU  98   2.684 -13.685  -5.031
  855    HA   LEU  98           HA       LEU  98   3.579 -16.012  -6.387
  856   1HB   LEU  98          HB2       LEU  98   2.598 -14.016  -7.497
  857   2HB   LEU  98          HB1       LEU  98   4.049 -13.099  -7.110
  858    HG   LEU  98           HG       LEU  98   3.852 -14.139  -9.479
  859   1HD1  LEU  98          HD11      LEU  98   5.981 -13.407  -7.934
  860   2HD1  LEU  98          HD12      LEU  98   6.108 -13.912  -9.618
  861   3HD1  LEU  98          HD13      LEU  98   6.404 -15.074  -8.326
  862   1HD2  LEU  98          HD21      LEU  98   4.940 -16.591  -8.104
  863   2HD2  LEU  98          HD22      LEU  98   4.326 -16.429  -9.749
  864   3HD2  LEU  98          HD23      LEU  98   3.208 -16.414  -8.385
  865    H    ASP  99           HN       ASP  99   5.459 -13.220  -5.165
  866    HA   ASP  99           HA       ASP  99   8.027 -14.198  -5.950
  867   1HB   ASP  99          HB2       ASP  99   7.423 -11.841  -5.165
  868   2HB   ASP  99          HB1       ASP  99   7.489 -12.474  -3.521
  869    H    GLU 100           HN       GLU 100   6.205 -14.572  -2.894
  870    HA   GLU 100           HA       GLU 100   8.255 -16.011  -1.494
  871   1HB   GLU 100          HB2       GLU 100   5.964 -14.929  -0.681
  872   2HB   GLU 100          HB1       GLU 100   5.366 -16.568  -0.939
  873   1HG   GLU 100          HG2       GLU 100   7.945 -16.467   0.474
  874   2HG   GLU 100          HG1       GLU 100   6.628 -15.691   1.352
  875    H    LEU 101           HN       LEU 101   5.293 -17.255  -3.118
  876    HA   LEU 101           HA       LEU 101   6.790 -19.682  -3.912
  877   1HB   LEU 101          HB2       LEU 101   5.168 -21.212  -2.912
  878   2HB   LEU 101          HB1       LEU 101   5.854 -20.184  -1.655
  879    HG   LEU 101           HG       LEU 101   3.559 -18.862  -2.774
  880   1HD1  LEU 101          HD11      LEU 101   1.842 -20.539  -2.013
  881   2HD1  LEU 101          HD12      LEU 101   3.135 -21.732  -1.892
  882   3HD1  LEU 101          HD13      LEU 101   2.726 -21.031  -3.458
  883   1HD2  LEU 101          HD21      LEU 101   2.768 -19.217  -0.355
  884   2HD2  LEU 101          HD22      LEU 101   4.296 -18.361  -0.564
  885   3HD2  LEU 101          HD23      LEU 101   4.295 -20.061  -0.096
  886    H    LEU 102           HN       LEU 102   4.795 -21.225  -4.920
  887    HA   LEU 102           HA       LEU 102   3.169 -21.450  -6.596
  888   1HB   LEU 102          HB2       LEU 102   2.271 -19.240  -5.324
  889   2HB   LEU 102          HB1       LEU 102   2.683 -18.528  -6.883
  890    HG   LEU 102           HG       LEU 102   1.132 -21.096  -6.826
  891   1HD1  LEU 102          HD11      LEU 102  -0.973 -19.790  -6.744
  892   2HD1  LEU 102          HD12      LEU 102  -0.042 -18.326  -6.429
  893   3HD1  LEU 102          HD13      LEU 102  -0.057 -19.633  -5.245
  894   1HD2  LEU 102          HD21      LEU 102   1.366 -18.686  -8.644
  895   2HD2  LEU 102          HD22      LEU 102   0.113 -19.908  -8.858
  896   3HD2  LEU 102          HD23      LEU 102   1.813 -20.356  -8.995
  Start of MODEL    2
    1   1H    MET   1          HT1       MET   1 -15.840 -17.012 -22.837
    2   2H    MET   1          HT2       MET   1 -17.276 -16.294 -23.391
    3   3H    MET   1          HT3       MET   1 -16.551 -15.752 -21.952
    4    HA   MET   1           HA       MET   1 -15.441 -15.487 -24.696
    5   1HB   MET   1          HB2       MET   1 -17.203 -13.849 -23.103
    6   2HB   MET   1          HB1       MET   1 -15.671 -13.007 -23.336
    7   1HG   MET   1          HG2       MET   1 -15.843 -13.488 -25.790
    8   2HG   MET   1          HG1       MET   1 -17.444 -14.169 -25.504
    9   1HE   MET   1          HE1       MET   1 -16.902 -11.529 -27.534
   10   2HE   MET   1          HE2       MET   1 -15.453 -11.516 -26.533
   11   3HE   MET   1          HE3       MET   1 -16.479 -10.086 -26.601
   12    H    ALA   2           HN       ALA   2 -13.251 -15.435 -24.707
   13    HA   ALA   2           HA       ALA   2 -11.836 -14.543 -22.226
   14   1HB   ALA   2          HB1       ALA   2 -10.084 -16.249 -22.741
   15   2HB   ALA   2          HB2       ALA   2 -11.106 -16.865 -24.040
   16   3HB   ALA   2          HB3       ALA   2 -11.647 -16.973 -22.365
   17    H    GLU   3           HN       GLU   3 -10.863 -12.658 -22.756
   18    HA   GLU   3           HA       GLU   3  -9.420 -12.499 -25.373
   19   1HB   GLU   3          HB2       GLU   3 -11.574 -11.133 -25.274
   20   2HB   GLU   3          HB1       GLU   3 -10.791 -10.152 -24.036
   21   1HG   GLU   3          HG2       GLU   3 -10.407  -9.029 -26.118
   22   2HG   GLU   3          HG1       GLU   3  -8.882  -9.803 -25.688
   23    H    GLN   4           HN       GLN   4  -7.401 -11.463 -25.294
   24    HA   GLN   4           HA       GLN   4  -5.969 -11.534 -22.817
   25   1HB   GLN   4          HB2       GLN   4  -5.412 -10.732 -25.603
   26   2HB   GLN   4          HB1       GLN   4  -4.453  -9.875 -24.395
   27   1HG   GLN   4          HG2       GLN   4  -3.818 -12.064 -23.389
   28   2HG   GLN   4          HG1       GLN   4  -4.705 -12.885 -24.674
   29   1HE2  GLN   4          HE21      GLN   4  -1.924 -10.693 -24.100
   30   2HE2  GLN   4          HE22      GLN   4  -1.120 -11.082 -25.543
   31    H    GLN   5           HN       GLN   5  -5.332  -9.873 -21.412
   32    HA   GLN   5           HA       GLN   5  -7.122  -7.605 -21.194
   33   1HB   GLN   5          HB2       GLN   5  -5.138  -8.899 -19.552
   34   2HB   GLN   5          HB1       GLN   5  -4.834  -7.162 -19.572
   35   1HG   GLN   5          HG2       GLN   5  -7.578  -8.340 -19.075
   36   2HG   GLN   5          HG1       GLN   5  -6.449  -7.964 -17.774
   37   1HE2  GLN   5          HE21      GLN   5  -8.823  -6.606 -19.889
   38   2HE2  GLN   5          HE22      GLN   5  -8.570  -4.978 -19.483
   39    H    GLN   6           HN       GLN   6  -6.942  -5.758 -22.332
   40    HA   GLN   6           HA       GLN   6  -4.258  -4.625 -22.887
   41   1HB   GLN   6          HB2       GLN   6  -6.100  -5.743 -24.910
   42   2HB   GLN   6          HB1       GLN   6  -5.510  -4.121 -25.272
   43   1HG   GLN   6          HG2       GLN   6  -3.194  -5.258 -24.476
   44   2HG   GLN   6          HG1       GLN   6  -4.015  -6.686 -25.106
   45   1HE2  GLN   6          HE21      GLN   6  -4.734  -6.600 -27.419
   46   2HE2  GLN   6          HE22      GLN   6  -3.957  -5.549 -28.500
   47    H    GLU   7           HN       GLU   7  -7.771  -4.132 -23.453
   48    HA   GLU   7           HA       GLU   7  -7.534  -1.235 -23.384
   49   1HB   GLU   7          HB2       GLU   7  -9.931  -3.082 -23.209
   50   2HB   GLU   7          HB1       GLU   7 -10.050  -1.325 -23.280
   51   1HG   GLU   7          HG2       GLU   7  -9.765  -1.338 -25.513
   52   2HG   GLU   7          HG1       GLU   7  -8.284  -2.282 -25.361
   53    H    GLN   8           HN       GLN   8  -8.489   0.148 -21.723
   54    HA   GLN   8           HA       GLN   8  -8.021  -0.927 -19.007
   55   1HB   GLN   8          HB2       GLN   8  -7.463   1.514 -20.193
   56   2HB   GLN   8          HB1       GLN   8  -8.886   1.871 -19.214
   57   1HG   GLN   8          HG2       GLN   8  -7.132   0.201 -17.680
   58   2HG   GLN   8          HG1       GLN   8  -6.192   1.543 -18.334
   59   1HE2  GLN   8          HE21      GLN   8  -9.090   0.790 -16.369
   60   2HE2  GLN   8          HE22      GLN   8  -9.161   2.306 -15.607
   61    H    GLN   9           HN       GLN   9  -9.665  -1.520 -17.695
   62    HA   GLN   9           HA       GLN   9 -12.387  -0.386 -18.164
   63   1HB   GLN   9          HB2       GLN   9 -11.519  -3.180 -18.434
   64   2HB   GLN   9          HB1       GLN   9 -12.884  -2.985 -17.335
   65   1HG   GLN   9          HG2       GLN   9 -14.292  -2.587 -19.047
   66   2HG   GLN   9          HG1       GLN   9 -13.234  -1.334 -19.694
   67   1HE2  GLN   9          HE21      GLN   9 -11.555  -2.006 -21.258
   68   2HE2  GLN   9          HE22      GLN   9 -11.681  -3.490 -22.072
   69    H    ILE  10           HN       ILE  10 -13.781  -1.560 -16.139
   70    HA   ILE  10           HA       ILE  10 -12.886  -0.198 -13.805
   71    HB   ILE  10           HB       ILE  10 -14.645  -1.569 -12.619
   72   1HG1  ILE  10          HG12      ILE  10 -15.791  -2.630 -15.082
   73   2HG1  ILE  10          HG11      ILE  10 -14.211  -3.342 -14.758
   74   1HG2  ILE  10          HG21      ILE  10 -14.942   0.559 -14.155
   75   2HG2  ILE  10          HG22      ILE  10 -16.357  -0.305 -13.550
   76   3HG2  ILE  10          HG23      ILE  10 -15.798  -0.575 -15.201
   77   1HD1  ILE  10          HD11      ILE  10 -15.787  -4.722 -13.611
   78   2HD1  ILE  10          HD12      ILE  10 -16.640  -3.323 -12.958
   79   3HD1  ILE  10          HD13      ILE  10 -15.027  -3.729 -12.367
   80    H    ARG  11           HN       ARG  11 -10.858  -0.735 -13.110
   81    HA   ARG  11           HA       ARG  11 -10.500  -3.148 -11.549
   82   1HB   ARG  11          HB2       ARG  11  -9.698  -3.193 -14.353
   83   2HB   ARG  11          HB1       ARG  11  -8.317  -3.453 -13.291
   84   1HG   ARG  11          HG2       ARG  11 -10.925  -4.957 -12.983
   85   2HG   ARG  11          HG1       ARG  11  -9.588  -5.552 -13.965
   86   1HD   ARG  11          HD2       ARG  11  -8.284  -6.037 -12.143
   87   2HD   ARG  11          HD1       ARG  11  -8.908  -4.682 -11.203
   88    HE   ARG  11           HE       ARG  11 -10.141  -7.364 -11.399
   89   1HH1  ARG  11          HH21      ARG  11 -12.349  -5.409 -11.470
   90   2HH1  ARG  11          HH22      ARG  11 -12.653  -5.100  -9.794
   91   1HH2  ARG  11          HH11      ARG  11  -9.613  -6.403  -8.731
   92   2HH2  ARG  11          HH12      ARG  11 -11.100  -5.664  -8.239
   93    H    VAL  12           HN       VAL  12  -7.720  -3.236 -11.403
   94    HA   VAL  12           HA       VAL  12  -7.104  -0.510 -10.365
   95    HB   VAL  12           HB       VAL  12  -5.169  -1.765  -9.219
   96   1HG1  VAL  12          HG11      VAL  12  -7.274  -0.987  -8.120
   97   2HG1  VAL  12          HG12      VAL  12  -6.597  -2.441  -7.388
   98   3HG1  VAL  12          HG13      VAL  12  -7.988  -2.562  -8.464
   99   1HG2  VAL  12          HG21      VAL  12  -5.504  -3.799 -10.756
  100   2HG2  VAL  12          HG22      VAL  12  -6.906  -4.180  -9.758
  101   3HG2  VAL  12          HG23      VAL  12  -5.299  -4.134  -9.036
  102    H    ARG  13           HN       ARG  13  -4.475  -0.318 -10.363
  103    HA   ARG  13           HA       ARG  13  -3.132  -1.249 -12.752
  104   1HB   ARG  13          HB2       ARG  13  -2.980   0.902 -13.943
  105   2HB   ARG  13          HB1       ARG  13  -4.660   0.385 -13.813
  106   1HG   ARG  13          HG2       ARG  13  -4.784   1.835 -11.699
  107   2HG   ARG  13          HG1       ARG  13  -3.243   2.522 -12.208
  108   1HD   ARG  13          HD2       ARG  13  -5.553   2.394 -14.134
  109   2HD   ARG  13          HD1       ARG  13  -5.446   3.704 -12.960
  110    HE   ARG  13           HE       ARG  13  -3.072   4.046 -13.991
  111   1HH1  ARG  13          HH21      ARG  13  -3.404   1.955 -16.105
  112   2HH1  ARG  13          HH22      ARG  13  -3.967   2.883 -17.456
  113   1HH2  ARG  13          HH11      ARG  13  -4.851   5.640 -15.536
  114   2HH2  ARG  13          HH12      ARG  13  -4.788   4.973 -17.133
  115    H    ILE  14           HN       ILE  14  -0.904  -0.620 -12.766
  116    HA   ILE  14           HA       ILE  14   0.008   1.145 -10.559
  117    HB   ILE  14           HB       ILE  14   0.093  -1.040  -9.542
  118   1HG1  ILE  14          HG12      ILE  14   2.658  -1.378  -9.425
  119   2HG1  ILE  14          HG11      ILE  14   2.756   0.008 -10.511
  120   1HG2  ILE  14          HG21      ILE  14   1.781  -2.020 -11.848
  121   2HG2  ILE  14          HG22      ILE  14   0.033  -2.245 -11.795
  122   3HG2  ILE  14          HG23      ILE  14   1.054  -2.969 -10.554
  123   1HD1  ILE  14          HD11      ILE  14   2.933   0.737  -8.167
  124   2HD1  ILE  14          HD12      ILE  14   1.384  -0.025  -7.805
  125   3HD1  ILE  14          HD13      ILE  14   1.453   1.359  -8.897
  126    HA   PRO  15           HA       PRO  15   2.476   2.286 -14.128
  127   1HB   PRO  15          HB2       PRO  15   3.219   4.717 -13.080
  128   2HB   PRO  15          HB1       PRO  15   1.668   4.429 -13.887
  129   1HG   PRO  15          HG2       PRO  15   2.236   4.756 -10.979
  130   2HG   PRO  15          HG1       PRO  15   0.744   5.086 -11.875
  131   1HD   PRO  15          HD2       PRO  15   1.247   2.808 -10.269
  132   2HD   PRO  15          HD1       PRO  15  -0.095   3.004 -11.418
  133    H    ARG  16           HN       ARG  16   3.513   2.563 -10.717
  134    HA   ARG  16           HA       ARG  16   6.323   2.817 -11.187
  135   1HB   ARG  16          HB2       ARG  16   4.860   1.551  -8.845
  136   2HB   ARG  16          HB1       ARG  16   6.570   1.979  -8.853
  137   1HG   ARG  16          HG2       ARG  16   6.128   4.282  -8.908
  138   2HG   ARG  16          HG1       ARG  16   4.488   4.050  -9.518
  139   1HD   ARG  16          HD2       ARG  16   4.440   2.670  -7.121
  140   2HD   ARG  16          HD1       ARG  16   5.464   4.056  -6.748
  141    HE   ARG  16           HE       ARG  16   2.639   4.222  -7.683
  142   1HH1  ARG  16          HH21      ARG  16   4.092   6.620  -8.556
  143   2HH1  ARG  16          HH22      ARG  16   3.976   7.677  -7.189
  144   1HH2  ARG  16          HH11      ARG  16   3.098   5.145  -4.975
  145   2HH2  ARG  16          HH12      ARG  16   3.412   6.840  -5.155
  146    H    LYS  17           HN       LYS  17   7.725   1.343 -12.015
  147    HA   LYS  17           HA       LYS  17   6.954  -1.548 -11.905
  148   1HB   LYS  17          HB2       LYS  17   8.099  -1.848 -14.048
  149   2HB   LYS  17          HB1       LYS  17   6.867  -0.598 -14.196
  150   1HG   LYS  17          HG2       LYS  17   9.523   0.404 -13.377
  151   2HG   LYS  17          HG1       LYS  17   9.474  -0.298 -14.994
  152   1HD   LYS  17          HD2       LYS  17   8.257   1.421 -15.823
  153   2HD   LYS  17          HD1       LYS  17   7.174   1.434 -14.431
  154   1HE   LYS  17          HE2       LYS  17   8.257   3.194 -13.538
  155   2HE   LYS  17          HE1       LYS  17   9.799   2.345 -13.638
  156   1HZ   LYS  17          HZ1       LYS  17   9.829   4.373 -14.942
  157   2HZ   LYS  17          HZ2       LYS  17   8.494   3.842 -15.849
  158   3HZ   LYS  17          HZ3       LYS  17   9.977   3.019 -15.954
  159    H    GLU  18           HN       GLU  18   8.819   0.331 -10.201
  160    HA   GLU  18           HA       GLU  18  11.444  -0.944 -10.571
  161   1HB   GLU  18          HB2       GLU  18  10.423   0.948  -8.429
  162   2HB   GLU  18          HB1       GLU  18  12.099   0.428  -8.606
  163   1HG   GLU  18          HG2       GLU  18  12.395   2.167 -10.010
  164   2HG   GLU  18          HG1       GLU  18  11.365   1.315 -11.161
  165    H    GLU  19           HN       GLU  19  12.508  -1.984  -8.622
  166    HA   GLU  19           HA       GLU  19  10.564  -3.829  -7.317
  167   1HB   GLU  19          HB2       GLU  19  13.559  -4.031  -7.774
  168   2HB   GLU  19          HB1       GLU  19  12.628  -5.207  -6.847
  169   1HG   GLU  19          HG2       GLU  19  12.337  -6.255  -8.843
  170   2HG   GLU  19          HG1       GLU  19  11.130  -5.005  -9.142
  171    H    ASN  20           HN       ASN  20  10.306  -1.546  -6.076
  172    HA   ASN  20           HA       ASN  20  11.690  -1.931  -3.485
  173   1HB   ASN  20          HB2       ASN  20  12.302   0.206  -5.353
  174   2HB   ASN  20          HB1       ASN  20  11.663   0.866  -3.848
  175   1HD2  ASN  20          HD21      ASN  20  12.812   0.256  -1.811
  176   2HD2  ASN  20          HD22      ASN  20  14.438  -0.228  -1.877
  177    H    GLU  21           HN       GLU  21   9.041  -2.550  -4.084
  178    HA   GLU  21           HA       GLU  21   7.460  -0.296  -2.918
  179   1HB   GLU  21          HB2       GLU  21   6.837  -1.386  -5.188
  180   2HB   GLU  21          HB1       GLU  21   6.301  -2.760  -4.222
  181   1HG   GLU  21          HG2       GLU  21   4.325  -1.581  -4.250
  182   2HG   GLU  21          HG1       GLU  21   5.068  -0.807  -2.852
  183    H    ILE  22           HN       ILE  22   6.524  -0.564  -0.918
  184    HA   ILE  22           HA       ILE  22   6.765  -3.277   0.344
  185    HB   ILE  22           HB       ILE  22   6.462  -1.670   2.485
  186   1HG1  ILE  22          HG12      ILE  22   6.483   0.318   0.769
  187   2HG1  ILE  22          HG11      ILE  22   7.418   0.465   2.248
  188   1HG2  ILE  22          HG21      ILE  22   8.788  -2.699   0.960
  189   2HG2  ILE  22          HG22      ILE  22   8.279  -3.041   2.613
  190   3HG2  ILE  22          HG23      ILE  22   9.135  -1.544   2.246
  191   1HD1  ILE  22          HD11      ILE  22   8.512   1.027  -0.101
  192   2HD1  ILE  22          HD12      ILE  22   8.748  -0.719  -0.163
  193   3HD1  ILE  22          HD13      ILE  22   9.451   0.219   1.154
  194    H    LEU  23           HN       LEU  23   4.938  -3.805   1.940
  195    HA   LEU  23           HA       LEU  23   2.444  -2.319   1.027
  196   1HB   LEU  23          HB2       LEU  23   3.040  -4.986   0.510
  197   2HB   LEU  23          HB1       LEU  23   1.961  -5.068   1.900
  198    HG   LEU  23           HG       LEU  23   0.738  -5.121  -0.272
  199   1HD1  LEU  23          HD11      LEU  23  -0.169  -2.526   0.690
  200   2HD1  LEU  23          HD12      LEU  23   0.181  -3.627   2.021
  201   3HD1  LEU  23          HD13      LEU  23  -0.973  -4.093   0.775
  202   1HD2  LEU  23          HD21      LEU  23   1.228  -3.666  -1.926
  203   2HD2  LEU  23          HD22      LEU  23   2.561  -3.076  -0.938
  204   3HD2  LEU  23          HD23      LEU  23   0.985  -2.289  -0.852
  205    H    GLY  24           HN       GLY  24   1.093  -1.574   2.749
  206   1HA   GLY  24          HA2       GLY  24   1.630  -2.841   5.395
  207   2HA   GLY  24          HA1       GLY  24   1.821  -1.102   5.251
  208    H    ILE  25           HN       ILE  25   0.047  -2.491   7.008
  209    HA   ILE  25           HA       ILE  25  -2.634  -1.797   5.902
  210    HB   ILE  25           HB       ILE  25  -3.608  -3.081   7.662
  211   1HG1  ILE  25          HG12      ILE  25  -1.734  -4.116   9.340
  212   2HG1  ILE  25          HG11      ILE  25  -1.018  -2.540   9.011
  213   1HG2  ILE  25          HG21      ILE  25  -2.349  -4.366   5.852
  214   2HG2  ILE  25          HG22      ILE  25  -2.681  -5.258   7.336
  215   3HG2  ILE  25          HG23      ILE  25  -1.070  -4.604   7.042
  216   1HD1  ILE  25          HD11      ILE  25  -3.828  -2.175   9.444
  217   2HD1  ILE  25          HD12      ILE  25  -2.485  -1.564  10.410
  218   3HD1  ILE  25          HD13      ILE  25  -3.181  -3.144  10.768
  219    H    ILE  26           HN       ILE  26  -3.730  -0.024   6.783
  220    HA   ILE  26           HA       ILE  26  -2.047   1.667   8.548
  221    HB   ILE  26           HB       ILE  26  -3.872   3.419   7.952
  222   1HG1  ILE  26          HG12      ILE  26  -4.197   1.479   5.640
  223   2HG1  ILE  26          HG11      ILE  26  -5.406   1.738   6.899
  224   1HG2  ILE  26          HG21      ILE  26  -1.725   2.335   6.161
  225   2HG2  ILE  26          HG22      ILE  26  -1.691   3.763   7.196
  226   3HG2  ILE  26          HG23      ILE  26  -2.650   3.768   5.716
  227   1HD1  ILE  26          HD11      ILE  26  -6.195   3.311   5.442
  228   2HD1  ILE  26          HD12      ILE  26  -4.642   3.479   4.628
  229   3HD1  ILE  26          HD13      ILE  26  -4.929   4.307   6.158
  230    H    GLU  27           HN       GLU  27  -2.725   2.594  10.348
  231    HA   GLU  27           HA       GLU  27  -5.385   1.934  11.489
  232   1HB   GLU  27          HB2       GLU  27  -3.112   0.485  12.197
  233   2HB   GLU  27          HB1       GLU  27  -3.250   1.690  13.477
  234   1HG   GLU  27          HG2       GLU  27  -5.245   0.847  14.247
  235   2HG   GLU  27          HG1       GLU  27  -5.766   0.332  12.643
  236    H    GLN  28           HN       GLN  28  -6.191   3.630  12.689
  237    HA   GLN  28           HA       GLN  28  -4.336   5.746  13.634
  238   1HB   GLN  28          HB2       GLN  28  -5.243   6.294  11.294
  239   2HB   GLN  28          HB1       GLN  28  -6.816   6.474  12.068
  240   1HG   GLN  28          HG2       GLN  28  -5.765   8.113  13.666
  241   2HG   GLN  28          HG1       GLN  28  -4.289   8.024  12.705
  242   1HE2  GLN  28          HE21      GLN  28  -4.151   9.722  11.235
  243   2HE2  GLN  28          HE22      GLN  28  -5.471  10.453  10.458
  244    H    MET  29           HN       MET  29  -4.832   5.286  15.776
  245    HA   MET  29           HA       MET  29  -7.672   5.217  16.623
  246   1HB   MET  29          HB2       MET  29  -5.249   4.065  17.594
  247   2HB   MET  29          HB1       MET  29  -5.842   5.165  18.838
  248   1HG   MET  29          HG2       MET  29  -8.120   3.808  17.874
  249   2HG   MET  29          HG1       MET  29  -6.874   2.575  18.061
  250   1HE   MET  29          HE1       MET  29  -9.651   2.778  19.795
  251   2HE   MET  29          HE2       MET  29  -9.539   4.511  19.494
  252   3HE   MET  29          HE3       MET  29  -9.585   3.914  21.151
  253    H    LEU  30           HN       LEU  30  -4.714   7.140  17.127
  254    HA   LEU  30           HA       LEU  30  -6.432   9.452  17.889
  255   1HB   LEU  30          HB2       LEU  30  -3.944   8.522  19.365
  256   2HB   LEU  30          HB1       LEU  30  -4.772  10.051  19.663
  257    HG   LEU  30           HG       LEU  30  -6.240   7.415  19.801
  258   1HD1  LEU  30          HD11      LEU  30  -5.197   8.797  22.254
  259   2HD1  LEU  30          HD12      LEU  30  -4.148   7.683  21.376
  260   3HD1  LEU  30          HD13      LEU  30  -5.678   7.114  22.044
  261   1HD2  LEU  30          HD21      LEU  30  -7.626   9.415  19.672
  262   2HD2  LEU  30          HD22      LEU  30  -6.697  10.182  20.960
  263   3HD2  LEU  30          HD23      LEU  30  -7.704   8.778  21.314
  264    H    GLY  31           HN       GLY  31  -5.577   9.282  15.364
  265   1HA   GLY  31          HA2       GLY  31  -3.087  10.942  15.212
  266   2HA   GLY  31          HA1       GLY  31  -3.616   9.855  13.930
  267    H    ALA  32           HN       ALA  32  -3.086  12.614  13.495
  268    HA   ALA  32           HA       ALA  32  -5.818  13.768  13.119
  269   1HB   ALA  32          HB1       ALA  32  -4.509  15.317  14.345
  270   2HB   ALA  32          HB2       ALA  32  -4.447  15.913  12.686
  271   3HB   ALA  32          HB3       ALA  32  -3.080  15.021  13.354
  272    H    SER  33           HN       SER  33  -2.720  14.241  11.378
  273    HA   SER  33           HA       SER  33  -4.222  13.845   8.825
  274   1HB   SER  33          HB2       SER  33  -1.831  15.492   9.584
  275   2HB   SER  33          HB1       SER  33  -2.016  14.962   7.915
  276    HG   SER  33           HG       SER  33  -3.336  16.582   7.754
  277    H    ARG  34           HN       ARG  34  -1.355  12.817  10.637
  278    HA   ARG  34           HA       ARG  34  -0.666  10.934   8.444
  279   1HB   ARG  34          HB2       ARG  34   1.447  10.603   9.587
  280   2HB   ARG  34          HB1       ARG  34   1.143  12.330   9.436
  281   1HG   ARG  34          HG2       ARG  34  -0.031  11.891  11.830
  282   2HG   ARG  34          HG1       ARG  34   1.195  10.624  11.871
  283   1HD   ARG  34          HD2       ARG  34   2.603  12.250  12.584
  284   2HD   ARG  34          HD1       ARG  34   2.610  12.790  10.904
  285    HE   ARG  34           HE       ARG  34   0.683  13.887  12.916
  286   1HH1  ARG  34          HH21      ARG  34   0.253  14.694  10.096
  287   2HH1  ARG  34          HH22      ARG  34   1.167  16.160   9.972
  288   1HH2  ARG  34          HH11      ARG  34   3.014  15.564  12.855
  289   2HH2  ARG  34          HH12      ARG  34   2.733  16.654  11.539
  290    H    VAL  35           HN       VAL  35  -0.569   8.728   8.772
  291    HA   VAL  35           HA       VAL  35  -1.933   7.680  11.204
  292    HB   VAL  35           HB       VAL  35  -2.233   7.227   8.302
  293   1HG1  VAL  35          HG11      VAL  35  -1.207   5.100   8.901
  294   2HG1  VAL  35          HG12      VAL  35  -2.923   4.882   8.562
  295   3HG1  VAL  35          HG13      VAL  35  -2.351   4.908  10.228
  296   1HG2  VAL  35          HG21      VAL  35  -4.460   6.279   9.570
  297   2HG2  VAL  35          HG22      VAL  35  -4.214   7.962   9.104
  298   3HG2  VAL  35          HG23      VAL  35  -3.845   7.438  10.746
  299    H    ARG  36           HN       ARG  36  -1.172   5.436  11.797
  300    HA   ARG  36           HA       ARG  36   1.752   5.172  11.167
  301   1HB   ARG  36          HB2       ARG  36   1.151   5.295  13.563
  302   2HB   ARG  36          HB1       ARG  36   0.178   3.845  13.382
  303   1HG   ARG  36          HG2       ARG  36   2.860   3.485  12.309
  304   2HG   ARG  36          HG1       ARG  36   2.899   3.952  14.009
  305   1HD   ARG  36          HD2       ARG  36   0.867   1.915  13.311
  306   2HD   ARG  36          HD1       ARG  36   2.543   1.387  13.159
  307    HE   ARG  36           HE       ARG  36   1.152   1.853  15.643
  308   1HH1  ARG  36          HH21      ARG  36   3.659   0.149  15.051
  309   2HH1  ARG  36          HH22      ARG  36   4.828   0.950  16.048
  310   1HH2  ARG  36          HH11      ARG  36   2.881   3.791  16.503
  311   2HH2  ARG  36          HH12      ARG  36   4.386   3.017  16.873
  312    H    VAL  37           HN       VAL  37   2.536   3.205  10.299
  313    HA   VAL  37           HA       VAL  37   0.437   1.260   9.503
  314    HB   VAL  37           HB       VAL  37   2.305   2.913   7.940
  315   1HG1  VAL  37          HG11      VAL  37   3.308   0.827   7.443
  316   2HG1  VAL  37          HG12      VAL  37   2.263   1.233   6.082
  317   3HG1  VAL  37          HG13      VAL  37   1.736   0.046   7.276
  318   1HG2  VAL  37          HG21      VAL  37  -0.297   2.928   8.099
  319   2HG2  VAL  37          HG22      VAL  37  -0.180   1.592   6.954
  320   3HG2  VAL  37          HG23      VAL  37   0.482   3.173   6.536
  321    H    ARG  38           HN       ARG  38   1.062  -0.789   9.359
  322    HA   ARG  38           HA       ARG  38   3.885  -1.527  10.126
  323   1HB   ARG  38          HB2       ARG  38   2.811  -3.810  10.696
  324   2HB   ARG  38          HB1       ARG  38   2.508  -2.492  11.819
  325   1HG   ARG  38          HG2       ARG  38   0.293  -2.173  11.025
  326   2HG   ARG  38          HG1       ARG  38   0.601  -3.109   9.562
  327   1HD   ARG  38          HD2       ARG  38   0.109  -5.059  10.595
  328   2HD   ARG  38          HD1       ARG  38   1.121  -4.661  11.983
  329    HE   ARG  38           HE       ARG  38  -1.761  -4.294  11.811
  330   1HH1  ARG  38          HH11      ARG  38   0.098  -4.877  14.236
  331   2HH1  ARG  38          HH12      ARG  38  -0.173  -3.446  15.174
  332   1HH2  ARG  38          HH21      ARG  38  -1.647  -1.689  12.567
  333   2HH2  ARG  38          HH22      ARG  38  -1.163  -1.640  14.229
  334    H    CYS  39           HN       CYS  39   4.916  -2.957   8.575
  335    HA   CYS  39           HA       CYS  39   3.149  -3.639   6.277
  336   1HB   CYS  39          HB2       CYS  39   4.094  -2.113   4.945
  337   2HB   CYS  39          HB1       CYS  39   4.917  -1.475   6.363
  338    HG   CYS  39           HG       CYS  39   6.188  -3.332   4.236
  339    H    LEU  40           HN       LEU  40   3.848  -5.134   4.834
  340    HA   LEU  40           HA       LEU  40   5.672  -7.196   5.825
  341   1HB   LEU  40          HB2       LEU  40   3.241  -7.427   4.803
  342   2HB   LEU  40          HB1       LEU  40   4.108  -7.372   3.278
  343    HG   LEU  40           HG       LEU  40   5.409  -9.312   3.885
  344   1HD1  LEU  40          HD11      LEU  40   4.202  -8.826   6.602
  345   2HD1  LEU  40          HD12      LEU  40   5.886  -9.131   6.179
  346   3HD1  LEU  40          HD13      LEU  40   4.716 -10.449   6.142
  347   1HD2  LEU  40          HD21      LEU  40   3.141  -9.682   3.009
  348   2HD2  LEU  40          HD22      LEU  40   2.503  -9.667   4.652
  349   3HD2  LEU  40          HD23      LEU  40   3.593 -10.956   4.140
  350    H    ASP  41           HN       ASP  41   6.975  -8.164   3.979
  351    HA   ASP  41           HA       ASP  41   8.656  -7.926   2.342
  352   1HB   ASP  41          HB2       ASP  41   6.919  -6.046   1.397
  353   2HB   ASP  41          HB1       ASP  41   8.188  -4.987   2.007
  354    H    GLY  42           HN       GLY  42   8.341  -7.329   5.275
  355   1HA   GLY  42          HA2       GLY  42   9.698  -6.877   7.076
  356   2HA   GLY  42          HA1       GLY  42  11.028  -6.764   5.945
  357    H    LYS  43           HN       LYS  43   8.156  -4.565   6.660
  358    HA   LYS  43           HA       LYS  43  10.198  -2.575   7.465
  359   1HB   LYS  43          HB2       LYS  43   8.689  -2.413   4.951
  360   2HB   LYS  43          HB1       LYS  43   8.713  -0.933   5.902
  361   1HG   LYS  43          HG2       LYS  43  10.761  -0.558   5.015
  362   2HG   LYS  43          HG1       LYS  43  11.330  -1.846   6.076
  363   1HD   LYS  43          HD2       LYS  43  10.654  -3.478   4.226
  364   2HD   LYS  43          HD1       LYS  43  10.488  -2.068   3.182
  365   1HE   LYS  43          HE2       LYS  43  12.821  -1.448   3.599
  366   2HE   LYS  43          HE1       LYS  43  13.001  -2.806   4.708
  367   1HZ   LYS  43          HZ1       LYS  43  13.838  -3.235   2.429
  368   2HZ   LYS  43          HZ2       LYS  43  12.247  -3.091   1.851
  369   3HZ   LYS  43          HZ3       LYS  43  12.650  -4.335   2.936
  370    H    THR  44           HN       THR  44   9.413  -0.788   8.619
  371    HA   THR  44           HA       THR  44   6.542  -0.814   9.422
  372    HB   THR  44           HB       THR  44   8.501  -0.146  11.563
  373    HG1  THR  44           HG1      THR  44   9.446  -2.025  11.015
  374   1HG2  THR  44          HG21      THR  44   6.074   0.010  11.896
  375   2HG2  THR  44          HG22      THR  44   6.774  -1.219  12.949
  376   3HG2  THR  44          HG23      THR  44   5.907  -1.698  11.490
  377    H    ARG  45           HN       ARG  45   5.791   1.169   8.874
  378    HA   ARG  45           HA       ARG  45   7.521   3.523   9.388
  379   1HB   ARG  45          HB2       ARG  45   6.804   4.314   6.987
  380   2HB   ARG  45          HB1       ARG  45   8.186   3.240   7.181
  381   1HG   ARG  45          HG2       ARG  45   5.768   1.675   6.996
  382   2HG   ARG  45          HG1       ARG  45   5.867   2.781   5.631
  383   1HD   ARG  45          HD2       ARG  45   8.123   0.964   6.518
  384   2HD   ARG  45          HD1       ARG  45   7.012   0.601   5.198
  385    HE   ARG  45           HE       ARG  45   8.135   3.157   4.683
  386   1HH1  ARG  45          HH11      ARG  45   8.347  -0.028   3.750
  387   2HH1  ARG  45          HH12      ARG  45   9.980   0.046   3.181
  388   1HH2  ARG  45          HH21      ARG  45  10.585   3.201   4.482
  389   2HH2  ARG  45          HH22      ARG  45  11.248   1.865   3.604
  390    H    LEU  46           HN       LEU  46   6.375   5.588   9.036
  391    HA   LEU  46           HA       LEU  46   3.494   5.334   9.846
  392   1HB   LEU  46          HB2       LEU  46   4.966   7.964   9.590
  393   2HB   LEU  46          HB1       LEU  46   3.647   7.539  10.676
  394    HG   LEU  46           HG       LEU  46   6.441   6.379  10.894
  395   1HD1  LEU  46          HD11      LEU  46   5.778   8.108  13.068
  396   2HD1  LEU  46          HD12      LEU  46   5.497   8.995  11.570
  397   3HD1  LEU  46          HD13      LEU  46   7.081   8.290  11.893
  398   1HD2  LEU  46          HD21      LEU  46   5.582   5.087  12.539
  399   2HD2  LEU  46          HD22      LEU  46   3.982   5.582  11.988
  400   3HD2  LEU  46          HD23      LEU  46   4.782   6.470  13.285
  401    H    GLY  47           HN       GLY  47   1.974   5.683   8.220
  402   1HA   GLY  47          HA2       GLY  47   3.001   6.486   5.564
  403   2HA   GLY  47          HA1       GLY  47   1.460   5.704   5.876
  404    H    ARG  48           HN       ARG  48   2.343   8.230   4.427
  405    HA   ARG  48           HA       ARG  48   0.720  10.239   5.879
  406   1HB   ARG  48          HB2       ARG  48   1.617  11.843   4.179
  407   2HB   ARG  48          HB1       ARG  48   2.858  11.091   5.172
  408   1HG   ARG  48          HG2       ARG  48   3.629   9.743   3.430
  409   2HG   ARG  48          HG1       ARG  48   2.095   9.812   2.564
  410   1HD   ARG  48          HD2       ARG  48   3.676  12.333   2.967
  411   2HD   ARG  48          HD1       ARG  48   4.139  11.211   1.688
  412    HE   ARG  48           HE       ARG  48   1.952  11.581   0.651
  413   1HH1  ARG  48          HH21      ARG  48   3.085  14.362   1.048
  414   2HH1  ARG  48          HH22      ARG  48   1.731  15.195   1.738
  415   1HH2  ARG  48          HH11      ARG  48   0.023  12.283   2.561
  416   2HH2  ARG  48          HH12      ARG  48  -0.005  14.014   2.596
  417    H    ILE  49           HN       ILE  49  -1.177  11.015   5.063
  418    HA   ILE  49           HA       ILE  49  -2.089   9.931   2.429
  419    HB   ILE  49           HB       ILE  49  -3.102   9.335   5.042
  420   1HG1  ILE  49          HG12      ILE  49  -4.438   8.687   2.412
  421   2HG1  ILE  49          HG11      ILE  49  -2.916   7.938   2.893
  422   1HG2  ILE  49          HG21      ILE  49  -5.245  10.612   3.336
  423   2HG2  ILE  49          HG22      ILE  49  -4.450  11.475   4.650
  424   3HG2  ILE  49          HG23      ILE  49  -5.380  10.017   4.989
  425   1HD1  ILE  49          HD11      ILE  49  -4.221   6.408   3.944
  426   2HD1  ILE  49          HD12      ILE  49  -5.640   7.454   3.895
  427   3HD1  ILE  49          HD13      ILE  49  -4.439   7.655   5.171
  428    HA   PRO  50           HA       PRO  50  -3.258  14.093   1.527
  429   1HB   PRO  50          HB2       PRO  50  -5.519  13.722   0.003
  430   2HB   PRO  50          HB1       PRO  50  -3.873  13.417  -0.579
  431   1HG   PRO  50          HG2       PRO  50  -5.970  11.456   0.245
  432   2HG   PRO  50          HG1       PRO  50  -4.646  11.263  -0.916
  433   1HD   PRO  50          HD2       PRO  50  -4.669  10.258   1.712
  434   2HD   PRO  50          HD1       PRO  50  -3.228  10.431   0.689
  435    H    GLY  51           HN       GLY  51  -6.114  12.148   2.537
  436   1HA   GLY  51          HA2       GLY  51  -6.984  13.209   4.797
  437   2HA   GLY  51          HA1       GLY  51  -7.294  14.595   3.756
  438    H    ARG  52           HN       ARG  52  -7.855  12.183   1.666
  439    HA   ARG  52           HA       ARG  52 -10.681  12.435   1.675
  440   1HB   ARG  52          HB2       ARG  52  -8.674  10.837   0.247
  441   2HB   ARG  52          HB1       ARG  52 -10.222  10.012   0.425
  442   1HG   ARG  52          HG2       ARG  52 -10.470  11.241  -1.575
  443   2HG   ARG  52          HG1       ARG  52 -11.279  12.237  -0.365
  444   1HD   ARG  52          HD2       ARG  52  -9.882  13.938  -0.823
  445   2HD   ARG  52          HD1       ARG  52  -8.505  12.934  -0.369
  446    HE   ARG  52           HE       ARG  52  -8.303  12.257  -2.717
  447   1HH1  ARG  52          HH21      ARG  52 -11.091  12.637  -3.656
  448   2HH1  ARG  52          HH22      ARG  52 -10.996  14.117  -4.551
  449   1HH2  ARG  52          HH11      ARG  52  -7.957  15.072  -3.161
  450   2HH2  ARG  52          HH12      ARG  52  -9.216  15.498  -4.270
  451    H    LEU  53           HN       LEU  53  -8.580  10.058   3.264
  452    HA   LEU  53           HA       LEU  53 -10.402   8.050   3.952
  453   1HB   LEU  53          HB2       LEU  53  -7.801   8.778   4.725
  454   2HB   LEU  53          HB1       LEU  53  -8.720   8.715   6.228
  455    HG   LEU  53           HG       LEU  53  -8.566   6.517   4.146
  456   1HD1  LEU  53          HD11      LEU  53  -6.573   6.994   5.737
  457   2HD1  LEU  53          HD12      LEU  53  -7.189   5.344   5.659
  458   3HD1  LEU  53          HD13      LEU  53  -7.633   6.388   7.010
  459   1HD2  LEU  53          HD21      LEU  53 -10.742   6.418   5.129
  460   2HD2  LEU  53          HD22      LEU  53 -10.112   6.797   6.732
  461   3HD2  LEU  53          HD23      LEU  53  -9.774   5.228   5.999
  462    H    LYS  54           HN       LYS  54  -9.926  11.200   5.564
  463    HA   LYS  54           HA       LYS  54 -11.640  10.741   7.798
  464   1HB   LYS  54          HB2       LYS  54 -10.949  13.306   6.336
  465   2HB   LYS  54          HB1       LYS  54 -11.820  13.250   7.868
  466   1HG   LYS  54          HG2       LYS  54  -9.928  12.870   9.045
  467   2HG   LYS  54          HG1       LYS  54  -9.384  11.630   7.915
  468   1HD   LYS  54          HD2       LYS  54  -8.278  13.163   6.550
  469   2HD   LYS  54          HD1       LYS  54  -9.268  14.517   7.096
  470   1HE   LYS  54          HE2       LYS  54  -7.482  13.097   9.054
  471   2HE   LYS  54          HE1       LYS  54  -6.796  14.296   7.959
  472   1HZ   LYS  54          HZ1       LYS  54  -8.414  14.679  10.280
  473   2HZ   LYS  54          HZ2       LYS  54  -9.065  15.476   8.930
  474   3HZ   LYS  54          HZ3       LYS  54  -7.475  15.800   9.426
  475    H    ASN  55           HN       ASN  55 -12.366  12.302   4.651
  476    HA   ASN  55           HA       ASN  55 -15.185  12.606   5.220
  477   1HB   ASN  55          HB2       ASN  55 -13.377  13.068   2.930
  478   2HB   ASN  55          HB1       ASN  55 -15.037  12.669   2.487
  479   1HD2  ASN  55          HD21      ASN  55 -13.142  14.924   4.557
  480   2HD2  ASN  55          HD22      ASN  55 -14.303  16.161   4.529
  481    H    ARG  56           HN       ARG  56 -13.273   9.936   4.030
  482    HA   ARG  56           HA       ARG  56 -15.510   8.564   2.749
  483   1HB   ARG  56          HB2       ARG  56 -12.769   8.312   2.609
  484   2HB   ARG  56          HB1       ARG  56 -13.222   6.908   3.574
  485   1HG   ARG  56          HG2       ARG  56 -14.897   7.477   1.179
  486   2HG   ARG  56          HG1       ARG  56 -13.265   6.882   0.880
  487   1HD   ARG  56          HD2       ARG  56 -14.346   4.858   1.105
  488   2HD   ARG  56          HD1       ARG  56 -13.951   5.149   2.798
  489    HE   ARG  56           HE       ARG  56 -16.255   5.499   3.227
  490   1HH1  ARG  56          HH11      ARG  56 -16.756   3.560   0.987
  491   2HH1  ARG  56          HH12      ARG  56 -17.877   4.434  -0.003
  492   1HH2  ARG  56          HH21      ARG  56 -17.184   7.503   1.468
  493   2HH2  ARG  56          HH22      ARG  56 -18.119   6.672   0.271
  494    H    ILE  57           HN       ILE  57 -13.505   7.583   5.579
  495    HA   ILE  57           HA       ILE  57 -16.023   6.635   6.885
  496    HB   ILE  57           HB       ILE  57 -14.774   4.627   7.699
  497   1HG1  ILE  57          HG12      ILE  57 -12.725   4.365   5.822
  498   2HG1  ILE  57          HG11      ILE  57 -12.583   6.037   6.362
  499   1HG2  ILE  57          HG21      ILE  57 -15.002   3.378   5.658
  500   2HG2  ILE  57          HG22      ILE  57 -14.752   4.822   4.677
  501   3HG2  ILE  57          HG23      ILE  57 -16.229   4.644   5.623
  502   1HD1  ILE  57          HD11      ILE  57 -11.469   3.962   7.694
  503   2HD1  ILE  57          HD12      ILE  57 -13.042   4.018   8.492
  504   3HD1  ILE  57          HD13      ILE  57 -12.000   5.441   8.494
  505    H    TRP  58           HN       TRP  58 -15.981   6.659   9.188
  506    HA   TRP  58           HA       TRP  58 -13.589   7.613  10.599
  507   1HB   TRP  58          HB2       TRP  58 -14.824   9.647   9.571
  508   2HB   TRP  58          HB1       TRP  58 -16.066   9.327  10.777
  509    HD1  TRP  58           HD1      TRP  58 -12.634   8.494  11.981
  510    HE1  TRP  58           HE1      TRP  58 -11.812  10.303  13.623
  511    HE3  TRP  58           HE3      TRP  58 -16.198  12.073  11.213
  512    HZ2  TRP  58           HZ2      TRP  58 -12.564  12.920  14.495
  513    HZ3  TRP  58           HZ3      TRP  58 -16.119  14.212  12.461
  514    HH2  TRP  58           HH2      TRP  58 -14.308  14.640  14.099
  515    H    VAL  59           HN       VAL  59 -15.360   5.257  10.731
  516    HA   VAL  59           HA       VAL  59 -16.238   5.550  13.573
  517    HB   VAL  59           HB       VAL  59 -18.146   3.992  13.037
  518   1HG1  VAL  59          HG11      VAL  59 -18.377   6.485  13.216
  519   2HG1  VAL  59          HG12      VAL  59 -19.562   5.746  12.140
  520   3HG1  VAL  59          HG13      VAL  59 -18.165   6.587  11.469
  521   1HG2  VAL  59          HG21      VAL  59 -18.793   3.672  10.722
  522   2HG2  VAL  59          HG22      VAL  59 -17.117   3.150  10.891
  523   3HG2  VAL  59          HG23      VAL  59 -17.483   4.714  10.164
  524    H    ARG  60           HN       ARG  60 -14.233   3.873  11.445
  525    HA   ARG  60           HA       ARG  60 -13.826   1.748  13.460
  526   1HB   ARG  60          HB2       ARG  60 -15.100   1.318  10.866
  527   2HB   ARG  60          HB1       ARG  60 -13.657   0.327  11.069
  528   1HG   ARG  60          HG2       ARG  60 -15.481   0.474  13.411
  529   2HG   ARG  60          HG1       ARG  60 -16.085  -0.408  12.008
  530   1HD   ARG  60          HD2       ARG  60 -14.597  -2.106  12.280
  531   2HD   ARG  60          HD1       ARG  60 -13.281  -1.011  12.701
  532    HE   ARG  60           HE       ARG  60 -13.962  -1.130  15.004
  533   1HH1  ARG  60          HH21      ARG  60 -16.900  -1.159  14.775
  534   2HH1  ARG  60          HH22      ARG  60 -17.309  -2.796  15.167
  535   1HH2  ARG  60          HH11      ARG  60 -14.085  -3.996  14.679
  536   2HH2  ARG  60          HH12      ARG  60 -15.711  -4.406  15.112
  537    H    GLU  61           HN       GLU  61 -11.799   0.500  12.984
  538    HA   GLU  61           HA       GLU  61  -9.849   2.116  11.387
  539   1HB   GLU  61          HB2       GLU  61  -9.545   0.877  14.131
  540   2HB   GLU  61          HB1       GLU  61  -8.151   1.322  13.147
  541   1HG   GLU  61          HG2       GLU  61  -8.359   3.385  14.051
  542   2HG   GLU  61          HG1       GLU  61  -9.761   3.576  12.998
  543    H    GLY  62           HN       GLY  62  -8.388   0.931  10.144
  544   1HA   GLY  62          HA2       GLY  62  -7.195  -1.313   9.926
  545   2HA   GLY  62          HA1       GLY  62  -8.791  -2.036  10.128
  546    H    ASP  63           HN       ASP  63  -6.751  -0.145   7.954
  547    HA   ASP  63           HA       ASP  63  -8.612  -0.879   5.711
  548   1HB   ASP  63          HB2       ASP  63  -6.941   1.632   5.688
  549   2HB   ASP  63          HB1       ASP  63  -8.333   1.238   4.686
  550    H    VAL  64           HN       VAL  64  -7.431  -1.038   3.537
  551    HA   VAL  64           HA       VAL  64  -4.697  -2.129   4.065
  552    HB   VAL  64           HB       VAL  64  -6.138  -3.666   2.861
  553   1HG1  VAL  64          HG11      VAL  64  -6.481  -1.372   0.915
  554   2HG1  VAL  64          HG12      VAL  64  -7.738  -2.176   1.854
  555   3HG1  VAL  64          HG13      VAL  64  -6.931  -3.037   0.546
  556   1HG2  VAL  64          HG21      VAL  64  -4.203  -2.452   0.877
  557   2HG2  VAL  64          HG22      VAL  64  -4.717  -4.137   0.976
  558   3HG2  VAL  64          HG23      VAL  64  -3.697  -3.450   2.241
  559    H    VAL  65           HN       VAL  65  -2.894  -1.232   3.156
  560    HA   VAL  65           HA       VAL  65  -3.272   1.074   1.316
  561    HB   VAL  65           HB       VAL  65  -2.828   1.320   4.081
  562   1HG1  VAL  65          HG11      VAL  65  -0.314   2.040   2.550
  563   2HG1  VAL  65          HG12      VAL  65  -0.453   0.742   3.735
  564   3HG1  VAL  65          HG13      VAL  65  -0.641   2.419   4.240
  565   1HG2  VAL  65          HG21      VAL  65  -2.681   3.703   3.577
  566   2HG2  VAL  65          HG22      VAL  65  -3.893   2.947   2.548
  567   3HG2  VAL  65          HG23      VAL  65  -2.307   3.344   1.891
  568    H    ILE  66           HN       ILE  66  -1.581   1.421  -0.107
  569    HA   ILE  66           HA       ILE  66   0.643  -0.596  -0.009
  570    HB   ILE  66           HB       ILE  66   0.735  -0.553  -2.306
  571   1HG1  ILE  66          HG12      ILE  66   0.011   1.678  -3.555
  572   2HG1  ILE  66          HG11      ILE  66   0.346   2.402  -1.985
  573   1HG2  ILE  66          HG21      ILE  66  -1.719  -0.814  -1.665
  574   2HG2  ILE  66          HG22      ILE  66  -1.399  -0.347  -3.335
  575   3HG2  ILE  66          HG23      ILE  66  -1.930   0.863  -2.167
  576   1HD1  ILE  66          HD11      ILE  66   2.225   0.957  -3.840
  577   2HD1  ILE  66          HD12      ILE  66   2.574   1.033  -2.113
  578   3HD1  ILE  66          HD13      ILE  66   2.434   2.520  -3.050
  579    H    VAL  67           HN       VAL  67   2.794   0.242   0.302
  580    HA   VAL  67           HA       VAL  67   2.826   3.201   0.707
  581    HB   VAL  67           HB       VAL  67   3.783   3.026   2.785
  582   1HG1  VAL  67          HG11      VAL  67   2.626   0.253   2.833
  583   2HG1  VAL  67          HG12      VAL  67   1.572   1.643   2.577
  584   3HG1  VAL  67          HG13      VAL  67   2.526   1.521   4.055
  585   1HG2  VAL  67          HG21      VAL  67   5.085   1.022   3.541
  586   2HG2  VAL  67          HG22      VAL  67   5.790   1.823   2.139
  587   3HG2  VAL  67          HG23      VAL  67   4.873   0.330   1.932
  588    H    LYS  68           HN       LYS  68   4.776   4.272   0.613
  589    HA   LYS  68           HA       LYS  68   6.826   3.125  -1.194
  590   1HB   LYS  68          HB2       LYS  68   6.434   5.011  -2.395
  591   2HB   LYS  68          HB1       LYS  68   5.427   5.670  -1.111
  592   1HG   LYS  68          HG2       LYS  68   7.293   6.656  -0.012
  593   2HG   LYS  68          HG1       LYS  68   8.446   5.718  -0.958
  594   1HD   LYS  68          HD2       LYS  68   8.456   7.254  -2.602
  595   2HD   LYS  68          HD1       LYS  68   6.695   7.230  -2.702
  596   1HE   LYS  68          HE2       LYS  68   6.917   8.620  -0.434
  597   2HE   LYS  68          HE1       LYS  68   8.483   9.035  -1.129
  598   1HZ   LYS  68          HZ1       LYS  68   5.815   9.426  -2.369
  599   2HZ   LYS  68          HZ2       LYS  68   7.287   9.671  -3.182
  600   3HZ   LYS  68          HZ3       LYS  68   6.883  10.632  -1.841
  601    HA   PRO  69           HA       PRO  69   9.551   3.484   2.267
  602   1HB   PRO  69          HB2       PRO  69  11.932   3.310   0.953
  603   2HB   PRO  69          HB1       PRO  69  10.843   1.933   1.171
  604   1HG   PRO  69          HG2       PRO  69  11.441   3.461  -1.299
  605   2HG   PRO  69          HG1       PRO  69  10.762   1.837  -1.132
  606   1HD   PRO  69          HD2       PRO  69   9.332   4.274  -1.697
  607   2HD   PRO  69          HD1       PRO  69   8.649   2.651  -1.450
  608    H    TRP  70           HN       TRP  70  10.578   4.993   3.430
  609    HA   TRP  70           HA       TRP  70  11.492   7.528   2.136
  610   1HB   TRP  70          HB2       TRP  70  10.123   7.078   4.773
  611   2HB   TRP  70          HB1       TRP  70  11.040   8.538   4.441
  612    HD1  TRP  70           HD1      TRP  70   8.862   6.503   2.150
  613    HE1  TRP  70           HE1      TRP  70   7.091   7.999   1.299
  614    HE3  TRP  70           HE3      TRP  70   9.907  10.730   4.768
  615    HZ2  TRP  70           HZ2      TRP  70   6.121  10.635   1.629
  616    HZ3  TRP  70           HZ3      TRP  70   8.512  12.765   4.474
  617    HH2  TRP  70           HH2      TRP  70   6.604  12.729   2.890
  618    H    GLU  71           HN       GLU  71  13.802   7.622   2.479
  619    HA   GLU  71           HA       GLU  71  15.133   5.904   4.404
  620   1HB   GLU  71          HB2       GLU  71  17.168   7.344   3.849
  621   2HB   GLU  71          HB1       GLU  71  16.422   6.508   2.490
  622   1HG   GLU  71          HG2       GLU  71  15.158   9.083   2.884
  623   2HG   GLU  71          HG1       GLU  71  16.903   9.280   2.731
  624    H    VAL  72           HN       VAL  72  15.717   6.316   6.470
  625    HA   VAL  72           HA       VAL  72  16.249   8.817   7.677
  626    HB   VAL  72           HB       VAL  72  13.980   9.510   7.399
  627   1HG1  VAL  72          HG11      VAL  72  13.450   6.689   7.592
  628   2HG1  VAL  72          HG12      VAL  72  12.385   7.977   7.031
  629   3HG1  VAL  72          HG13      VAL  72  12.429   7.554   8.741
  630   1HG2  VAL  72          HG21      VAL  72  15.023   9.663   9.748
  631   2HG2  VAL  72          HG22      VAL  72  13.966   8.318  10.176
  632   3HG2  VAL  72          HG23      VAL  72  13.273   9.847   9.640
  633    H    GLN  73           HN       GLN  73  17.758   7.833   8.954
  634    HA   GLN  73           HA       GLN  73  17.663   5.272  10.106
  635   1HB   GLN  73          HB2       GLN  73  19.356   6.105  11.729
  636   2HB   GLN  73          HB1       GLN  73  19.717   6.574  10.072
  637   1HG   GLN  73          HG2       GLN  73  18.153   8.674  10.934
  638   2HG   GLN  73          HG1       GLN  73  19.056   8.259  12.390
  639   1HE2  GLN  73          HE21      GLN  73  19.652   8.793   8.861
  640   2HE2  GLN  73          HE22      GLN  73  21.164   9.531   9.084
  641    H    GLY  74           HN       GLY  74  16.902   4.428  12.032
  642   1HA   GLY  74          HA2       GLY  74  16.025   4.716  14.324
  643   2HA   GLY  74          HA1       GLY  74  15.305   6.239  13.799
  644    H    ASP  75           HN       ASP  75  14.065   5.493  11.420
  645    HA   ASP  75           HA       ASP  75  12.470   3.069  11.730
  646   1HB   ASP  75          HB2       ASP  75  11.603   5.246  13.249
  647   2HB   ASP  75          HB1       ASP  75  10.607   5.328  11.796
  648    H    GLN  76           HN       GLN  76  10.463   3.305   9.995
  649    HA   GLN  76           HA       GLN  76  11.746   4.660   7.645
  650   1HB   GLN  76          HB2       GLN  76   9.865   2.296   7.815
  651   2HB   GLN  76          HB1       GLN  76  10.309   3.076   6.300
  652   1HG   GLN  76          HG2       GLN  76  12.083   1.672   6.266
  653   2HG   GLN  76          HG1       GLN  76  12.758   2.685   7.541
  654   1HE2  GLN  76          HE21      GLN  76  12.875   1.800   9.668
  655   2HE2  GLN  76          HE22      GLN  76  12.340   0.237  10.055
  656    H    LYS  77           HN       LYS  77  10.462   5.890   6.195
  657    HA   LYS  77           HA       LYS  77   7.769   6.695   7.307
  658   1HB   LYS  77          HB2       LYS  77   9.997   8.278   6.186
  659   2HB   LYS  77          HB1       LYS  77   8.400   8.698   5.565
  660   1HG   LYS  77          HG2       LYS  77   7.597   9.324   7.660
  661   2HG   LYS  77          HG1       LYS  77   8.778   8.335   8.520
  662   1HD   LYS  77          HD2       LYS  77  10.403  10.076   7.147
  663   2HD   LYS  77          HD1       LYS  77   9.015  11.098   7.522
  664   1HE   LYS  77          HE2       LYS  77  10.177   9.348   9.669
  665   2HE   LYS  77          HE1       LYS  77  10.968  10.873   9.270
  666   1HZ   LYS  77          HZ1       LYS  77   9.379  11.237  11.008
  667   2HZ   LYS  77          HZ2       LYS  77   8.140  10.507  10.103
  668   3HZ   LYS  77          HZ3       LYS  77   8.810  11.984   9.595
  669    H    CYS  78           HN       CYS  78   6.028   6.889   5.668
  670    HA   CYS  78           HA       CYS  78   6.837   5.856   3.015
  671   1HB   CYS  78          HB2       CYS  78   5.229   4.037   3.029
  672   2HB   CYS  78          HB1       CYS  78   6.316   3.869   4.403
  673    HG   CYS  78           HG       CYS  78   3.521   3.768   4.847
  674    H    ASP  79           HN       ASP  79   5.325   6.096   1.339
  675    HA   ASP  79           HA       ASP  79   3.261   8.248   1.932
  676   1HB   ASP  79          HB2       ASP  79   5.095   8.231  -0.081
  677   2HB   ASP  79          HB1       ASP  79   3.812   7.313  -0.868
  678    H    ILE  80           HN       ILE  80   1.131   7.455   2.089
  679    HA   ILE  80           HA       ILE  80   0.777   4.730   0.906
  680    HB   ILE  80           HB       ILE  80  -0.968   4.465   2.792
  681   1HG1  ILE  80          HG12      ILE  80   0.799   6.453   4.199
  682   2HG1  ILE  80          HG11      ILE  80  -0.645   7.005   3.351
  683   1HG2  ILE  80          HG21      ILE  80   1.224   3.314   2.555
  684   2HG2  ILE  80          HG22      ILE  80   0.771   3.597   4.235
  685   3HG2  ILE  80          HG23      ILE  80   1.975   4.626   3.458
  686   1HD1  ILE  80          HD11      ILE  80  -1.051   6.496   5.777
  687   2HD1  ILE  80          HD12      ILE  80  -0.648   4.812   5.445
  688   3HD1  ILE  80          HD13      ILE  80  -2.056   5.549   4.682
  689    H    ILE  81           HN       ILE  81  -1.093   4.059   0.135
  690    HA   ILE  81           HA       ILE  81  -3.223   6.108  -0.415
  691    HB   ILE  81           HB       ILE  81  -3.674   4.662  -2.521
  692   1HG1  ILE  81          HG12      ILE  81  -0.747   4.015  -2.406
  693   2HG1  ILE  81          HG11      ILE  81  -1.877   2.952  -1.568
  694   1HG2  ILE  81          HG21      ILE  81  -2.095   5.970  -3.841
  695   2HG2  ILE  81          HG22      ILE  81  -1.114   6.281  -2.409
  696   3HG2  ILE  81          HG23      ILE  81  -2.734   6.967  -2.535
  697   1HD1  ILE  81          HD11      ILE  81  -2.627   2.068  -3.506
  698   2HD1  ILE  81          HD12      ILE  81  -1.254   2.857  -4.282
  699   3HD1  ILE  81          HD13      ILE  81  -2.823   3.661  -4.237
  700    H    TRP  82           HN       TRP  82  -5.041   5.487   0.657
  701    HA   TRP  82           HA       TRP  82  -5.235   2.668   1.545
  702   1HB   TRP  82          HB2       TRP  82  -6.078   3.499   3.445
  703   2HB   TRP  82          HB1       TRP  82  -5.665   5.096   2.834
  704    HD1  TRP  82           HD1      TRP  82  -8.537   2.974   3.818
  705    HE1  TRP  82           HE1      TRP  82 -10.762   4.162   3.291
  706    HE3  TRP  82           HE3      TRP  82  -6.821   6.806   0.910
  707    HZ2  TRP  82           HZ2      TRP  82 -11.688   6.433   1.826
  708    HZ3  TRP  82           HZ3      TRP  82  -8.398   8.467  -0.037
  709    HH2  TRP  82           HH2      TRP  82 -10.829   8.285   0.418
  710    H    ARG  83           HN       ARG  83  -7.265   1.571   1.557
  711    HA   ARG  83           HA       ARG  83  -9.586   2.318   0.110
  712   1HB   ARG  83          HB2       ARG  83  -7.386   1.601  -1.578
  713   2HB   ARG  83          HB1       ARG  83  -8.584   0.311  -1.670
  714   1HG   ARG  83          HG2       ARG  83 -10.160   1.653  -2.647
  715   2HG   ARG  83          HG1       ARG  83  -9.643   3.084  -1.756
  716   1HD   ARG  83          HD2       ARG  83  -7.843   3.498  -3.236
  717   2HD   ARG  83          HD1       ARG  83  -7.915   1.870  -3.912
  718    HE   ARG  83           HE       ARG  83  -9.696   2.574  -5.318
  719   1HH1  ARG  83          HH21      ARG  83  -8.184   5.238  -5.138
  720   2HH1  ARG  83          HH22      ARG  83  -9.490   6.334  -4.835
  721   1HH2  ARG  83          HH11      ARG  83 -11.732   3.834  -3.950
  722   2HH2  ARG  83          HH12      ARG  83 -11.503   5.539  -4.161
  723    H    TYR  84           HN       TYR  84 -10.745   0.111  -0.642
  724    HA   TYR  84           HA       TYR  84 -11.922  -1.657   0.437
  725   1HB   TYR  84          HB2       TYR  84  -9.132  -2.798   0.174
  726   2HB   TYR  84          HB1       TYR  84 -10.636  -3.712   0.212
  727    HD1  TYR  84           HD1      TYR  84  -8.206  -2.355  -1.917
  728    HD2  TYR  84           HD2      TYR  84 -12.462  -2.833  -1.571
  729    HE1  TYR  84           HE1      TYR  84  -8.437  -2.076  -4.370
  730    HE2  TYR  84           HE2      TYR  84 -12.693  -2.554  -4.024
  731    HH   TYR  84           HH       TYR  84 -10.367  -2.931  -6.146
  732    H    THR  85           HN       THR  85 -12.173  -0.545   2.556
  733    HA   THR  85           HA       THR  85 -10.339  -0.752   4.715
  734    HB   THR  85           HB       THR  85 -12.245  -0.239   6.167
  735    HG1  THR  85           HG1      THR  85 -14.085  -1.075   5.662
  736   1HG2  THR  85          HG21      THR  85 -11.319   1.368   4.232
  737   2HG2  THR  85          HG22      THR  85 -12.640   1.854   5.295
  738   3HG2  THR  85          HG23      THR  85 -12.988   1.231   3.681
  739    H    LYS  86           HN       LYS  86  -9.631  -3.028   4.196
  740    HA   LYS  86           HA       LYS  86 -10.676  -4.915   6.139
  741   1HB   LYS  86          HB2       LYS  86 -11.462  -5.115   3.270
  742   2HB   LYS  86          HB1       LYS  86 -10.908  -6.610   4.015
  743   1HG   LYS  86          HG2       LYS  86 -12.958  -6.846   4.913
  744   2HG   LYS  86          HG1       LYS  86 -12.629  -5.428   5.908
  745   1HD   LYS  86          HD2       LYS  86 -14.344  -4.432   4.825
  746   2HD   LYS  86          HD1       LYS  86 -13.273  -4.343   3.427
  747   1HE   LYS  86          HE2       LYS  86 -14.239  -6.963   3.373
  748   2HE   LYS  86          HE1       LYS  86 -15.639  -5.998   3.838
  749   1HZ   LYS  86          HZ1       LYS  86 -15.544  -6.079   1.476
  750   2HZ   LYS  86          HZ2       LYS  86 -13.911  -5.614   1.457
  751   3HZ   LYS  86          HZ3       LYS  86 -15.107  -4.509   1.945
  752    H    THR  87           HN       THR  87  -9.503  -7.265   5.024
  753    HA   THR  87           HA       THR  87  -6.641  -6.445   5.006
  754    HB   THR  87           HB       THR  87  -7.323  -8.105   6.713
  755    HG1  THR  87           HG1      THR  87  -5.397  -8.823   6.416
  756   1HG2  THR  87          HG21      THR  87  -8.443 -10.046   6.255
  757   2HG2  THR  87          HG22      THR  87  -7.668 -10.246   4.684
  758   3HG2  THR  87          HG23      THR  87  -9.014  -9.123   4.866
  759    H    GLN  88           HN       GLN  88  -5.799  -6.190   3.002
  760    HA   GLN  88           HA       GLN  88  -6.269  -8.310   0.972
  761   1HB   GLN  88          HB2       GLN  88  -7.140  -5.474   0.780
  762   2HB   GLN  88          HB1       GLN  88  -6.354  -6.138  -0.651
  763   1HG   GLN  88          HG2       GLN  88  -8.131  -7.443  -1.148
  764   2HG   GLN  88          HG1       GLN  88  -8.286  -7.996   0.520
  765   1HE2  GLN  88          HE21      GLN  88  -9.393  -6.397   2.061
  766   2HE2  GLN  88          HE22      GLN  88 -10.599  -5.388   1.425
  767    H    VAL  89           HN       VAL  89  -3.966  -7.569   2.655
  768    HA   VAL  89           HA       VAL  89  -2.010  -6.095   1.152
  769    HB   VAL  89           HB       VAL  89  -1.543  -8.296   3.192
  770   1HG1  VAL  89          HG11      VAL  89   0.470  -7.720   1.920
  771   2HG1  VAL  89          HG12      VAL  89   0.598  -7.078   3.558
  772   3HG1  VAL  89          HG13      VAL  89   0.192  -6.004   2.220
  773   1HG2  VAL  89          HG21      VAL  89  -2.830  -6.737   4.372
  774   2HG2  VAL  89          HG22      VAL  89  -2.226  -5.375   3.429
  775   3HG2  VAL  89          HG23      VAL  89  -1.198  -6.129   4.648
  776    H    GLU  90           HN       GLU  90  -2.895  -9.539   1.238
  777    HA   GLU  90           HA       GLU  90  -0.749 -10.562  -0.335
  778   1HB   GLU  90          HB2       GLU  90  -3.605 -11.457   0.077
  779   2HB   GLU  90          HB1       GLU  90  -2.504 -12.345  -0.976
  780   1HG   GLU  90          HG2       GLU  90  -1.006 -12.820   0.817
  781   2HG   GLU  90          HG1       GLU  90  -1.782 -11.640   1.874
  782    H    TRP  91           HN       TRP  91  -3.901  -9.192  -1.292
  783    HA   TRP  91           HA       TRP  91  -3.706  -9.668  -4.093
  784   1HB   TRP  91          HB2       TRP  91  -5.801  -8.945  -3.090
  785   2HB   TRP  91          HB1       TRP  91  -5.067  -7.431  -2.574
  786    HD1  TRP  91           HD1      TRP  91  -4.300  -5.721  -4.552
  787    HE1  TRP  91           HE1      TRP  91  -5.317  -5.330  -6.889
  788    HE3  TRP  91           HE3      TRP  91  -7.023 -10.010  -5.057
  789    HZ2  TRP  91           HZ2      TRP  91  -7.055  -6.659  -8.727
  790    HZ3  TRP  91           HZ3      TRP  91  -8.349 -10.422  -7.109
  791    HH2  TRP  91           HH2      TRP  91  -8.369  -8.753  -8.943
  792    H    LEU  92           HN       LEU  92  -2.681  -6.843  -2.149
  793    HA   LEU  92           HA       LEU  92  -1.655  -5.326  -4.352
  794   1HB   LEU  92          HB2       LEU  92  -1.024  -5.301  -1.394
  795   2HB   LEU  92          HB1       LEU  92  -0.287  -4.173  -2.533
  796    HG   LEU  92           HG       LEU  92  -3.282  -4.537  -2.352
  797   1HD1  LEU  92          HD11      LEU  92  -3.244  -2.429  -0.983
  798   2HD1  LEU  92          HD12      LEU  92  -1.496  -2.613  -0.839
  799   3HD1  LEU  92          HD13      LEU  92  -2.571  -3.829  -0.148
  800   1HD2  LEU  92          HD21      LEU  92  -2.646  -3.442  -4.368
  801   2HD2  LEU  92          HD22      LEU  92  -1.399  -2.499  -3.554
  802   3HD2  LEU  92          HD23      LEU  92  -3.101  -2.136  -3.272
  803    H    LYS  93           HN       LYS  93  -0.125  -7.768  -2.256
  804    HA   LYS  93           HA       LYS  93   2.562  -7.425  -3.185
  805   1HB   LYS  93          HB2       LYS  93   1.061  -9.780  -2.024
  806   2HB   LYS  93          HB1       LYS  93   2.752  -9.909  -2.502
  807   1HG   LYS  93          HG2       LYS  93   2.114  -7.538  -0.854
  808   2HG   LYS  93          HG1       LYS  93   1.919  -9.085  -0.031
  809   1HD   LYS  93          HD2       LYS  93   4.253  -9.654  -1.040
  810   2HD   LYS  93          HD1       LYS  93   4.404  -7.911  -1.263
  811   1HE   LYS  93          HE2       LYS  93   4.452  -7.486   1.011
  812   2HE   LYS  93          HE1       LYS  93   3.493  -8.912   1.403
  813   1HZ   LYS  93          HZ1       LYS  93   5.835  -9.130   2.055
  814   2HZ   LYS  93          HZ2       LYS  93   6.299  -8.973   0.431
  815   3HZ   LYS  93          HZ3       LYS  93   5.373 -10.308   0.929
  816    H    ARG  94           HN       ARG  94  -0.008  -9.677  -4.260
  817    HA   ARG  94           HA       ARG  94   1.401 -10.878  -6.415
  818   1HB   ARG  94          HB2       ARG  94  -1.218 -10.963  -5.383
  819   2HB   ARG  94          HB1       ARG  94  -1.394 -10.468  -7.066
  820   1HG   ARG  94          HG2       ARG  94   0.515 -12.470  -7.213
  821   2HG   ARG  94          HG1       ARG  94  -0.577 -13.061  -5.961
  822   1HD   ARG  94          HD2       ARG  94  -1.304 -12.238  -8.786
  823   2HD   ARG  94          HD1       ARG  94  -1.415 -13.852  -8.085
  824    HE   ARG  94           HE       ARG  94  -3.280 -11.613  -7.580
  825   1HH1  ARG  94          HH11      ARG  94  -4.226 -14.309  -8.410
  826   2HH1  ARG  94          HH12      ARG  94  -4.758 -14.998  -6.913
  827   1HH2  ARG  94          HH21      ARG  94  -3.065 -12.690  -4.945
  828   2HH2  ARG  94          HH22      ARG  94  -4.099 -14.079  -4.947
  829    H    LYS  95           HN       LYS  95  -0.379  -7.835  -6.195
  830    HA   LYS  95           HA       LYS  95  -0.437  -7.168  -8.968
  831   1HB   LYS  95          HB2       LYS  95  -1.573  -6.038  -6.880
  832   2HB   LYS  95          HB1       LYS  95  -0.101  -5.068  -6.845
  833   1HG   LYS  95          HG2       LYS  95  -1.006  -5.209  -9.557
  834   2HG   LYS  95          HG1       LYS  95  -2.376  -4.754  -8.546
  835   1HD   LYS  95          HD2       LYS  95   0.330  -3.417  -8.319
  836   2HD   LYS  95          HD1       LYS  95  -0.938  -2.823  -9.391
  837   1HE   LYS  95          HE2       LYS  95  -2.292  -3.188  -7.008
  838   2HE   LYS  95          HE1       LYS  95  -0.715  -2.613  -6.471
  839   1HZ   LYS  95          HZ1       LYS  95  -2.323  -1.289  -8.584
  840   2HZ   LYS  95          HZ2       LYS  95  -0.911  -0.700  -7.846
  841   3HZ   LYS  95          HZ3       LYS  95  -2.349  -0.828  -6.952
  842    H    GLY  96           HN       GLY  96   2.086  -6.766  -6.489
  843   1HA   GLY  96          HA2       GLY  96   3.793  -5.050  -8.056
  844   2HA   GLY  96          HA1       GLY  96   4.301  -6.016  -6.672
  845    H    TYR  97           HN       TYR  97   3.547  -8.569  -7.669
  846    HA   TYR  97           HA       TYR  97   5.888  -9.236  -9.196
  847   1HB   TYR  97          HB2       TYR  97   3.460 -11.014  -9.017
  848   2HB   TYR  97          HB1       TYR  97   5.158 -11.479  -9.098
  849    HD1  TYR  97           HD1      TYR  97   2.828 -12.046  -6.952
  850    HD2  TYR  97           HD2      TYR  97   6.255  -9.463  -7.109
  851    HE1  TYR  97           HE1      TYR  97   2.921 -12.023  -4.480
  852    HE2  TYR  97           HE2      TYR  97   6.352  -9.437  -4.638
  853    HH   TYR  97           HH       TYR  97   5.288 -10.021  -2.737
  854    H    LEU  98           HN       LEU  98   2.427  -9.263 -10.212
  855    HA   LEU  98           HA       LEU  98   2.981  -9.903 -12.941
  856   1HB   LEU  98          HB2       LEU  98   0.718  -9.006 -13.433
  857   2HB   LEU  98          HB1       LEU  98   0.709 -10.087 -12.044
  858    HG   LEU  98           HG       LEU  98   1.137  -7.727 -10.782
  859   1HD1  LEU  98          HD11      LEU  98  -0.951  -6.789 -12.641
  860   2HD1  LEU  98          HD12      LEU  98   0.660  -6.866 -13.353
  861   3HD1  LEU  98          HD13      LEU  98   0.380  -5.897 -11.906
  862   1HD2  LEU  98          HD21      LEU  98  -1.424  -7.693 -10.526
  863   2HD2  LEU  98          HD22      LEU  98  -0.606  -9.192 -10.085
  864   3HD2  LEU  98          HD23      LEU  98  -1.437  -9.064 -11.634
  865    H    ASP  99           HN       ASP  99   2.842  -6.795 -11.247
  866    HA   ASP  99           HA       ASP  99   3.083  -5.113 -13.565
  867   1HB   ASP  99          HB2       ASP  99   2.394  -4.005 -11.611
  868   2HB   ASP  99          HB1       ASP  99   3.625  -4.776 -10.620
  869    H    GLU 100           HN       GLU 100   5.483  -6.557 -11.361
  870    HA   GLU 100           HA       GLU 100   7.845  -5.372 -12.278
  871   1HB   GLU 100          HB2       GLU 100   7.698  -6.979 -10.383
  872   2HB   GLU 100          HB1       GLU 100   7.476  -8.292 -11.538
  873   1HG   GLU 100          HG2       GLU 100   9.791  -6.649 -12.209
  874   2HG   GLU 100          HG1       GLU 100   9.919  -7.326 -10.586
  875    H    LEU 101           HN       LEU 101   6.268  -8.308 -13.624
  876    HA   LEU 101           HA       LEU 101   8.171  -8.461 -15.832
  877   1HB   LEU 101          HB2       LEU 101   6.690 -10.356 -14.724
  878   2HB   LEU 101          HB1       LEU 101   5.500  -9.826 -15.914
  879    HG   LEU 101           HG       LEU 101   8.238 -10.174 -16.974
  880   1HD1  LEU 101          HD11      LEU 101   8.111 -12.063 -15.375
  881   2HD1  LEU 101          HD12      LEU 101   8.082 -12.626 -17.047
  882   3HD1  LEU 101          HD13      LEU 101   6.589 -12.571 -16.109
  883   1HD2  LEU 101          HD21      LEU 101   5.892  -9.752 -18.131
  884   2HD2  LEU 101          HD22      LEU 101   5.748 -11.504 -17.998
  885   3HD2  LEU 101          HD23      LEU 101   7.086 -10.795 -18.901
  886    H    LEU 102           HN       LEU 102   8.119  -6.932 -17.399
  887    HA   LEU 102           HA       LEU 102   5.463  -6.172 -18.539
  888   1HB   LEU 102          HB2       LEU 102   7.094  -4.461 -17.036
  889   2HB   LEU 102          HB1       LEU 102   7.434  -4.025 -18.709
  890    HG   LEU 102           HG       LEU 102   5.544  -2.713 -17.800
  891   1HD1  LEU 102          HD11      LEU 102   5.673  -3.461 -20.235
  892   2HD1  LEU 102          HD12      LEU 102   4.068  -3.013 -19.656
  893   3HD1  LEU 102          HD13      LEU 102   4.504  -4.714 -19.817
  894   1HD2  LEU 102          HD21      LEU 102   3.834  -5.173 -17.759
  895   2HD2  LEU 102          HD22      LEU 102   3.648  -3.665 -16.863
  896   3HD2  LEU 102          HD23      LEU 102   4.859  -4.846 -16.361
  Start of MODEL    3
    1   1H    MET   1          HT1       MET   1 -35.125   7.343 -10.401
    2   2H    MET   1          HT2       MET   1 -33.892   8.329  -9.772
    3   3H    MET   1          HT3       MET   1 -35.517   8.799  -9.624
    4    HA   MET   1           HA       MET   1 -34.643   7.933  -7.529
    5   1HB   MET   1          HB2       MET   1 -37.073   7.481  -8.615
    6   2HB   MET   1          HB1       MET   1 -36.532   5.813  -8.430
    7   1HG   MET   1          HG2       MET   1 -37.623   6.341  -6.381
    8   2HG   MET   1          HG1       MET   1 -35.899   6.447  -6.026
    9   1HE   MET   1          HE1       MET   1 -39.237   8.081  -5.756
   10   2HE   MET   1          HE2       MET   1 -38.888   8.455  -7.441
   11   3HE   MET   1          HE3       MET   1 -39.019   9.760  -6.266
   12    H    ALA   2           HN       ALA   2 -33.255   6.511  -6.577
   13    HA   ALA   2           HA       ALA   2 -31.780   4.717  -6.301
   14   1HB   ALA   2          HB1       ALA   2 -33.950   3.426  -6.718
   15   2HB   ALA   2          HB2       ALA   2 -32.456   2.560  -7.075
   16   3HB   ALA   2          HB3       ALA   2 -33.411   3.250  -8.387
   17    H    GLU   3           HN       GLU   3 -30.149   6.068  -7.331
   18    HA   GLU   3           HA       GLU   3 -29.585   5.429 -10.186
   19   1HB   GLU   3          HB2       GLU   3 -28.949   7.704  -8.366
   20   2HB   GLU   3          HB1       GLU   3 -27.745   7.307  -9.592
   21   1HG   GLU   3          HG2       GLU   3 -29.364   8.981 -10.431
   22   2HG   GLU   3          HG1       GLU   3 -29.456   7.481 -11.352
   23    H    GLN   4           HN       GLN   4 -28.800   3.272  -9.676
   24    HA   GLN   4           HA       GLN   4 -25.941   3.282  -8.941
   25   1HB   GLN   4          HB2       GLN   4 -28.075   2.222  -7.211
   26   2HB   GLN   4          HB1       GLN   4 -26.805   1.049  -7.559
   27   1HG   GLN   4          HG2       GLN   4 -25.458   3.467  -7.055
   28   2HG   GLN   4          HG1       GLN   4 -26.716   3.367  -5.822
   29   1HE2  GLN   4          HE21      GLN   4 -23.997   1.495  -7.244
   30   2HE2  GLN   4          HE22      GLN   4 -23.718   0.555  -5.857
   31    H    GLN   5           HN       GLN   5 -25.768   2.775 -11.221
   32    HA   GLN   5           HA       GLN   5 -26.421  -0.080 -11.825
   33   1HB   GLN   5          HB2       GLN   5 -27.441   2.233 -13.137
   34   2HB   GLN   5          HB1       GLN   5 -26.299   1.468 -14.244
   35   1HG   GLN   5          HG2       GLN   5 -27.499  -0.749 -13.594
   36   2HG   GLN   5          HG1       GLN   5 -28.789   0.303 -13.010
   37   1HE2  GLN   5          HE21      GLN   5 -26.921  -0.540 -15.949
   38   2HE2  GLN   5          HE22      GLN   5 -28.085   0.029 -17.043
   39    H    GLN   6           HN       GLN   6 -24.688  -1.244 -12.509
   40    HA   GLN   6           HA       GLN   6 -22.085   0.101 -12.752
   41   1HB   GLN   6          HB2       GLN   6 -22.360  -2.062 -11.523
   42   2HB   GLN   6          HB1       GLN   6 -22.771  -2.839 -13.050
   43   1HG   GLN   6          HG2       GLN   6 -20.532  -1.918 -13.927
   44   2HG   GLN   6          HG1       GLN   6 -20.139  -1.601 -12.237
   45   1HE2  GLN   6          HE21      GLN   6 -21.486  -4.331 -14.203
   46   2HE2  GLN   6          HE22      GLN   6 -20.607  -5.533 -13.389
   47    H    GLU   7           HN       GLU   7 -21.794   1.114 -14.693
   48    HA   GLU   7           HA       GLU   7 -22.731  -0.185 -17.190
   49   1HB   GLU   7          HB2       GLU   7 -22.178   1.937 -18.277
   50   2HB   GLU   7          HB1       GLU   7 -23.166   2.240 -16.851
   51   1HG   GLU   7          HG2       GLU   7 -20.720   2.384 -15.716
   52   2HG   GLU   7          HG1       GLU   7 -20.307   2.900 -17.350
   53    H    GLN   8           HN       GLN   8 -19.743   0.626 -15.490
   54    HA   GLN   8           HA       GLN   8 -18.193  -0.638 -17.717
   55   1HB   GLN   8          HB2       GLN   8 -17.552   1.573 -15.788
   56   2HB   GLN   8          HB1       GLN   8 -16.242   0.582 -16.429
   57   1HG   GLN   8          HG2       GLN   8 -17.856   1.190 -18.650
   58   2HG   GLN   8          HG1       GLN   8 -17.738   2.694 -17.737
   59   1HE2  GLN   8          HE21      GLN   8 -15.535   3.562 -17.329
   60   2HE2  GLN   8          HE22      GLN   8 -14.235   3.081 -18.309
   61    H    GLN   9           HN       GLN   9 -16.788  -2.318 -17.205
   62    HA   GLN   9           HA       GLN   9 -16.882  -3.305 -14.382
   63   1HB   GLN   9          HB2       GLN   9 -17.504  -4.583 -16.896
   64   2HB   GLN   9          HB1       GLN   9 -16.206  -5.443 -16.067
   65   1HG   GLN   9          HG2       GLN   9 -17.521  -5.728 -14.096
   66   2HG   GLN   9          HG1       GLN   9 -18.740  -4.589 -14.666
   67   1HE2  GLN   9          HE21      GLN   9 -17.387  -7.849 -15.278
   68   2HE2  GLN   9          HE22      GLN   9 -18.747  -8.429 -16.111
   69    H    ILE  10           HN       ILE  10 -14.917  -1.607 -15.998
   70    HA   ILE  10           HA       ILE  10 -12.483  -3.286 -15.641
   71    HB   ILE  10           HB       ILE  10 -12.777  -2.315 -17.896
   72   1HG1  ILE  10          HG12      ILE  10 -10.525  -0.746 -16.693
   73   2HG1  ILE  10          HG11      ILE  10 -10.495  -2.502 -16.541
   74   1HG2  ILE  10          HG21      ILE  10 -13.193  -0.107 -18.301
   75   2HG2  ILE  10          HG22      ILE  10 -12.196   0.437 -16.952
   76   3HG2  ILE  10          HG23      ILE  10 -13.835  -0.143 -16.660
   77   1HD1  ILE  10          HD11      ILE  10 -11.215  -1.621 -19.239
   78   2HD1  ILE  10          HD12      ILE  10  -9.993  -2.784 -18.727
   79   3HD1  ILE  10          HD13      ILE  10  -9.617  -1.061 -18.743
   80    H    ARG  11           HN       ARG  11 -11.967  -3.050 -13.515
   81    HA   ARG  11           HA       ARG  11 -11.642  -0.296 -12.453
   82   1HB   ARG  11          HB2       ARG  11 -11.904  -1.250 -10.216
   83   2HB   ARG  11          HB1       ARG  11 -13.277  -1.669 -11.231
   84   1HG   ARG  11          HG2       ARG  11 -11.469  -3.725 -11.710
   85   2HG   ARG  11          HG1       ARG  11 -11.307  -3.420  -9.980
   86   1HD   ARG  11          HD2       ARG  11 -13.068  -5.014 -10.172
   87   2HD   ARG  11          HD1       ARG  11 -13.868  -3.469  -9.884
   88    HE   ARG  11           HE       ARG  11 -14.010  -3.460 -12.527
   89   1HH1  ARG  11          HH11      ARG  11 -13.057  -6.372 -12.520
   90   2HH1  ARG  11          HH12      ARG  11 -14.568  -7.212 -12.637
   91   1HH2  ARG  11          HH21      ARG  11 -16.479  -4.443 -11.768
   92   2HH2  ARG  11          HH22      ARG  11 -16.510  -6.117 -12.210
   93    H    VAL  12           HN       VAL  12 -10.048  -3.016 -13.352
   94    HA   VAL  12           HA       VAL  12  -7.636  -2.591 -11.714
   95    HB   VAL  12           HB       VAL  12  -8.666  -4.871 -12.398
   96   1HG1  VAL  12          HG11      VAL  12  -8.471  -5.648 -14.527
   97   2HG1  VAL  12          HG12      VAL  12  -6.938  -4.823 -14.804
   98   3HG1  VAL  12          HG13      VAL  12  -8.454  -3.932 -14.931
   99   1HG2  VAL  12          HG21      VAL  12  -6.713  -5.514 -11.496
  100   2HG2  VAL  12          HG22      VAL  12  -5.947  -4.006 -11.991
  101   3HG2  VAL  12          HG23      VAL  12  -5.969  -5.385 -13.090
  102    H    ARG  13           HN       ARG  13  -5.835  -3.430 -13.989
  103    HA   ARG  13           HA       ARG  13  -4.685  -2.527 -15.823
  104   1HB   ARG  13          HB2       ARG  13  -6.751  -0.308 -15.860
  105   2HB   ARG  13          HB1       ARG  13  -5.610  -0.719 -17.135
  106   1HG   ARG  13          HG2       ARG  13  -7.630  -2.714 -16.107
  107   2HG   ARG  13          HG1       ARG  13  -8.009  -1.592 -17.410
  108   1HD   ARG  13          HD2       ARG  13  -5.793  -3.660 -17.389
  109   2HD   ARG  13          HD1       ARG  13  -7.244  -3.680 -18.392
  110    HE   ARG  13           HE       ARG  13  -6.294  -1.532 -19.432
  111   1HH1  ARG  13          HH21      ARG  13  -4.909  -3.938 -20.497
  112   2HH1  ARG  13          HH22      ARG  13  -3.238  -3.557 -20.246
  113   1HH2  ARG  13          HH11      ARG  13  -3.883  -1.011 -17.971
  114   2HH2  ARG  13          HH12      ARG  13  -2.657  -1.897 -18.813
  115    H    ILE  14           HN       ILE  14  -4.737  -1.521 -12.817
  116    HA   ILE  14           HA       ILE  14  -3.690   1.152 -12.869
  117    HB   ILE  14           HB       ILE  14  -4.563   0.025 -10.813
  118   1HG1  ILE  14          HG12      ILE  14  -2.491   0.695  -9.353
  119   2HG1  ILE  14          HG11      ILE  14  -1.810   1.240 -10.886
  120   1HG2  ILE  14          HG21      ILE  14  -3.327  -2.168 -11.394
  121   2HG2  ILE  14          HG22      ILE  14  -3.361  -1.681  -9.700
  122   3HG2  ILE  14          HG23      ILE  14  -1.911  -1.409 -10.665
  123   1HD1  ILE  14          HD11      ILE  14  -2.931   3.136  -9.945
  124   2HD1  ILE  14          HD12      ILE  14  -4.362   2.181  -9.558
  125   3HD1  ILE  14          HD13      ILE  14  -3.973   2.544 -11.240
  126    HA   PRO  15           HA       PRO  15   0.271   0.192 -14.596
  127   1HB   PRO  15          HB2       PRO  15   1.361   2.699 -14.262
  128   2HB   PRO  15          HB1       PRO  15   0.226   2.278 -15.556
  129   1HG   PRO  15          HG2       PRO  15  -0.262   3.856 -13.072
  130   2HG   PRO  15          HG1       PRO  15  -1.094   3.934 -14.633
  131   1HD   PRO  15          HD2       PRO  15  -2.062   2.646 -12.313
  132   2HD   PRO  15          HD1       PRO  15  -2.696   2.438 -13.959
  133    H    ARG  16           HN       ARG  16   1.142   2.643 -12.156
  134    HA   ARG  16           HA       ARG  16   2.704   2.555 -10.413
  135   1HB   ARG  16          HB2       ARG  16   0.681   0.699  -9.889
  136   2HB   ARG  16          HB1       ARG  16   2.169  -0.206  -9.613
  137   1HG   ARG  16          HG2       ARG  16   1.689   0.825  -7.525
  138   2HG   ARG  16          HG1       ARG  16   2.953   1.825  -8.243
  139   1HD   ARG  16          HD2       ARG  16   1.137   3.322  -9.157
  140   2HD   ARG  16          HD1       ARG  16  -0.024   2.391  -8.211
  141    HE   ARG  16           HE       ARG  16   0.678   3.619  -6.338
  142   1HH1  ARG  16          HH11      ARG  16   2.166   5.332  -8.554
  143   2HH1  ARG  16          HH12      ARG  16   3.689   5.541  -7.758
  144   1HH2  ARG  16          HH21      ARG  16   3.077   3.097  -5.367
  145   2HH2  ARG  16          HH22      ARG  16   4.206   4.272  -5.950
  146    H    LYS  17           HN       LYS  17   4.087   2.295 -12.580
  147    HA   LYS  17           HA       LYS  17   5.579  -0.268 -12.568
  148   1HB   LYS  17          HB2       LYS  17   6.216   0.192 -14.754
  149   2HB   LYS  17          HB1       LYS  17   4.650   0.984 -14.683
  150   1HG   LYS  17          HG2       LYS  17   7.375   2.304 -14.468
  151   2HG   LYS  17          HG1       LYS  17   6.205   2.485 -15.766
  152   1HD   LYS  17          HD2       LYS  17   4.662   3.645 -14.313
  153   2HD   LYS  17          HD1       LYS  17   5.663   3.308 -12.901
  154   1HE   LYS  17          HE2       LYS  17   7.339   4.807 -13.567
  155   2HE   LYS  17          HE1       LYS  17   6.813   4.797 -15.250
  156   1HZ   LYS  17          HZ1       LYS  17   6.217   6.837 -13.978
  157   2HZ   LYS  17          HZ2       LYS  17   5.176   5.887 -13.028
  158   3HZ   LYS  17          HZ3       LYS  17   4.896   6.051 -14.696
  159    H    GLU  18           HN       GLU  18   5.946   1.563 -10.337
  160    HA   GLU  18           HA       GLU  18   8.454   2.994 -10.680
  161   1HB   GLU  18          HB2       GLU  18   7.088   2.083  -8.125
  162   2HB   GLU  18          HB1       GLU  18   8.373   3.285  -8.241
  163   1HG   GLU  18          HG2       GLU  18   6.698   4.422  -9.960
  164   2HG   GLU  18          HG1       GLU  18   5.498   3.504  -9.050
  165    H    GLU  19           HN       GLU  19   9.482   1.772  -8.003
  166    HA   GLU  19           HA       GLU  19  10.448  -0.842  -9.051
  167   1HB   GLU  19          HB2       GLU  19  11.982   1.414  -9.283
  168   2HB   GLU  19          HB1       GLU  19  12.516   0.795  -7.721
  169   1HG   GLU  19          HG2       GLU  19  13.349  -1.173  -8.628
  170   2HG   GLU  19          HG1       GLU  19  12.245  -1.129 -10.001
  171    H    ASN  20           HN       ASN  20   8.549  -0.176  -6.887
  172    HA   ASN  20           HA       ASN  20   9.794  -1.796  -4.798
  173   1HB   ASN  20          HB2       ASN  20  10.063   0.979  -4.561
  174   2HB   ASN  20          HB1       ASN  20   8.720   0.577  -3.492
  175   1HD2  ASN  20          HD21      ASN  20  12.121  -0.338  -4.212
  176   2HD2  ASN  20          HD22      ASN  20  12.454  -0.912  -2.649
  177    H    GLU  21           HN       GLU  21   7.135   0.560  -4.406
  178    HA   GLU  21           HA       GLU  21   4.876   0.228  -3.905
  179   1HB   GLU  21          HB2       GLU  21   5.515  -1.718  -6.051
  180   2HB   GLU  21          HB1       GLU  21   4.048  -2.060  -5.135
  181   1HG   GLU  21          HG2       GLU  21   3.331  -0.654  -6.909
  182   2HG   GLU  21          HG1       GLU  21   3.435   0.412  -5.509
  183    H    ILE  22           HN       ILE  22   5.053  -0.187  -1.674
  184    HA   ILE  22           HA       ILE  22   5.364  -3.046  -0.857
  185    HB   ILE  22           HB       ILE  22   5.323  -1.601   1.486
  186   1HG1  ILE  22          HG12      ILE  22   5.377   0.496  -0.054
  187   2HG1  ILE  22          HG11      ILE  22   6.538   0.419   1.256
  188   1HG2  ILE  22          HG21      ILE  22   6.958  -3.223   1.236
  189   2HG2  ILE  22          HG22      ILE  22   7.922  -1.751   1.123
  190   3HG2  ILE  22          HG23      ILE  22   7.464  -2.620  -0.341
  191   1HD1  ILE  22          HD11      ILE  22   7.192   0.917  -1.359
  192   2HD1  ILE  22          HD12      ILE  22   7.476  -0.820  -1.253
  193   3HD1  ILE  22          HD13      ILE  22   8.314   0.279  -0.159
  194    H    LEU  23           HN       LEU  23   3.825  -3.830   0.956
  195    HA   LEU  23           HA       LEU  23   1.171  -2.431   0.497
  196   1HB   LEU  23          HB2       LEU  23   0.105  -4.647   1.036
  197   2HB   LEU  23          HB1       LEU  23   1.044  -4.636  -0.451
  198    HG   LEU  23           HG       LEU  23   2.638  -5.359   1.910
  199   1HD1  LEU  23          HD11      LEU  23   1.554  -7.754   1.741
  200   2HD1  LEU  23          HD12      LEU  23   0.135  -6.860   1.195
  201   3HD1  LEU  23          HD13      LEU  23   0.823  -6.537   2.787
  202   1HD2  LEU  23          HD21      LEU  23   3.400  -5.586  -0.434
  203   2HD2  LEU  23          HD22      LEU  23   2.080  -6.713  -0.751
  204   3HD2  LEU  23          HD23      LEU  23   3.366  -7.152   0.373
  205    H    GLY  24           HN       GLY  24   0.421  -1.362   2.311
  206   1HA   GLY  24          HA2       GLY  24   1.350  -2.469   4.935
  207   2HA   GLY  24          HA1       GLY  24   1.241  -0.745   4.623
  208    H    ILE  25           HN       ILE  25   0.055  -1.967   6.780
  209    HA   ILE  25           HA       ILE  25  -2.855  -1.582   6.223
  210    HB   ILE  25           HB       ILE  25  -3.280  -3.129   8.162
  211   1HG1  ILE  25          HG12      ILE  25  -0.821  -4.584   8.122
  212   2HG1  ILE  25          HG11      ILE  25  -0.427  -2.894   8.433
  213   1HG2  ILE  25          HG21      ILE  25  -3.421  -3.952   5.851
  214   2HG2  ILE  25          HG22      ILE  25  -2.777  -5.206   6.910
  215   3HG2  ILE  25          HG23      ILE  25  -1.692  -4.299   5.856
  216   1HD1  ILE  25          HD11      ILE  25  -0.917  -4.236  10.511
  217   2HD1  ILE  25          HD12      ILE  25  -2.574  -4.414   9.935
  218   3HD1  ILE  25          HD13      ILE  25  -1.938  -2.812  10.314
  219    H    ILE  26           HN       ILE  26  -3.800  -0.031   7.604
  220    HA   ILE  26           HA       ILE  26  -1.873   1.347   9.387
  221    HB   ILE  26           HB       ILE  26  -3.664   3.147   9.497
  222   1HG1  ILE  26          HG12      ILE  26  -5.390   1.372   8.552
  223   2HG1  ILE  26          HG11      ILE  26  -5.545   3.080   8.156
  224   1HG2  ILE  26          HG21      ILE  26  -1.851   3.690   8.183
  225   2HG2  ILE  26          HG22      ILE  26  -3.173   3.800   7.021
  226   3HG2  ILE  26          HG23      ILE  26  -2.139   2.371   7.047
  227   1HD1  ILE  26          HD11      ILE  26  -3.774   1.640   6.319
  228   2HD1  ILE  26          HD12      ILE  26  -5.126   2.716   5.971
  229   3HD1  ILE  26          HD13      ILE  26  -5.421   1.019   6.323
  230    H    GLU  27           HN       GLU  27  -2.414   2.119  11.362
  231    HA   GLU  27           HA       GLU  27  -4.711   0.935  12.829
  232   1HB   GLU  27          HB2       GLU  27  -1.915   0.161  13.141
  233   2HB   GLU  27          HB1       GLU  27  -2.563   0.829  14.638
  234   1HG   GLU  27          HG2       GLU  27  -4.551  -0.716  14.355
  235   2HG   GLU  27          HG1       GLU  27  -3.672  -1.487  13.033
  236    H    GLN  28           HN       GLN  28  -5.644   2.539  14.037
  237    HA   GLN  28           HA       GLN  28  -4.147   5.091  14.383
  238   1HB   GLN  28          HB2       GLN  28  -6.947   4.362  13.965
  239   2HB   GLN  28          HB1       GLN  28  -6.747   5.483  15.312
  240   1HG   GLN  28          HG2       GLN  28  -5.400   5.947  12.648
  241   2HG   GLN  28          HG1       GLN  28  -7.036   6.513  12.967
  242   1HE2  GLN  28          HE21      GLN  28  -5.024   8.419  12.458
  243   2HE2  GLN  28          HE22      GLN  28  -4.661   9.260  13.886
  244    H    MET  29           HN       MET  29  -4.026   6.117  16.454
  245    HA   MET  29           HA       MET  29  -4.116   4.202  18.723
  246   1HB   MET  29          HB2       MET  29  -2.356   6.308  17.970
  247   2HB   MET  29          HB1       MET  29  -3.131   6.797  19.477
  248   1HG   MET  29          HG2       MET  29  -2.600   4.361  20.254
  249   2HG   MET  29          HG1       MET  29  -1.438   4.370  18.927
  250   1HE   MET  29          HE1       MET  29   0.400   5.248  18.700
  251   2HE   MET  29          HE2       MET  29   1.209   4.750  20.183
  252   3HE   MET  29          HE3       MET  29   1.299   6.430  19.661
  253    H    LEU  30           HN       LEU  30  -4.903   7.692  18.345
  254    HA   LEU  30           HA       LEU  30  -7.613   7.340  19.314
  255   1HB   LEU  30          HB2       LEU  30  -7.270   8.691  21.424
  256   2HB   LEU  30          HB1       LEU  30  -6.577   7.073  21.477
  257    HG   LEU  30           HG       LEU  30  -4.665   8.972  20.390
  258   1HD1  LEU  30          HD11      LEU  30  -4.300  10.211  22.533
  259   2HD1  LEU  30          HD12      LEU  30  -5.814   9.542  23.141
  260   3HD1  LEU  30          HD13      LEU  30  -5.824  10.629  21.752
  261   1HD2  LEU  30          HD21      LEU  30  -3.284   8.022  22.227
  262   2HD2  LEU  30          HD22      LEU  30  -4.098   6.760  21.303
  263   3HD2  LEU  30          HD23      LEU  30  -4.721   7.237  22.883
  264    H    GLY  31           HN       GLY  31  -6.775   8.538  17.017
  265   1HA   GLY  31          HA2       GLY  31  -7.524  10.523  15.900
  266   2HA   GLY  31          HA1       GLY  31  -7.578  11.353  17.455
  267    H    ALA  32           HN       ALA  32  -5.795  10.961  14.613
  268    HA   ALA  32           HA       ALA  32  -3.751  12.831  15.463
  269   1HB   ALA  32          HB1       ALA  32  -1.808  11.350  15.251
  270   2HB   ALA  32          HB2       ALA  32  -2.866   9.977  14.929
  271   3HB   ALA  32          HB3       ALA  32  -2.881  10.749  16.514
  272    H    SER  33           HN       SER  33  -2.396  13.492  13.661
  273    HA   SER  33           HA       SER  33  -3.714  13.363  11.096
  274   1HB   SER  33          HB2       SER  33  -1.090  14.469  12.072
  275   2HB   SER  33          HB1       SER  33  -1.418  14.384  10.344
  276    HG   SER  33           HG       SER  33  -2.908  15.886  10.547
  277    H    ARG  34           HN       ARG  34  -0.660  11.951  12.310
  278    HA   ARG  34           HA       ARG  34  -0.575  10.181   9.915
  279   1HB   ARG  34          HB2       ARG  34   1.477  10.905  12.022
  280   2HB   ARG  34          HB1       ARG  34   1.733   9.610  10.852
  281   1HG   ARG  34          HG2       ARG  34   1.790  11.078   9.035
  282   2HG   ARG  34          HG1       ARG  34   0.885  12.329   9.890
  283   1HD   ARG  34          HD2       ARG  34   2.849  12.635  11.414
  284   2HD   ARG  34          HD1       ARG  34   3.751  11.493  10.417
  285    HE   ARG  34           HE       ARG  34   3.594  13.114   8.559
  286   1HH1  ARG  34          HH21      ARG  34   5.038  14.597  10.697
  287   2HH1  ARG  34          HH22      ARG  34   4.151  16.081  10.793
  288   1HH2  ARG  34          HH11      ARG  34   1.381  14.840   9.100
  289   2HH2  ARG  34          HH12      ARG  34   2.074  16.220   9.886
  290    H    VAL  35           HN       VAL  35  -0.140   7.878  10.270
  291    HA   VAL  35           HA       VAL  35  -1.144   6.861  12.896
  292    HB   VAL  35           HB       VAL  35  -2.091   4.910  11.627
  293   1HG1  VAL  35          HG11      VAL  35  -3.465   6.757  12.484
  294   2HG1  VAL  35          HG12      VAL  35  -4.114   6.099  10.983
  295   3HG1  VAL  35          HG13      VAL  35  -3.232   7.627  10.968
  296   1HG2  VAL  35          HG21      VAL  35  -0.791   5.219   9.567
  297   2HG2  VAL  35          HG22      VAL  35  -1.622   6.746   9.268
  298   3HG2  VAL  35          HG23      VAL  35  -2.523   5.230   9.232
  299    H    ARG  36           HN       ARG  36  -0.628   4.519  13.158
  300    HA   ARG  36           HA       ARG  36   2.264   4.112  12.458
  301   1HB   ARG  36          HB2       ARG  36   1.883   2.099  14.143
  302   2HB   ARG  36          HB1       ARG  36   2.144   3.730  14.746
  303   1HG   ARG  36          HG2       ARG  36  -0.177   4.056  15.181
  304   2HG   ARG  36          HG1       ARG  36  -0.630   2.660  14.204
  305   1HD   ARG  36          HD2       ARG  36   1.107   2.351  16.649
  306   2HD   ARG  36          HD1       ARG  36  -0.652   2.374  16.773
  307    HE   ARG  36           HE       ARG  36  -0.202   0.483  14.821
  308   1HH1  ARG  36          HH21      ARG  36   2.488   0.095  16.142
  309   2HH1  ARG  36          HH22      ARG  36   2.138  -1.148  17.295
  310   1HH2  ARG  36          HH11      ARG  36  -1.304  -0.715  17.111
  311   2HH2  ARG  36          HH12      ARG  36  -0.015  -1.609  17.844
  312    H    VAL  37           HN       VAL  37   2.770   2.601  10.892
  313    HA   VAL  37           HA       VAL  37   0.630   0.671  10.177
  314    HB   VAL  37           HB       VAL  37   2.082   2.727   8.637
  315   1HG1  VAL  37          HG11      VAL  37   1.462   0.014   7.486
  316   2HG1  VAL  37          HG12      VAL  37   3.054   0.761   7.636
  317   3HG1  VAL  37          HG13      VAL  37   1.861   1.444   6.535
  318   1HG2  VAL  37          HG21      VAL  37   0.008   3.164   7.806
  319   2HG2  VAL  37          HG22      VAL  37  -0.486   2.322   9.273
  320   3HG2  VAL  37          HG23      VAL  37  -0.436   1.459   7.735
  321    H    ARG  38           HN       ARG  38   1.289  -1.226   9.279
  322    HA   ARG  38           HA       ARG  38   4.220  -1.857   9.332
  323   1HB   ARG  38          HB2       ARG  38   2.445  -3.027  11.080
  324   2HB   ARG  38          HB1       ARG  38   2.501  -4.182   9.767
  325   1HG   ARG  38          HG2       ARG  38   5.136  -3.614  10.007
  326   2HG   ARG  38          HG1       ARG  38   4.622  -3.385  11.679
  327   1HD   ARG  38          HD2       ARG  38   3.339  -5.685  11.194
  328   2HD   ARG  38          HD1       ARG  38   4.649  -5.869  10.027
  329    HE   ARG  38           HE       ARG  38   6.243  -5.681  11.913
  330   1HH1  ARG  38          HH11      ARG  38   4.781  -8.120  12.604
  331   2HH1  ARG  38          HH12      ARG  38   4.222  -7.815  14.215
  332   1HH2  ARG  38          HH21      ARG  38   4.708  -4.380  14.015
  333   2HH2  ARG  38          HH22      ARG  38   4.180  -5.692  15.015
  334    H    CYS  39           HN       CYS  39   4.813  -3.274   7.622
  335    HA   CYS  39           HA       CYS  39   2.646  -3.834   5.664
  336   1HB   CYS  39          HB2       CYS  39   3.324  -2.292   4.168
  337   2HB   CYS  39          HB1       CYS  39   4.236  -1.583   5.492
  338    HG   CYS  39           HG       CYS  39   6.245  -3.253   4.652
  339    H    LEU  40           HN       LEU  40   3.195  -5.233   3.951
  340    HA   LEU  40           HA       LEU  40   5.303  -7.174   4.628
  341   1HB   LEU  40          HB2       LEU  40   2.697  -7.370   3.407
  342   2HB   LEU  40          HB1       LEU  40   3.909  -8.026   2.324
  343    HG   LEU  40           HG       LEU  40   3.481  -9.909   3.578
  344   1HD1  LEU  40          HD11      LEU  40   5.886  -8.956   4.064
  345   2HD1  LEU  40          HD12      LEU  40   5.292 -10.354   4.958
  346   3HD1  LEU  40          HD13      LEU  40   5.255  -8.753   5.697
  347   1HD2  LEU  40          HD21      LEU  40   1.748  -8.801   4.952
  348   2HD2  LEU  40          HD22      LEU  40   3.010  -8.136   5.990
  349   3HD2  LEU  40          HD23      LEU  40   2.749  -9.879   5.925
  350    H    ASP  41           HN       ASP  41   6.251  -8.090   2.493
  351    HA   ASP  41           HA       ASP  41   7.629  -7.729   0.622
  352   1HB   ASP  41          HB2       ASP  41   5.763  -5.619   0.308
  353   2HB   ASP  41          HB1       ASP  41   7.340  -4.832   0.358
  354    H    GLY  42           HN       GLY  42   7.803  -7.289   3.603
  355   1HA   GLY  42          HA2       GLY  42   9.536  -7.017   5.113
  356   2HA   GLY  42          HA1       GLY  42  10.587  -6.642   3.767
  357    H    LYS  43           HN       LYS  43   7.807  -4.785   5.357
  358    HA   LYS  43           HA       LYS  43   9.882  -2.776   6.028
  359   1HB   LYS  43          HB2       LYS  43   7.972  -2.423   3.846
  360   2HB   LYS  43          HB1       LYS  43   7.995  -1.083   4.992
  361   1HG   LYS  43          HG2       LYS  43   9.841  -0.360   3.900
  362   2HG   LYS  43          HG1       LYS  43  10.685  -1.699   4.672
  363   1HD   LYS  43          HD2       LYS  43   9.651  -3.071   2.641
  364   2HD   LYS  43          HD1       LYS  43   9.639  -1.482   1.879
  365   1HE   LYS  43          HE2       LYS  43  11.993  -1.231   2.118
  366   2HE   LYS  43          HE1       LYS  43  12.097  -2.577   3.253
  367   1HZ   LYS  43          HZ1       LYS  43  11.462  -4.086   1.489
  368   2HZ   LYS  43          HZ2       LYS  43  12.843  -3.206   1.037
  369   3HZ   LYS  43          HZ3       LYS  43  11.324  -2.798   0.394
  370    H    THR  44           HN       THR  44   9.199  -1.066   7.433
  371    HA   THR  44           HA       THR  44   6.571  -1.339   8.801
  372    HB   THR  44           HB       THR  44   8.644  -2.576  10.000
  373    HG1  THR  44           HG1      THR  44   6.589  -0.997  11.113
  374   1HG2  THR  44          HG21      THR  44   9.750  -1.158  11.621
  375   2HG2  THR  44          HG22      THR  44   8.815   0.243  11.099
  376   3HG2  THR  44          HG23      THR  44  10.013  -0.471  10.018
  377    H    ARG  45           HN       ARG  45   5.720   0.723   8.683
  378    HA   ARG  45           HA       ARG  45   7.553   3.035   9.036
  379   1HB   ARG  45          HB2       ARG  45   5.902   2.444   6.587
  380   2HB   ARG  45          HB1       ARG  45   6.435   4.080   6.981
  381   1HG   ARG  45          HG2       ARG  45   8.330   3.551   5.886
  382   2HG   ARG  45          HG1       ARG  45   8.728   2.598   7.314
  383   1HD   ARG  45          HD2       ARG  45   8.884   0.912   5.789
  384   2HD   ARG  45          HD1       ARG  45   7.138   0.840   6.036
  385    HE   ARG  45           HE       ARG  45   7.704   2.749   3.985
  386   1HH1  ARG  45          HH21      ARG  45   5.883   0.194   4.181
  387   2HH1  ARG  45          HH22      ARG  45   6.454  -0.668   2.795
  388   1HH2  ARG  45          HH11      ARG  45   9.287   1.313   2.414
  389   2HH2  ARG  45          HH12      ARG  45   8.390  -0.022   1.778
  390    H    LEU  46           HN       LEU  46   6.456   5.103   9.114
  391    HA   LEU  46           HA       LEU  46   3.772   4.888  10.434
  392   1HB   LEU  46          HB2       LEU  46   6.053   6.786  10.568
  393   2HB   LEU  46          HB1       LEU  46   4.466   7.554  10.511
  394    HG   LEU  46           HG       LEU  46   3.725   6.193  12.423
  395   1HD1  LEU  46          HD11      LEU  46   6.496   5.021  12.136
  396   2HD1  LEU  46          HD12      LEU  46   4.952   4.171  12.202
  397   3HD1  LEU  46          HD13      LEU  46   5.605   4.928  13.654
  398   1HD2  LEU  46          HD21      LEU  46   4.971   8.394  12.713
  399   2HD2  LEU  46          HD22      LEU  46   6.413   7.436  13.056
  400   3HD2  LEU  46          HD23      LEU  46   5.004   7.320  14.111
  401    H    GLY  47           HN       GLY  47   2.000   5.467   9.154
  402   1HA   GLY  47          HA2       GLY  47   2.613   6.320   6.394
  403   2HA   GLY  47          HA1       GLY  47   1.078   5.674   6.953
  404    H    ARG  48           HN       ARG  48   2.015   8.171   5.469
  405    HA   ARG  48           HA       ARG  48   0.636  10.184   7.163
  406   1HB   ARG  48          HB2       ARG  48   1.825  11.906   5.944
  407   2HB   ARG  48          HB1       ARG  48   2.990  10.728   6.533
  408   1HG   ARG  48          HG2       ARG  48   3.727  10.703   4.380
  409   2HG   ARG  48          HG1       ARG  48   2.333   9.661   4.094
  410   1HD   ARG  48          HD2       ARG  48   1.730  11.235   2.572
  411   2HD   ARG  48          HD1       ARG  48   1.185  12.149   3.976
  412    HE   ARG  48           HE       ARG  48   3.893  12.781   3.715
  413   1HH1  ARG  48          HH11      ARG  48   1.408  14.594   3.315
  414   2HH1  ARG  48          HH12      ARG  48   1.749  15.242   1.745
  415   1HH2  ARG  48          HH21      ARG  48   4.197  12.885   1.014
  416   2HH2  ARG  48          HH22      ARG  48   3.333  14.271   0.439
  417    H    ILE  49           HN       ILE  49  -0.945  11.525   6.157
  418    HA   ILE  49           HA       ILE  49  -1.897  10.575   3.488
  419    HB   ILE  49           HB       ILE  49  -4.251  10.765   4.351
  420   1HG1  ILE  49          HG12      ILE  49  -3.774  10.397   7.123
  421   2HG1  ILE  49          HG11      ILE  49  -2.852  11.823   6.646
  422   1HG2  ILE  49          HG21      ILE  49  -3.177   8.779   6.201
  423   2HG2  ILE  49          HG22      ILE  49  -2.416   8.690   4.613
  424   3HG2  ILE  49          HG23      ILE  49  -4.167   8.550   4.760
  425   1HD1  ILE  49          HD11      ILE  49  -5.410  12.030   7.320
  426   2HD1  ILE  49          HD12      ILE  49  -5.660  11.544   5.643
  427   3HD1  ILE  49          HD13      ILE  49  -4.742  13.005   6.012
  428    HA   PRO  50           HA       PRO  50  -2.428  14.827   2.514
  429   1HB   PRO  50          HB2       PRO  50  -4.653  14.739   0.896
  430   2HB   PRO  50          HB1       PRO  50  -3.045  14.187   0.394
  431   1HG   PRO  50          HG2       PRO  50  -5.437  12.569   1.151
  432   2HG   PRO  50          HG1       PRO  50  -4.097  12.154   0.069
  433   1HD   PRO  50          HD2       PRO  50  -4.403  11.254   2.724
  434   2HD   PRO  50          HD1       PRO  50  -2.913  11.160   1.762
  435    H    GLY  51           HN       GLY  51  -5.660  13.393   3.228
  436   1HA   GLY  51          HA2       GLY  51  -6.589  14.416   5.449
  437   2HA   GLY  51          HA1       GLY  51  -6.408  15.943   4.586
  438    H    ARG  52           HN       ARG  52  -7.199  14.897   1.986
  439    HA   ARG  52           HA       ARG  52 -10.004  15.323   2.064
  440   1HB   ARG  52          HB2       ARG  52  -8.355  15.379   0.049
  441   2HB   ARG  52          HB1       ARG  52  -8.689  13.652  -0.075
  442   1HG   ARG  52          HG2       ARG  52 -11.035  15.476   0.194
  443   2HG   ARG  52          HG1       ARG  52 -10.184  15.477  -1.351
  444   1HD   ARG  52          HD2       ARG  52 -10.706  12.793  -0.226
  445   2HD   ARG  52          HD1       ARG  52 -12.147  13.693  -0.695
  446    HE   ARG  52           HE       ARG  52 -11.351  13.700  -2.980
  447   1HH1  ARG  52          HH11      ARG  52 -10.900  10.814  -2.179
  448   2HH1  ARG  52          HH12      ARG  52  -9.285  10.544  -2.743
  449   1HH2  ARG  52          HH21      ARG  52  -8.558  13.923  -3.091
  450   2HH2  ARG  52          HH22      ARG  52  -7.956  12.308  -3.261
  451    H    LEU  53           HN       LEU  53  -8.143  12.281   2.020
  452    HA   LEU  53           HA       LEU  53 -10.337  10.479   1.819
  453   1HB   LEU  53          HB2       LEU  53  -7.602  10.214   3.085
  454   2HB   LEU  53          HB1       LEU  53  -8.744   8.872   3.014
  455    HG   LEU  53           HG       LEU  53  -8.296  10.338   0.469
  456   1HD1  LEU  53          HD11      LEU  53  -6.010  10.130   1.553
  457   2HD1  LEU  53          HD12      LEU  53  -6.178   9.305   0.004
  458   3HD1  LEU  53          HD13      LEU  53  -6.231   8.381   1.505
  459   1HD2  LEU  53          HD21      LEU  53  -8.388   8.014  -0.401
  460   2HD2  LEU  53          HD22      LEU  53  -9.779   8.378   0.620
  461   3HD2  LEU  53          HD23      LEU  53  -8.449   7.409   1.254
  462    H    LYS  54           HN       LYS  54  -8.872  12.046   4.661
  463    HA   LYS  54           HA       LYS  54 -10.230  10.612   6.700
  464   1HB   LYS  54          HB2       LYS  54  -8.373  12.442   6.861
  465   2HB   LYS  54          HB1       LYS  54  -9.726  13.572   6.916
  466   1HG   LYS  54          HG2       LYS  54 -10.514  11.639   8.717
  467   2HG   LYS  54          HG1       LYS  54  -8.769  11.694   8.970
  468   1HD   LYS  54          HD2       LYS  54  -9.031  13.579  10.169
  469   2HD   LYS  54          HD1       LYS  54  -9.638  14.385   8.723
  470   1HE   LYS  54          HE2       LYS  54 -11.899  13.830   9.237
  471   2HE   LYS  54          HE1       LYS  54 -11.409  12.659  10.462
  472   1HZ   LYS  54          HZ1       LYS  54 -10.509  14.472  11.784
  473   2HZ   LYS  54          HZ2       LYS  54 -12.160  14.720  11.466
  474   3HZ   LYS  54          HZ3       LYS  54 -10.986  15.597  10.606
  475    H    ASN  55           HN       ASN  55 -11.282  13.430   4.794
  476    HA   ASN  55           HA       ASN  55 -13.816  13.652   6.244
  477   1HB   ASN  55          HB2       ASN  55 -12.315  15.339   4.593
  478   2HB   ASN  55          HB1       ASN  55 -13.759  14.972   3.649
  479   1HD2  ASN  55          HD21      ASN  55 -15.903  15.393   4.759
  480   2HD2  ASN  55          HD22      ASN  55 -15.983  16.600   5.949
  481    H    ARG  56           HN       ARG  56 -12.661  11.920   3.434
  482    HA   ARG  56           HA       ARG  56 -15.463  11.297   2.622
  483   1HB   ARG  56          HB2       ARG  56 -13.655  12.134   0.964
  484   2HB   ARG  56          HB1       ARG  56 -12.983  10.509   1.100
  485   1HG   ARG  56          HG2       ARG  56 -14.499   9.784  -0.395
  486   2HG   ARG  56          HG1       ARG  56 -15.783  10.207   0.736
  487   1HD   ARG  56          HD2       ARG  56 -15.618  12.588  -0.139
  488   2HD   ARG  56          HD1       ARG  56 -14.569  11.961  -1.412
  489    HE   ARG  56           HE       ARG  56 -17.467  11.424  -1.136
  490   1HH1  ARG  56          HH11      ARG  56 -16.019   8.911  -1.932
  491   2HH1  ARG  56          HH12      ARG  56 -16.023   9.027  -3.660
  492   1HH2  ARG  56          HH21      ARG  56 -16.800  12.411  -3.698
  493   2HH2  ARG  56          HH22      ARG  56 -16.466  11.012  -4.661
  494    H    ILE  57           HN       ILE  57 -13.928  10.080   4.976
  495    HA   ILE  57           HA       ILE  57 -14.346   7.241   4.157
  496    HB   ILE  57           HB       ILE  57 -11.894   7.848   4.301
  497   1HG1  ILE  57          HG12      ILE  57 -11.348   5.869   5.813
  498   2HG1  ILE  57          HG11      ILE  57 -13.077   5.756   6.136
  499   1HG2  ILE  57          HG21      ILE  57 -12.291   7.854   7.288
  500   2HG2  ILE  57          HG22      ILE  57 -12.360   9.356   6.366
  501   3HG2  ILE  57          HG23      ILE  57 -10.888   8.386   6.361
  502   1HD1  ILE  57          HD11      ILE  57 -12.121   5.877   3.293
  503   2HD1  ILE  57          HD12      ILE  57 -13.583   5.139   3.946
  504   3HD1  ILE  57          HD13      ILE  57 -12.022   4.353   4.175
  505    H    TRP  58           HN       TRP  58 -15.076   5.862   5.826
  506    HA   TRP  58           HA       TRP  58 -15.857   7.132   8.402
  507   1HB   TRP  58          HB2       TRP  58 -17.706   5.776   6.431
  508   2HB   TRP  58          HB1       TRP  58 -18.121   5.945   8.134
  509    HD1  TRP  58           HD1      TRP  58 -17.460   8.722   8.942
  510    HE1  TRP  58           HE1      TRP  58 -18.440  10.819   7.809
  511    HE3  TRP  58           HE3      TRP  58 -18.835   6.735   4.440
  512    HZ2  TRP  58           HZ2      TRP  58 -19.648  11.557   5.326
  513    HZ3  TRP  58           HZ3      TRP  58 -19.900   8.158   2.713
  514    HH2  TRP  58           HH2      TRP  58 -20.307  10.565   3.150
  515    H    VAL  59           HN       VAL  59 -13.728   5.387   8.050
  516    HA   VAL  59           HA       VAL  59 -14.756   2.776   9.090
  517    HB   VAL  59           HB       VAL  59 -12.638   1.790   8.325
  518   1HG1  VAL  59          HG11      VAL  59 -13.865   3.470   6.120
  519   2HG1  VAL  59          HG12      VAL  59 -14.608   2.008   6.771
  520   3HG1  VAL  59          HG13      VAL  59 -13.052   1.914   5.946
  521   1HG2  VAL  59          HG21      VAL  59 -11.021   3.490   8.506
  522   2HG2  VAL  59          HG22      VAL  59 -12.022   4.666   7.656
  523   3HG2  VAL  59          HG23      VAL  59 -11.249   3.357   6.762
  524    H    ARG  60           HN       ARG  60 -13.122   1.692  10.607
  525    HA   ARG  60           HA       ARG  60 -12.060   3.734  12.521
  526   1HB   ARG  60          HB2       ARG  60 -12.451   2.049  14.289
  527   2HB   ARG  60          HB1       ARG  60 -13.941   2.410  13.420
  528   1HG   ARG  60          HG2       ARG  60 -14.056   0.328  12.471
  529   2HG   ARG  60          HG1       ARG  60 -12.305   0.184  12.322
  530   1HD   ARG  60          HD2       ARG  60 -13.109  -1.420  13.977
  531   2HD   ARG  60          HD1       ARG  60 -12.158  -0.176  14.785
  532    HE   ARG  60           HE       ARG  60 -14.990   0.475  14.752
  533   1HH1  ARG  60          HH21      ARG  60 -13.150   1.067  17.037
  534   2HH1  ARG  60          HH22      ARG  60 -13.668  -0.075  18.232
  535   1HH2  ARG  60          HH11      ARG  60 -15.398  -2.061  15.967
  536   2HH2  ARG  60          HH12      ARG  60 -14.944  -1.850  17.624
  537    H    GLU  61           HN       GLU  61 -10.560   1.900  14.102
  538    HA   GLU  61           HA       GLU  61  -8.075   1.829  12.726
  539   1HB   GLU  61          HB2       GLU  61  -7.311   0.368  14.593
  540   2HB   GLU  61          HB1       GLU  61  -8.188   1.784  15.167
  541   1HG   GLU  61          HG2       GLU  61 -10.030  -0.396  14.650
  542   2HG   GLU  61          HG1       GLU  61  -8.759  -0.915  15.757
  543    H    GLY  62           HN       GLY  62  -6.885   0.071  11.822
  544   1HA   GLY  62          HA2       GLY  62  -6.585  -2.126  10.941
  545   2HA   GLY  62          HA1       GLY  62  -8.237  -2.520  11.418
  546    H    ASP  63           HN       ASP  63  -6.368  -0.602   9.051
  547    HA   ASP  63           HA       ASP  63  -8.566  -1.131   7.073
  548   1HB   ASP  63          HB2       ASP  63  -7.894   1.393   8.146
  549   2HB   ASP  63          HB1       ASP  63  -7.221   1.370   6.517
  550    H    VAL  64           HN       VAL  64  -7.763  -0.990   4.725
  551    HA   VAL  64           HA       VAL  64  -4.907  -1.893   4.689
  552    HB   VAL  64           HB       VAL  64  -5.370  -2.712   2.390
  553   1HG1  VAL  64          HG11      VAL  64  -5.518  -4.141   4.406
  554   2HG1  VAL  64          HG12      VAL  64  -6.612  -4.663   3.123
  555   3HG1  VAL  64          HG13      VAL  64  -7.240  -3.776   4.513
  556   1HG2  VAL  64          HG21      VAL  64  -8.217  -1.962   3.094
  557   2HG2  VAL  64          HG22      VAL  64  -7.720  -2.874   1.670
  558   3HG2  VAL  64          HG23      VAL  64  -7.222  -1.194   1.857
  559    H    VAL  65           HN       VAL  65  -3.443  -0.983   3.344
  560    HA   VAL  65           HA       VAL  65  -4.212   1.446   1.811
  561    HB   VAL  65           HB       VAL  65  -2.148   2.598   2.861
  562   1HG1  VAL  65          HG11      VAL  65  -4.099   3.648   3.450
  563   2HG1  VAL  65          HG12      VAL  65  -3.611   3.045   5.027
  564   3HG1  VAL  65          HG13      VAL  65  -4.828   2.180   4.091
  565   1HG2  VAL  65          HG21      VAL  65  -2.715   0.459   4.936
  566   2HG2  VAL  65          HG22      VAL  65  -1.698   1.873   5.205
  567   3HG2  VAL  65          HG23      VAL  65  -1.223   0.659   4.018
  568    H    ILE  66           HN       ILE  66  -2.585   2.201   0.355
  569    HA   ILE  66           HA       ILE  66  -0.594   0.102  -0.422
  570    HB   ILE  66           HB       ILE  66  -0.719   0.854  -2.621
  571   1HG1  ILE  66          HG12      ILE  66  -1.573   3.595  -1.628
  572   2HG1  ILE  66          HG11      ILE  66   0.073   3.148  -2.069
  573   1HG2  ILE  66          HG21      ILE  66  -2.973   1.146  -3.249
  574   2HG2  ILE  66          HG22      ILE  66  -3.358   2.048  -1.784
  575   3HG2  ILE  66          HG23      ILE  66  -3.073   0.309  -1.699
  576   1HD1  ILE  66          HD11      ILE  66  -2.347   3.230  -3.888
  577   2HD1  ILE  66          HD12      ILE  66  -0.801   2.524  -4.356
  578   3HD1  ILE  66          HD13      ILE  66  -0.907   4.243  -3.980
  579    H    VAL  67           HN       VAL  67   1.597   0.649   0.000
  580    HA   VAL  67           HA       VAL  67   1.951   3.426   1.041
  581    HB   VAL  67           HB       VAL  67   3.241   2.656   2.822
  582   1HG1  VAL  67          HG11      VAL  67   0.740   1.741   2.597
  583   2HG1  VAL  67          HG12      VAL  67   1.767   1.306   3.963
  584   3HG1  VAL  67          HG13      VAL  67   1.578   0.191   2.611
  585   1HG2  VAL  67          HG21      VAL  67   3.936   0.130   2.821
  586   2HG2  VAL  67          HG22      VAL  67   4.882   1.283   1.879
  587   3HG2  VAL  67          HG23      VAL  67   3.698   0.250   1.076
  588    H    LYS  68           HN       LYS  68   3.918   4.394   0.978
  589    HA   LYS  68           HA       LYS  68   5.783   3.573  -1.194
  590   1HB   LYS  68          HB2       LYS  68   4.523   6.128  -0.528
  591   2HB   LYS  68          HB1       LYS  68   6.274   6.254  -0.691
  592   1HG   LYS  68          HG2       LYS  68   6.063   5.018  -2.891
  593   2HG   LYS  68          HG1       LYS  68   4.315   5.188  -2.740
  594   1HD   LYS  68          HD2       LYS  68   4.732   7.109  -3.931
  595   2HD   LYS  68          HD1       LYS  68   5.003   7.747  -2.310
  596   1HE   LYS  68          HE2       LYS  68   6.974   8.427  -3.293
  597   2HE   LYS  68          HE1       LYS  68   7.473   6.818  -2.775
  598   1HZ   LYS  68          HZ1       LYS  68   8.021   7.280  -5.107
  599   2HZ   LYS  68          HZ2       LYS  68   6.369   7.470  -5.455
  600   3HZ   LYS  68          HZ3       LYS  68   6.966   5.961  -4.949
  601    HA   PRO  69           HA       PRO  69   8.779   3.418   2.083
  602   1HB   PRO  69          HB2       PRO  69  11.021   3.237   0.543
  603   2HB   PRO  69          HB1       PRO  69   9.869   1.907   0.726
  604   1HG   PRO  69          HG2       PRO  69  10.347   3.641  -1.634
  605   2HG   PRO  69          HG1       PRO  69   9.589   2.043  -1.556
  606   1HD   PRO  69          HD2       PRO  69   8.265   4.594  -1.757
  607   2HD   PRO  69          HD1       PRO  69   7.511   2.991  -1.610
  608    H    TRP  70           HN       TRP  70  10.034   4.800   3.268
  609    HA   TRP  70           HA       TRP  70  10.912   7.394   2.047
  610   1HB   TRP  70          HB2       TRP  70   9.802   6.830   4.782
  611   2HB   TRP  70          HB1       TRP  70  10.728   8.278   4.436
  612    HD1  TRP  70           HD1      TRP  70   8.316   6.515   2.166
  613    HE1  TRP  70           HE1      TRP  70   6.479   8.086   1.669
  614    HE3  TRP  70           HE3      TRP  70   9.602  10.398   5.187
  615    HZ2  TRP  70           HZ2      TRP  70   5.549  10.645   2.404
  616    HZ3  TRP  70           HZ3      TRP  70   8.179  12.432   5.267
  617    HH2  TRP  70           HH2      TRP  70   6.135  12.568   3.863
  618    H    GLU  71           HN       GLU  71  13.270   7.421   2.187
  619    HA   GLU  71           HA       GLU  71  14.710   5.525   3.839
  620   1HB   GLU  71          HB2       GLU  71  16.725   6.953   3.257
  621   2HB   GLU  71          HB1       GLU  71  15.841   6.290   1.889
  622   1HG   GLU  71          HG2       GLU  71  15.436   8.363   1.097
  623   2HG   GLU  71          HG1       GLU  71  14.697   8.834   2.627
  624    H    VAL  72           HN       VAL  72  15.476   5.720   5.881
  625    HA   VAL  72           HA       VAL  72  16.182   8.079   7.262
  626    HB   VAL  72           HB       VAL  72  13.953   8.886   7.271
  627   1HG1  VAL  72          HG11      VAL  72  12.315   6.943   8.436
  628   2HG1  VAL  72          HG12      VAL  72  13.284   6.054   7.261
  629   3HG1  VAL  72          HG13      VAL  72  12.317   7.434   6.742
  630   1HG2  VAL  72          HG21      VAL  72  15.128   8.726   9.545
  631   2HG2  VAL  72          HG22      VAL  72  14.071   7.354   9.878
  632   3HG2  VAL  72          HG23      VAL  72  13.378   8.949   9.585
  633    H    GLN  73           HN       GLN  73  17.717   7.055   8.421
  634    HA   GLN  73           HA       GLN  73  17.715   4.377   9.307
  635   1HB   GLN  73          HB2       GLN  73  19.485   5.147  10.946
  636   2HB   GLN  73          HB1       GLN  73  19.784   5.596   9.270
  637   1HG   GLN  73          HG2       GLN  73  19.168   7.851   9.640
  638   2HG   GLN  73          HG1       GLN  73  18.350   7.470  11.155
  639   1HE2  GLN  73          HE21      GLN  73  21.516   8.021   9.674
  640   2HE2  GLN  73          HE22      GLN  73  22.383   8.086  11.130
  641    H    GLY  74           HN       GLY  74  17.090   3.345  11.201
  642   1HA   GLY  74          HA2       GLY  74  16.375   3.362  13.545
  643   2HA   GLY  74          HA1       GLY  74  15.703   4.970  13.286
  644    H    ASP  75           HN       ASP  75  14.290   4.524  10.890
  645    HA   ASP  75           HA       ASP  75  12.567   2.209  10.975
  646   1HB   ASP  75          HB2       ASP  75  10.502   3.373  11.723
  647   2HB   ASP  75          HB1       ASP  75  11.694   3.286  13.015
  648    H    GLN  76           HN       GLN  76  10.730   2.531   9.266
  649    HA   GLN  76           HA       GLN  76  11.774   4.556   7.325
  650   1HB   GLN  76          HB2       GLN  76  10.380   1.925   7.032
  651   2HB   GLN  76          HB1       GLN  76  10.191   3.130   5.758
  652   1HG   GLN  76          HG2       GLN  76  12.917   3.192   6.305
  653   2HG   GLN  76          HG1       GLN  76  12.511   1.479   6.416
  654   1HE2  GLN  76          HE21      GLN  76  13.586   3.684   4.211
  655   2HE2  GLN  76          HE22      GLN  76  12.917   3.035   2.793
  656    H    LYS  77           HN       LYS  77  10.262   5.778   6.051
  657    HA   LYS  77           HA       LYS  77   7.686   6.334   7.503
  658   1HB   LYS  77          HB2       LYS  77   9.662   8.099   6.162
  659   2HB   LYS  77          HB1       LYS  77   7.961   8.501   5.931
  660   1HG   LYS  77          HG2       LYS  77   8.356   9.654   7.892
  661   2HG   LYS  77          HG1       LYS  77   7.882   8.094   8.564
  662   1HD   LYS  77          HD2       LYS  77  10.006   7.590   9.255
  663   2HD   LYS  77          HD1       LYS  77  10.756   8.391   7.875
  664   1HE   LYS  77          HE2       LYS  77   9.375   9.981  10.036
  665   2HE   LYS  77          HE1       LYS  77  11.058   9.482  10.204
  666   1HZ   LYS  77          HZ1       LYS  77  10.915  11.669   9.222
  667   2HZ   LYS  77          HZ2       LYS  77   9.925  11.085   7.973
  668   3HZ   LYS  77          HZ3       LYS  77  11.541  10.573   8.089
  669    H    CYS  78           HN       CYS  78   5.774   6.664   6.091
  670    HA   CYS  78           HA       CYS  78   6.253   5.747   3.314
  671   1HB   CYS  78          HB2       CYS  78   4.446   4.051   3.486
  672   2HB   CYS  78          HB1       CYS  78   5.812   3.681   4.535
  673    HG   CYS  78           HG       CYS  78   3.885   3.472   6.162
  674    H    ASP  79           HN       ASP  79   4.596   6.208   1.833
  675    HA   ASP  79           HA       ASP  79   2.688   8.339   2.844
  676   1HB   ASP  79          HB2       ASP  79   4.290   8.275   0.546
  677   2HB   ASP  79          HB1       ASP  79   2.715   7.762  -0.060
  678    H    ILE  80           HN       ILE  80   0.700   7.483   3.328
  679    HA   ILE  80           HA       ILE  80   0.012   4.938   1.931
  680    HB   ILE  80           HB       ILE  80   0.217   5.641   4.725
  681   1HG1  ILE  80          HG12      ILE  80  -0.586   2.958   3.650
  682   2HG1  ILE  80          HG11      ILE  80   1.004   3.610   3.260
  683   1HG2  ILE  80          HG21      ILE  80  -2.152   6.002   4.787
  684   2HG2  ILE  80          HG22      ILE  80  -1.874   4.378   5.416
  685   3HG2  ILE  80          HG23      ILE  80  -2.455   4.596   3.767
  686   1HD1  ILE  80          HD11      ILE  80   0.601   4.047   6.035
  687   2HD1  ILE  80          HD12      ILE  80   1.740   2.938   5.273
  688   3HD1  ILE  80          HD13      ILE  80   0.125   2.381   5.705
  689    H    ILE  81           HN       ILE  81  -1.921   4.627   1.072
  690    HA   ILE  81           HA       ILE  81  -4.022   6.755   1.399
  691    HB   ILE  81           HB       ILE  81  -2.999   6.506  -0.950
  692   1HG1  ILE  81          HG12      ILE  81  -5.892   5.787  -1.126
  693   2HG1  ILE  81          HG11      ILE  81  -5.465   7.223  -0.196
  694   1HG2  ILE  81          HG21      ILE  81  -4.698   4.035  -1.175
  695   2HG2  ILE  81          HG22      ILE  81  -3.017   3.909  -0.660
  696   3HG2  ILE  81          HG23      ILE  81  -3.407   4.595  -2.237
  697   1HD1  ILE  81          HD11      ILE  81  -5.836   7.945  -2.460
  698   2HD1  ILE  81          HD12      ILE  81  -4.816   6.656  -3.098
  699   3HD1  ILE  81          HD13      ILE  81  -4.094   7.983  -2.188
  700    H    TRP  82           HN       TRP  82  -5.741   5.925   2.588
  701    HA   TRP  82           HA       TRP  82  -5.825   2.982   2.886
  702   1HB   TRP  82          HB2       TRP  82  -7.205   3.359   4.865
  703   2HB   TRP  82          HB1       TRP  82  -5.727   4.307   4.943
  704    HD1  TRP  82           HD1      TRP  82  -9.275   4.946   3.484
  705    HE1  TRP  82           HE1      TRP  82 -10.010   7.302   4.218
  706    HE3  TRP  82           HE3      TRP  82  -5.179   6.348   6.188
  707    HZ2  TRP  82           HZ2      TRP  82  -9.004   9.487   5.757
  708    HZ3  TRP  82           HZ3      TRP  82  -5.096   8.570   7.281
  709    HH2  TRP  82           HH2      TRP  82  -7.003  10.141   7.068
  710    H    ARG  83           HN       ARG  83  -7.802   1.843   3.037
  711    HA   ARG  83           HA       ARG  83 -10.297   2.809   2.011
  712   1HB   ARG  83          HB2       ARG  83  -8.825   2.802  -0.080
  713   2HB   ARG  83          HB1       ARG  83  -8.747   1.051   0.085
  714   1HG   ARG  83          HG2       ARG  83 -10.528   1.709  -1.488
  715   2HG   ARG  83          HG1       ARG  83 -11.208   0.921  -0.067
  716   1HD   ARG  83          HD2       ARG  83 -11.122   3.611   0.657
  717   2HD   ARG  83          HD1       ARG  83 -11.596   3.652  -1.041
  718    HE   ARG  83           HE       ARG  83 -13.316   1.794  -0.156
  719   1HH1  ARG  83          HH21      ARG  83 -14.056   4.763  -0.293
  720   2HH1  ARG  83          HH22      ARG  83 -14.722   5.011   1.287
  721   1HH2  ARG  83          HH11      ARG  83 -13.395   2.079   2.598
  722   2HH2  ARG  83          HH12      ARG  83 -14.348   3.486   2.926
  723    H    TYR  84           HN       TYR  84 -11.829   0.955   1.727
  724    HA   TYR  84           HA       TYR  84 -11.119  -1.738   2.430
  725   1HB   TYR  84          HB2       TYR  84 -11.131  -0.122   4.650
  726   2HB   TYR  84          HB1       TYR  84 -12.803  -0.684   4.623
  727    HD1  TYR  84           HD1      TYR  84 -12.614  -3.377   3.509
  728    HD2  TYR  84           HD2      TYR  84 -10.008  -1.379   6.276
  729    HE1  TYR  84           HE1      TYR  84 -11.878  -5.570   4.400
  730    HE2  TYR  84           HE2      TYR  84  -9.272  -3.572   7.168
  731    HH   TYR  84           HH       TYR  84  -9.360  -6.224   5.822
  732    H    THR  85           HN       THR  85 -12.562  -2.623   1.023
  733    HA   THR  85           HA       THR  85 -15.432  -2.211   1.500
  734    HB   THR  85           HB       THR  85 -14.880  -0.360  -0.045
  735    HG1  THR  85           HG1      THR  85 -16.854  -0.965  -0.509
  736   1HG2  THR  85          HG21      THR  85 -13.924  -0.700  -2.183
  737   2HG2  THR  85          HG22      THR  85 -14.175  -2.444  -2.111
  738   3HG2  THR  85          HG23      THR  85 -12.940  -1.688  -1.104
  739    H    LYS  86           HN       LYS  86 -12.943  -3.757  -0.567
  740    HA   LYS  86           HA       LYS  86 -14.380  -6.316  -0.282
  741   1HB   LYS  86          HB2       LYS  86 -15.280  -5.059  -2.341
  742   2HB   LYS  86          HB1       LYS  86 -13.699  -5.353  -3.064
  743   1HG   LYS  86          HG2       LYS  86 -14.079  -7.595  -3.308
  744   2HG   LYS  86          HG1       LYS  86 -14.996  -7.707  -1.807
  745   1HD   LYS  86          HD2       LYS  86 -16.653  -8.040  -3.431
  746   2HD   LYS  86          HD1       LYS  86 -16.798  -6.316  -3.092
  747   1HE   LYS  86          HE2       LYS  86 -14.812  -6.929  -5.169
  748   2HE   LYS  86          HE1       LYS  86 -16.451  -7.417  -5.602
  749   1HZ   LYS  86          HZ1       LYS  86 -16.094  -5.160  -6.275
  750   2HZ   LYS  86          HZ2       LYS  86 -15.577  -4.719  -4.717
  751   3HZ   LYS  86          HZ3       LYS  86 -17.195  -5.166  -4.985
  752    H    THR  87           HN       THR  87 -11.813  -4.984  -2.430
  753    HA   THR  87           HA       THR  87  -9.879  -6.850  -1.131
  754    HB   THR  87           HB       THR  87  -9.011  -7.529  -3.335
  755    HG1  THR  87           HG1      THR  87  -9.500  -6.273  -4.926
  756   1HG2  THR  87          HG21      THR  87 -10.688  -9.093  -3.831
  757   2HG2  THR  87          HG22      THR  87 -11.986  -7.963  -3.442
  758   3HG2  THR  87          HG23      THR  87 -11.022  -8.675  -2.150
  759    H    GLN  88           HN       GLN  88  -7.694  -6.139  -1.218
  760    HA   GLN  88           HA       GLN  88  -6.921  -3.744  -2.681
  761   1HB   GLN  88          HB2       GLN  88  -8.239  -3.186  -0.357
  762   2HB   GLN  88          HB1       GLN  88  -6.578  -3.293   0.225
  763   1HG   GLN  88          HG2       GLN  88  -6.705  -1.049  -0.404
  764   2HG   GLN  88          HG1       GLN  88  -6.043  -1.787  -1.864
  765   1HE2  GLN  88          HE21      GLN  88  -7.252  -1.543  -3.780
  766   2HE2  GLN  88          HE22      GLN  88  -8.830  -0.920  -3.840
  767    H    VAL  89           HN       VAL  89  -5.981  -5.313   0.415
  768    HA   VAL  89           HA       VAL  89  -3.173  -5.169  -0.065
  769    HB   VAL  89           HB       VAL  89  -4.754  -7.097   1.666
  770   1HG1  VAL  89          HG11      VAL  89  -2.566  -7.380   2.863
  771   2HG1  VAL  89          HG12      VAL  89  -1.785  -6.484   1.560
  772   3HG1  VAL  89          HG13      VAL  89  -2.551  -8.037   1.226
  773   1HG2  VAL  89          HG21      VAL  89  -4.820  -4.543   2.074
  774   2HG2  VAL  89          HG22      VAL  89  -3.125  -4.703   2.532
  775   3HG2  VAL  89          HG23      VAL  89  -4.368  -5.565   3.437
  776    H    GLU  90           HN       GLU  90  -5.583  -7.596  -0.981
  777    HA   GLU  90           HA       GLU  90  -3.882  -9.719  -1.756
  778   1HB   GLU  90          HB2       GLU  90  -6.462  -8.780  -3.055
  779   2HB   GLU  90          HB1       GLU  90  -5.698 -10.343  -3.345
  780   1HG   GLU  90          HG2       GLU  90  -6.846 -11.138  -1.576
  781   2HG   GLU  90          HG1       GLU  90  -5.832 -10.123  -0.550
  782    H    TRP  91           HN       TRP  91  -5.089  -7.003  -3.777
  783    HA   TRP  91           HA       TRP  91  -3.485  -7.672  -6.070
  784   1HB   TRP  91          HB2       TRP  91  -5.323  -5.568  -5.307
  785   2HB   TRP  91          HB1       TRP  91  -3.906  -4.883  -6.103
  786    HD1  TRP  91           HD1      TRP  91  -7.143  -6.255  -6.920
  787    HE1  TRP  91           HE1      TRP  91  -7.254  -7.065  -9.366
  788    HE3  TRP  91           HE3      TRP  91  -2.164  -6.322  -8.052
  789    HZ2  TRP  91           HZ2      TRP  91  -5.466  -7.663 -11.516
  790    HZ3  TRP  91           HZ3      TRP  91  -1.397  -7.018 -10.303
  791    HH2  TRP  91           HH2      TRP  91  -3.040  -7.688 -12.035
  792    H    LEU  92           HN       LEU  92  -2.952  -5.535  -3.276
  793    HA   LEU  92           HA       LEU  92  -0.523  -4.312  -4.116
  794   1HB   LEU  92          HB2       LEU  92  -1.453  -5.094  -1.331
  795   2HB   LEU  92          HB1       LEU  92  -0.067  -4.056  -1.658
  796    HG   LEU  92           HG       LEU  92  -2.717  -3.364  -2.886
  797   1HD1  LEU  92          HD11      LEU  92  -2.534  -1.861  -0.529
  798   2HD1  LEU  92          HD12      LEU  92  -2.172  -3.510  -0.025
  799   3HD1  LEU  92          HD13      LEU  92  -3.686  -3.154  -0.855
  800   1HD2  LEU  92          HD21      LEU  92  -0.940  -1.976  -3.602
  801   2HD2  LEU  92          HD22      LEU  92  -0.219  -1.922  -1.993
  802   3HD2  LEU  92          HD23      LEU  92  -1.712  -1.044  -2.320
  803    H    LYS  93           HN       LYS  93  -1.134  -7.414  -2.492
  804    HA   LYS  93           HA       LYS  93   1.598  -8.157  -2.055
  805   1HB   LYS  93          HB2       LYS  93  -1.016  -9.630  -2.221
  806   2HB   LYS  93          HB1       LYS  93   0.487 -10.550  -2.189
  807   1HG   LYS  93          HG2       LYS  93   1.112  -9.662  -0.072
  808   2HG   LYS  93          HG1       LYS  93  -0.100  -8.383  -0.167
  809   1HD   LYS  93          HD2       LYS  93  -1.817  -9.772   0.459
  810   2HD   LYS  93          HD1       LYS  93  -1.105 -11.180  -0.328
  811   1HE   LYS  93          HE2       LYS  93   0.270 -10.002   2.065
  812   2HE   LYS  93          HE1       LYS  93  -1.147 -11.022   2.307
  813   1HZ   LYS  93          HZ1       LYS  93   0.802 -12.380   2.352
  814   2HZ   LYS  93          HZ2       LYS  93   1.349 -11.751   0.872
  815   3HZ   LYS  93          HZ3       LYS  93  -0.044 -12.725   0.922
  816    H    ARG  94           HN       ARG  94  -0.673  -9.115  -4.670
  817    HA   ARG  94           HA       ARG  94   1.151 -10.610  -6.234
  818   1HB   ARG  94          HB2       ARG  94  -1.442  -9.300  -6.659
  819   2HB   ARG  94          HB1       ARG  94  -0.451  -9.362  -8.116
  820   1HG   ARG  94          HG2       ARG  94  -0.144 -11.785  -7.824
  821   2HG   ARG  94          HG1       ARG  94  -1.107 -11.737  -6.347
  822   1HD   ARG  94          HD2       ARG  94  -3.095 -11.243  -7.510
  823   2HD   ARG  94          HD1       ARG  94  -2.226 -10.707  -8.949
  824    HE   ARG  94           HE       ARG  94  -2.565 -13.556  -8.127
  825   1HH1  ARG  94          HH21      ARG  94  -3.973 -12.714 -10.549
  826   2HH1  ARG  94          HH22      ARG  94  -2.856 -13.087 -11.818
  827   1HH2  ARG  94          HH11      ARG  94  -0.120 -13.352  -9.692
  828   2HH2  ARG  94          HH12      ARG  94  -0.670 -13.449 -11.332
  829    H    LYS  95           HN       LYS  95   0.612  -7.117  -6.066
  830    HA   LYS  95           HA       LYS  95   2.210  -6.371  -8.321
  831   1HB   LYS  95          HB2       LYS  95   0.715  -5.047  -6.320
  832   2HB   LYS  95          HB1       LYS  95   2.354  -4.409  -6.205
  833   1HG   LYS  95          HG2       LYS  95   1.532  -4.687  -8.982
  834   2HG   LYS  95          HG1       LYS  95   0.405  -3.673  -8.082
  835   1HD   LYS  95          HD2       LYS  95   1.890  -1.995  -8.380
  836   2HD   LYS  95          HD1       LYS  95   2.893  -2.816  -7.184
  837   1HE   LYS  95          HE2       LYS  95   3.635  -4.252  -9.293
  838   2HE   LYS  95          HE1       LYS  95   3.121  -2.811 -10.170
  839   1HZ   LYS  95          HZ1       LYS  95   5.083  -2.879  -7.940
  840   2HZ   LYS  95          HZ2       LYS  95   4.580  -1.484  -8.772
  841   3HZ   LYS  95          HZ3       LYS  95   5.456  -2.692  -9.585
  842    H    GLY  96           HN       GLY  96   3.046  -7.054  -4.925
  843   1HA   GLY  96          HA2       GLY  96   5.742  -6.049  -5.062
  844   2HA   GLY  96          HA1       GLY  96   5.137  -7.202  -3.873
  845    H    TYR  97           HN       TYR  97   4.314  -9.245  -5.657
  846    HA   TYR  97           HA       TYR  97   6.793 -10.647  -6.024
  847   1HB   TYR  97          HB2       TYR  97   4.214 -11.428  -7.377
  848   2HB   TYR  97          HB1       TYR  97   5.493 -12.476  -6.764
  849    HD1  TYR  97           HD1      TYR  97   6.014 -11.228  -4.108
  850    HD2  TYR  97           HD2      TYR  97   2.315 -12.076  -6.120
  851    HE1  TYR  97           HE1      TYR  97   4.851 -11.309  -1.926
  852    HE2  TYR  97           HE2      TYR  97   1.149 -12.160  -3.937
  853    HH   TYR  97           HH       TYR  97   2.288 -10.918  -1.189
  854    H    LEU  98           HN       LEU  98   4.503  -9.381  -8.508
  855    HA   LEU  98           HA       LEU  98   6.173 -10.068 -10.724
  856   1HB   LEU  98          HB2       LEU  98   4.833  -8.426 -12.022
  857   2HB   LEU  98          HB1       LEU  98   3.822  -9.510 -11.072
  858    HG   LEU  98           HG       LEU  98   4.144  -7.501  -9.280
  859   1HD1  LEU  98          HD11      LEU  98   5.227  -6.423 -11.632
  860   2HD1  LEU  98          HD12      LEU  98   4.738  -5.525 -10.197
  861   3HD1  LEU  98          HD13      LEU  98   3.607  -5.736 -11.532
  862   1HD2  LEU  98          HD21      LEU  98   1.924  -6.652 -10.160
  863   2HD2  LEU  98          HD22      LEU  98   1.988  -8.395  -9.904
  864   3HD2  LEU  98          HD23      LEU  98   2.130  -7.738 -11.534
  865    H    ASP  99           HN       ASP  99   6.018  -7.109  -8.746
  866    HA   ASP  99           HA       ASP  99   7.904  -5.594 -10.306
  867   1HB   ASP  99          HB2       ASP  99   6.301  -4.770  -8.443
  868   2HB   ASP  99          HB1       ASP  99   7.550  -5.305  -7.319
  869    H    GLU 100           HN       GLU 100   8.262  -7.847  -7.576
  870    HA   GLU 100           HA       GLU 100  11.066  -7.423  -7.138
  871   1HB   GLU 100          HB2       GLU 100   9.647  -8.571  -5.490
  872   2HB   GLU 100          HB1       GLU 100   9.368  -9.888  -6.628
  873   1HG   GLU 100          HG2       GLU 100  12.210  -9.382  -6.329
  874   2HG   GLU 100          HG1       GLU 100  11.465  -9.690  -4.761
  875    H    LEU 101           HN       LEU 101   9.388 -10.054  -8.924
  876    HA   LEU 101           HA       LEU 101  11.937 -10.866 -10.153
  877   1HB   LEU 101          HB2       LEU 101   9.820 -12.339  -9.423
  878   2HB   LEU 101          HB1       LEU 101   9.328 -11.990 -11.082
  879    HG   LEU 101           HG       LEU 101  12.148 -12.870 -10.619
  880   1HD1  LEU 101          HD11      LEU 101   9.767 -14.750 -10.643
  881   2HD1  LEU 101          HD12      LEU 101  10.821 -14.450  -9.263
  882   3HD1  LEU 101          HD13      LEU 101  11.460 -15.239 -10.704
  883   1HD2  LEU 101          HD21      LEU 101  11.694 -13.993 -12.809
  884   2HD2  LEU 101          HD22      LEU 101  11.418 -12.252 -12.866
  885   3HD2  LEU 101          HD23      LEU 101  10.049 -13.359 -12.757
  886    H    LEU 102           HN       LEU 102  12.593  -9.314 -11.610
  887    HA   LEU 102           HA       LEU 102  10.710  -8.701 -13.853
  888   1HB   LEU 102          HB2       LEU 102  11.736  -6.863 -12.015
  889   2HB   LEU 102          HB1       LEU 102  12.771  -6.672 -13.429
  890    HG   LEU 102           HG       LEU 102  10.848  -5.171 -13.606
  891   1HD1  LEU 102          HD11      LEU 102  10.154  -5.749 -15.810
  892   2HD1  LEU 102          HD12      LEU 102  10.359  -7.474 -15.504
  893   3HD1  LEU 102          HD13      LEU 102  11.773  -6.428 -15.639
  894   1HD2  LEU 102          HD21      LEU 102   9.353  -6.618 -12.161
  895   2HD2  LEU 102          HD22      LEU 102   9.111  -7.656 -13.565
  896   3HD2  LEU 102          HD23      LEU 102   8.574  -5.977 -13.608
  Start of MODEL    4
    1   1H    MET   1          HT1       MET   1 -22.630  -9.436 -29.898
    2   2H    MET   1          HT2       MET   1 -24.209  -9.496 -30.520
    3   3H    MET   1          HT3       MET   1 -23.946  -9.618 -28.845
    4    HA   MET   1           HA       MET   1 -23.126  -7.224 -30.376
    5   1HB   MET   1          HB2       MET   1 -25.288  -6.206 -29.516
    6   2HB   MET   1          HB1       MET   1 -25.489  -7.395 -30.801
    7   1HG   MET   1          HG2       MET   1 -26.233  -9.067 -29.288
    8   2HG   MET   1          HG1       MET   1 -25.646  -8.175 -27.885
    9   1HE   MET   1          HE1       MET   1 -28.169  -5.655 -27.001
   10   2HE   MET   1          HE2       MET   1 -26.449  -5.729 -27.374
   11   3HE   MET   1          HE3       MET   1 -27.184  -6.989 -26.386
   12    H    ALA   2           HN       ALA   2 -21.426  -8.100 -28.561
   13    HA   ALA   2           HA       ALA   2 -22.098  -6.647 -26.029
   14   1HB   ALA   2          HB1       ALA   2 -21.811  -9.107 -25.739
   15   2HB   ALA   2          HB2       ALA   2 -20.591  -8.184 -24.863
   16   3HB   ALA   2          HB3       ALA   2 -20.177  -8.969 -26.386
   17    H    GLU   3           HN       GLU   3 -20.971  -5.423 -28.421
   18    HA   GLU   3           HA       GLU   3 -18.224  -4.755 -27.435
   19   1HB   GLU   3          HB2       GLU   3 -18.769  -5.801 -29.865
   20   2HB   GLU   3          HB1       GLU   3 -18.995  -4.092 -30.235
   21   1HG   GLU   3          HG2       GLU   3 -16.723  -3.777 -28.975
   22   2HG   GLU   3          HG1       GLU   3 -16.516  -5.503 -29.277
   23    H    GLN   4           HN       GLN   4 -18.376  -2.858 -26.338
   24    HA   GLN   4           HA       GLN   4 -19.307  -0.450 -27.665
   25   1HB   GLN   4          HB2       GLN   4 -21.376  -1.814 -26.594
   26   2HB   GLN   4          HB1       GLN   4 -20.864  -0.912 -25.169
   27   1HG   GLN   4          HG2       GLN   4 -22.409   0.534 -26.213
   28   2HG   GLN   4          HG1       GLN   4 -20.843   1.154 -26.735
   29   1HE2  GLN   4          HE21      GLN   4 -20.311   1.003 -28.988
   30   2HE2  GLN   4          HE22      GLN   4 -21.389   0.394 -30.150
   31    H    GLN   5           HN       GLN   5 -18.528  -1.968 -24.524
   32    HA   GLN   5           HA       GLN   5 -17.793   0.344 -23.080
   33   1HB   GLN   5          HB2       GLN   5 -16.986  -2.540 -22.963
   34   2HB   GLN   5          HB1       GLN   5 -16.072  -1.372 -22.010
   35   1HG   GLN   5          HG2       GLN   5 -17.703  -1.727 -20.457
   36   2HG   GLN   5          HG1       GLN   5 -18.625  -0.594 -21.446
   37   1HE2  GLN   5          HE21      GLN   5 -20.303  -1.475 -22.856
   38   2HE2  GLN   5          HE22      GLN   5 -20.841  -3.077 -22.700
   39    H    GLN   6           HN       GLN   6 -16.321   1.860 -23.604
   40    HA   GLN   6           HA       GLN   6 -13.728   1.001 -24.808
   41   1HB   GLN   6          HB2       GLN   6 -15.551   2.076 -26.412
   42   2HB   GLN   6          HB1       GLN   6 -14.980   3.580 -25.691
   43   1HG   GLN   6          HG2       GLN   6 -12.638   2.170 -26.268
   44   2HG   GLN   6          HG1       GLN   6 -13.678   1.870 -27.662
   45   1HE2  GLN   6          HE21      GLN   6 -11.971   4.396 -25.857
   46   2HE2  GLN   6          HE22      GLN   6 -12.205   5.622 -27.008
   47    H    GLU   7           HN       GLU   7 -14.447   1.701 -22.046
   48    HA   GLU   7           HA       GLU   7 -12.762   4.156 -21.730
   49   1HB   GLU   7          HB2       GLU   7 -15.212   3.287 -20.175
   50   2HB   GLU   7          HB1       GLU   7 -14.085   4.501 -19.573
   51   1HG   GLU   7          HG2       GLU   7 -15.432   5.960 -20.692
   52   2HG   GLU   7          HG1       GLU   7 -14.513   5.429 -22.102
   53    H    GLN   8           HN       GLN   8 -10.825   3.463 -20.971
   54    HA   GLN   8           HA       GLN   8 -10.810   1.268 -18.935
   55   1HB   GLN   8          HB2       GLN   8  -9.138   1.809 -21.301
   56   2HB   GLN   8          HB1       GLN   8  -8.217   1.433 -19.845
   57   1HG   GLN   8          HG2       GLN   8 -10.584  -0.286 -20.387
   58   2HG   GLN   8          HG1       GLN   8  -9.210  -0.479 -21.475
   59   1HE2  GLN   8          HE21      GLN   8  -9.954  -0.354 -17.942
   60   2HE2  GLN   8          HE22      GLN   8  -8.723  -1.435 -17.499
   61    H    GLN   9           HN       GLN   9 -10.445   2.056 -16.934
   62    HA   GLN   9           HA       GLN   9  -9.011   4.636 -16.608
   63   1HB   GLN   9          HB2       GLN   9 -11.163   3.342 -15.248
   64   2HB   GLN   9          HB1       GLN   9  -9.830   3.511 -14.103
   65   1HG   GLN   9          HG2       GLN   9  -9.772   5.852 -14.321
   66   2HG   GLN   9          HG1       GLN   9 -10.646   5.824 -15.853
   67   1HE2  GLN   9          HE21      GLN   9 -11.063   5.364 -12.327
   68   2HE2  GLN   9          HE22      GLN   9 -12.742   5.614 -12.334
   69    H    ILE  10           HN       ILE  10  -7.448   4.731 -14.694
   70    HA   ILE  10           HA       ILE  10  -5.506   2.535 -14.974
   71    HB   ILE  10           HB       ILE  10  -4.727   4.882 -15.021
   72   1HG1  ILE  10          HG12      ILE  10  -3.228   4.502 -12.746
   73   2HG1  ILE  10          HG11      ILE  10  -3.783   2.863 -13.087
   74   1HG2  ILE  10          HG21      ILE  10  -5.382   6.428 -13.517
   75   2HG2  ILE  10          HG22      ILE  10  -4.953   5.388 -12.160
   76   3HG2  ILE  10          HG23      ILE  10  -6.536   5.236 -12.920
   77   1HD1  ILE  10          HD11      ILE  10  -1.649   3.340 -14.240
   78   2HD1  ILE  10          HD12      ILE  10  -2.409   4.696 -15.074
   79   3HD1  ILE  10          HD13      ILE  10  -2.949   3.048 -15.397
   80    H    ARG  11           HN       ARG  11  -7.103   1.024 -13.919
   81    HA   ARG  11           HA       ARG  11  -7.613   1.313 -11.063
   82   1HB   ARG  11          HB2       ARG  11  -8.511  -1.008 -11.241
   83   2HB   ARG  11          HB1       ARG  11  -9.211   0.082 -12.435
   84   1HG   ARG  11          HG2       ARG  11  -6.781  -1.181 -13.438
   85   2HG   ARG  11          HG1       ARG  11  -7.982  -2.378 -12.956
   86   1HD   ARG  11          HD2       ARG  11  -8.695   0.001 -14.681
   87   2HD   ARG  11          HD1       ARG  11  -8.129  -1.519 -15.371
   88    HE   ARG  11           HE       ARG  11 -10.131  -2.517 -13.993
   89   1HH1  ARG  11          HH21      ARG  11 -11.146   0.205 -13.201
   90   2HH1  ARG  11          HH22      ARG  11 -12.333   0.514 -14.424
   91   1HH2  ARG  11          HH11      ARG  11 -11.162  -1.963 -16.561
   92   2HH2  ARG  11          HH12      ARG  11 -12.342  -0.716 -16.331
   93    H    VAL  12           HN       VAL  12  -6.626   0.185  -9.376
   94    HA   VAL  12           HA       VAL  12  -4.692  -0.486  -8.225
   95    HB   VAL  12           HB       VAL  12  -4.020  -2.833  -8.878
   96   1HG1  VAL  12          HG11      VAL  12  -6.982  -2.303  -8.656
   97   2HG1  VAL  12          HG12      VAL  12  -5.848  -2.331  -7.304
   98   3HG1  VAL  12          HG13      VAL  12  -6.153  -3.800  -8.230
   99   1HG2  VAL  12          HG21      VAL  12  -5.303  -3.966 -10.616
  100   2HG2  VAL  12          HG22      VAL  12  -4.473  -2.582 -11.324
  101   3HG2  VAL  12          HG23      VAL  12  -6.196  -2.486 -10.962
  102    H    ARG  13           HN       ARG  13  -2.545  -2.177  -9.410
  103    HA   ARG  13           HA       ARG  13  -0.431  -1.881 -10.366
  104   1HB   ARG  13          HB2       ARG  13  -1.921   0.038 -12.188
  105   2HB   ARG  13          HB1       ARG  13  -0.313  -0.621 -12.483
  106   1HG   ARG  13          HG2       ARG  13  -2.640  -2.470 -11.998
  107   2HG   ARG  13          HG1       ARG  13  -2.367  -1.784 -13.600
  108   1HD   ARG  13          HD2       ARG  13   0.098  -2.604 -13.239
  109   2HD   ARG  13          HD1       ARG  13  -0.626  -3.663 -12.028
  110    HE   ARG  13           HE       ARG  13  -1.833  -4.793 -13.790
  111   1HH1  ARG  13          HH21      ARG  13  -2.430  -2.598 -15.658
  112   2HH1  ARG  13          HH22      ARG  13  -1.326  -2.878 -16.963
  113   1HH2  ARG  13          HH11      ARG  13   0.726  -4.994 -15.125
  114   2HH2  ARG  13          HH12      ARG  13   0.465  -4.238 -16.660
  115    H    ILE  14           HN       ILE  14   1.066   0.194 -11.172
  116    HA   ILE  14           HA       ILE  14   0.587   2.582  -9.540
  117    HB   ILE  14           HB       ILE  14   1.513   1.060  -7.853
  118   1HG1  ILE  14          HG12      ILE  14   3.895   2.743  -8.440
  119   2HG1  ILE  14          HG11      ILE  14   2.352   3.590  -8.326
  120   1HG2  ILE  14          HG21      ILE  14   2.755  -0.322  -9.649
  121   2HG2  ILE  14          HG22      ILE  14   3.563  -0.091  -8.100
  122   3HG2  ILE  14          HG23      ILE  14   4.040   0.877  -9.495
  123   1HD1  ILE  14          HD11      ILE  14   1.947   2.594  -6.118
  124   2HD1  ILE  14          HD12      ILE  14   3.482   3.460  -6.125
  125   3HD1  ILE  14          HD13      ILE  14   3.463   1.701  -6.231
  126    HA   PRO  15           HA       PRO  15   2.926   4.015 -13.044
  127   1HB   PRO  15          HB2       PRO  15   2.688   6.686 -12.427
  128   2HB   PRO  15          HB1       PRO  15   1.406   5.737 -13.198
  129   1HG   PRO  15          HG2       PRO  15   1.597   6.690 -10.378
  130   2HG   PRO  15          HG1       PRO  15   0.158   6.337 -11.348
  131   1HD   PRO  15          HD2       PRO  15   1.262   4.655  -9.365
  132   2HD   PRO  15          HD1       PRO  15   0.057   4.179 -10.581
  133    H    ARG  16           HN       ARG  16   3.616   4.777  -9.672
  134    HA   ARG  16           HA       ARG  16   6.073   6.198 -10.004
  135   1HB   ARG  16          HB2       ARG  16   5.081   4.408  -7.766
  136   2HB   ARG  16          HB1       ARG  16   6.565   5.353  -7.667
  137   1HG   ARG  16          HG2       ARG  16   4.062   6.767  -8.490
  138   2HG   ARG  16          HG1       ARG  16   4.244   6.329  -6.791
  139   1HD   ARG  16          HD2       ARG  16   6.339   7.539  -6.641
  140   2HD   ARG  16          HD1       ARG  16   6.331   7.850  -8.376
  141    HE   ARG  16           HE       ARG  16   4.533   9.443  -8.041
  142   1HH1  ARG  16          HH21      ARG  16   3.286   8.033  -5.649
  143   2HH1  ARG  16          HH22      ARG  16   3.649   9.143  -4.372
  144   1HH2  ARG  16          HH11      ARG  16   6.064  10.858  -6.190
  145   2HH2  ARG  16          HH12      ARG  16   5.225  10.747  -4.679
  146    H    LYS  17           HN       LYS  17   7.865   5.448 -11.004
  147    HA   LYS  17           HA       LYS  17   8.512   2.534 -10.771
  148   1HB   LYS  17          HB2       LYS  17   8.769   4.434 -13.107
  149   2HB   LYS  17          HB1       LYS  17   9.722   2.952 -13.021
  150   1HG   LYS  17          HG2       LYS  17   7.840   1.573 -13.148
  151   2HG   LYS  17          HG1       LYS  17   6.752   2.838 -12.578
  152   1HD   LYS  17          HD2       LYS  17   6.598   3.837 -14.655
  153   2HD   LYS  17          HD1       LYS  17   8.205   3.302 -15.149
  154   1HE   LYS  17          HE2       LYS  17   6.174   1.179 -14.657
  155   2HE   LYS  17          HE1       LYS  17   5.961   2.166 -16.102
  156   1HZ   LYS  17          HZ1       LYS  17   8.211   1.637 -16.770
  157   2HZ   LYS  17          HZ2       LYS  17   7.323   0.209 -16.532
  158   3HZ   LYS  17          HZ3       LYS  17   8.449   0.718 -15.365
  159    H    GLU  18           HN       GLU  18   9.426   4.134  -8.786
  160    HA   GLU  18           HA       GLU  18  12.004   5.351  -9.338
  161   1HB   GLU  18          HB2       GLU  18  10.593   4.516  -6.791
  162   2HB   GLU  18          HB1       GLU  18  12.213   5.212  -6.781
  163   1HG   GLU  18          HG2       GLU  18  10.958   7.143  -6.557
  164   2HG   GLU  18          HG1       GLU  18  11.057   7.054  -8.314
  165    H    GLU  19           HN       GLU  19  11.140   2.410  -7.475
  166    HA   GLU  19           HA       GLU  19  13.218   0.825  -8.741
  167   1HB   GLU  19          HB2       GLU  19  14.363   2.388  -6.952
  168   2HB   GLU  19          HB1       GLU  19  13.682   1.240  -5.800
  169   1HG   GLU  19          HG2       GLU  19  14.779  -0.619  -7.024
  170   2HG   GLU  19          HG1       GLU  19  15.494   0.549  -8.134
  171    H    ASN  20           HN       ASN  20  11.479   1.066  -5.607
  172    HA   ASN  20           HA       ASN  20   9.828  -1.247  -6.209
  173   1HB   ASN  20          HB2       ASN  20  10.772  -2.498  -4.108
  174   2HB   ASN  20          HB1       ASN  20  11.613  -2.658  -5.648
  175   1HD2  ASN  20          HD21      ASN  20  11.738  -0.967  -2.496
  176   2HD2  ASN  20          HD22      ASN  20  13.388  -0.576  -2.592
  177    H    GLU  21           HN       GLU  21   7.971  -1.072  -5.037
  178    HA   GLU  21           HA       GLU  21   7.934   0.913  -2.810
  179   1HB   GLU  21          HB2       GLU  21   6.010   0.090  -4.904
  180   2HB   GLU  21          HB1       GLU  21   5.308   0.368  -3.310
  181   1HG   GLU  21          HG2       GLU  21   5.239   2.514  -4.222
  182   2HG   GLU  21          HG1       GLU  21   6.773   2.553  -3.354
  183    H    ILE  22           HN       ILE  22   6.342   0.367  -1.010
  184    HA   ILE  22           HA       ILE  22   6.528  -2.553  -0.352
  185    HB   ILE  22           HB       ILE  22   6.192  -1.384   2.077
  186   1HG1  ILE  22          HG12      ILE  22   7.835   0.560   0.407
  187   2HG1  ILE  22          HG11      ILE  22   6.262   0.911   1.120
  188   1HG2  ILE  22          HG21      ILE  22   8.280  -2.576   0.531
  189   2HG2  ILE  22          HG22      ILE  22   8.089  -2.564   2.284
  190   3HG2  ILE  22          HG23      ILE  22   8.974  -1.265   1.484
  191   1HD1  ILE  22          HD11      ILE  22   7.365   0.270   3.371
  192   2HD1  ILE  22          HD12      ILE  22   7.805   1.823   2.659
  193   3HD1  ILE  22          HD13      ILE  22   8.895   0.444   2.513
  194    H    LEU  23           HN       LEU  23   4.643  -3.387   1.073
  195    HA   LEU  23           HA       LEU  23   2.177  -1.725   0.432
  196   1HB   LEU  23          HB2       LEU  23   2.810  -4.245  -0.647
  197   2HB   LEU  23          HB1       LEU  23   1.580  -4.556   0.574
  198    HG   LEU  23           HG       LEU  23   0.571  -4.090  -1.637
  199   1HD1  LEU  23          HD11      LEU  23  -0.097  -2.935   0.840
  200   2HD1  LEU  23          HD12      LEU  23  -1.165  -3.161  -0.544
  201   3HD1  LEU  23          HD13      LEU  23  -0.292  -1.642  -0.344
  202   1HD2  LEU  23          HD21      LEU  23   1.600  -1.262  -1.347
  203   2HD2  LEU  23          HD22      LEU  23   0.864  -2.019  -2.759
  204   3HD2  LEU  23          HD23      LEU  23   2.491  -2.480  -2.260
  205    H    GLY  24           HN       GLY  24   1.046  -1.194   2.297
  206   1HA   GLY  24          HA2       GLY  24   1.154  -3.171   4.527
  207   2HA   GLY  24          HA1       GLY  24   1.632  -1.509   4.840
  208    H    ILE  25           HN       ILE  25  -0.403  -2.715   6.251
  209    HA   ILE  25           HA       ILE  25  -2.929  -1.615   5.130
  210    HB   ILE  25           HB       ILE  25  -4.003  -2.783   7.070
  211   1HG1  ILE  25          HG12      ILE  25  -1.354  -4.140   7.563
  212   2HG1  ILE  25          HG11      ILE  25  -1.754  -2.645   8.409
  213   1HG2  ILE  25          HG21      ILE  25  -2.187  -4.449   5.298
  214   2HG2  ILE  25          HG22      ILE  25  -3.841  -3.949   4.941
  215   3HG2  ILE  25          HG23      ILE  25  -3.529  -5.101   6.239
  216   1HD1  ILE  25          HD11      ILE  25  -2.487  -4.423   9.834
  217   2HD1  ILE  25          HD12      ILE  25  -3.252  -5.273   8.491
  218   3HD1  ILE  25          HD13      ILE  25  -3.943  -3.765   9.088
  219    H    ILE  26           HN       ILE  26  -4.057   0.013   6.250
  220    HA   ILE  26           HA       ILE  26  -2.366   1.630   8.058
  221    HB   ILE  26           HB       ILE  26  -4.277   3.339   7.690
  222   1HG1  ILE  26          HG12      ILE  26  -4.707   1.889   5.103
  223   2HG1  ILE  26          HG11      ILE  26  -5.621   1.367   6.519
  224   1HG2  ILE  26          HG21      ILE  26  -3.273   3.799   5.324
  225   2HG2  ILE  26          HG22      ILE  26  -2.187   2.475   5.744
  226   3HG2  ILE  26          HG23      ILE  26  -2.255   3.918   6.756
  227   1HD1  ILE  26          HD11      ILE  26  -6.738   3.158   5.085
  228   2HD1  ILE  26          HD12      ILE  26  -5.485   4.262   5.651
  229   3HD1  ILE  26          HD13      ILE  26  -6.601   3.530   6.803
  230    H    GLU  27           HN       GLU  27  -3.040   2.445   9.928
  231    HA   GLU  27           HA       GLU  27  -5.589   1.525  11.156
  232   1HB   GLU  27          HB2       GLU  27  -3.639  -0.048  11.742
  233   2HB   GLU  27          HB1       GLU  27  -2.947   1.314  12.624
  234   1HG   GLU  27          HG2       GLU  27  -4.992   1.479  13.993
  235   2HG   GLU  27          HG1       GLU  27  -5.697   0.125  13.109
  236    H    GLN  28           HN       GLN  28  -6.518   3.231  12.242
  237    HA   GLN  28           HA       GLN  28  -5.422   5.845  12.153
  238   1HB   GLN  28          HB2       GLN  28  -7.243   6.513  13.630
  239   2HB   GLN  28          HB1       GLN  28  -7.844   5.361  12.441
  240   1HG   GLN  28          HG2       GLN  28  -7.855   3.577  14.038
  241   2HG   GLN  28          HG1       GLN  28  -6.921   4.518  15.199
  242   1HE2  GLN  28          HE21      GLN  28  -8.213   5.323  16.856
  243   2HE2  GLN  28          HE22      GLN  28  -9.835   5.796  16.688
  244    H    MET  29           HN       MET  29  -4.275   7.089  13.607
  245    HA   MET  29           HA       MET  29  -3.001   5.623  15.865
  246   1HB   MET  29          HB2       MET  29  -1.804   7.026  13.914
  247   2HB   MET  29          HB1       MET  29  -2.099   8.353  15.035
  248   1HG   MET  29          HG2       MET  29  -0.931   7.154  16.818
  249   2HG   MET  29          HG1       MET  29  -0.710   5.757  15.766
  250   1HE   MET  29          HE1       MET  29   2.107   9.046  16.428
  251   2HE   MET  29          HE2       MET  29   1.211   7.932  17.458
  252   3HE   MET  29          HE3       MET  29   0.388   9.316  16.742
  253    H    LEU  30           HN       LEU  30  -2.364   8.532  16.900
  254    HA   LEU  30           HA       LEU  30  -4.421   8.617  18.901
  255   1HB   LEU  30          HB2       LEU  30  -2.180  10.431  18.068
  256   2HB   LEU  30          HB1       LEU  30  -3.420  11.061  19.153
  257    HG   LEU  30           HG       LEU  30  -2.986   8.779  20.438
  258   1HD1  LEU  30          HD11      LEU  30  -1.420   7.833  18.841
  259   2HD1  LEU  30          HD12      LEU  30  -0.539   8.223  20.318
  260   3HD1  LEU  30          HD13      LEU  30  -0.414   9.279  18.911
  261   1HD2  LEU  30          HD21      LEU  30  -1.295   9.968  21.815
  262   2HD2  LEU  30          HD22      LEU  30  -2.641  11.023  21.384
  263   3HD2  LEU  30          HD23      LEU  30  -1.104  11.160  20.530
  264    H    GLY  31           HN       GLY  31  -3.983  10.316  15.813
  265   1HA   GLY  31          HA2       GLY  31  -6.045  10.935  14.573
  266   2HA   GLY  31          HA1       GLY  31  -6.753  11.410  16.118
  267    H    ALA  32           HN       ALA  32  -4.259  12.257  13.745
  268    HA   ALA  32           HA       ALA  32  -4.568  15.105  14.518
  269   1HB   ALA  32          HB1       ALA  32  -2.657  14.458  15.838
  270   2HB   ALA  32          HB2       ALA  32  -2.049  15.366  14.454
  271   3HB   ALA  32          HB3       ALA  32  -1.935  13.607  14.473
  272    H    SER  33           HN       SER  33  -2.413  13.150  12.409
  273    HA   SER  33           HA       SER  33  -3.681  14.213   9.989
  274   1HB   SER  33          HB2       SER  33  -1.248  15.428  11.110
  275   2HB   SER  33          HB1       SER  33  -1.075  14.929   9.430
  276    HG   SER  33           HG       SER  33  -2.676  16.275   8.854
  277    H    ARG  34           HN       ARG  34  -0.764  12.594  11.302
  278    HA   ARG  34           HA       ARG  34  -0.688  10.868   8.880
  279   1HB   ARG  34          HB2       ARG  34   1.287  11.142  11.164
  280   2HB   ARG  34          HB1       ARG  34   1.518  10.146   9.730
  281   1HG   ARG  34          HG2       ARG  34   1.433  12.125   8.297
  282   2HG   ARG  34          HG1       ARG  34   1.096  13.150   9.692
  283   1HD   ARG  34          HD2       ARG  34   3.586  11.443   9.462
  284   2HD   ARG  34          HD1       ARG  34   3.521  13.126   8.942
  285    HE   ARG  34           HE       ARG  34   2.815  12.428  11.756
  286   1HH1  ARG  34          HH21      ARG  34   5.763  12.524  11.302
  287   2HH1  ARG  34          HH22      ARG  34   6.133  14.188  11.608
  288   1HH2  ARG  34          HH11      ARG  34   2.832  15.244  11.333
  289   2HH2  ARG  34          HH12      ARG  34   4.467  15.734  11.625
  290    H    VAL  35           HN       VAL  35  -0.995   8.675   8.982
  291    HA   VAL  35           HA       VAL  35  -2.184   7.593  11.478
  292    HB   VAL  35           HB       VAL  35  -2.618   7.264   8.606
  293   1HG1  VAL  35          HG11      VAL  35  -1.537   5.115   8.879
  294   2HG1  VAL  35          HG12      VAL  35  -3.277   4.868   8.739
  295   3HG1  VAL  35          HG13      VAL  35  -2.499   4.778  10.317
  296   1HG2  VAL  35          HG21      VAL  35  -4.854   6.649   9.368
  297   2HG2  VAL  35          HG22      VAL  35  -4.285   8.066  10.252
  298   3HG2  VAL  35          HG23      VAL  35  -4.261   6.479  11.020
  299    H    ARG  36           HN       ARG  36  -1.595   5.307  12.025
  300    HA   ARG  36           HA       ARG  36   1.330   4.863  11.576
  301   1HB   ARG  36          HB2       ARG  36   0.896   3.026  13.397
  302   2HB   ARG  36          HB1       ARG  36   0.989   4.713  13.884
  303   1HG   ARG  36          HG2       ARG  36  -1.375   4.893  14.089
  304   2HG   ARG  36          HG1       ARG  36  -1.642   3.401  13.188
  305   1HD   ARG  36          HD2       ARG  36  -0.643   2.095  15.000
  306   2HD   ARG  36          HD1       ARG  36  -0.286   3.572  15.895
  307    HE   ARG  36           HE       ARG  36  -3.124   3.118  15.212
  308   1HH1  ARG  36          HH11      ARG  36  -2.035   4.911  17.429
  309   2HH1  ARG  36          HH12      ARG  36  -2.412   3.972  18.834
  310   1HH2  ARG  36          HH21      ARG  36  -2.973   1.042  17.055
  311   2HH2  ARG  36          HH22      ARG  36  -2.943   1.778  18.622
  312    H    VAL  37           HN       VAL  37   1.996   3.163  10.272
  313    HA   VAL  37           HA       VAL  37  -0.082   1.177   9.520
  314    HB   VAL  37           HB       VAL  37   1.604   3.035   7.913
  315   1HG1  VAL  37          HG11      VAL  37   1.250   1.569   5.945
  316   2HG1  VAL  37          HG12      VAL  37   0.727   0.297   7.049
  317   3HG1  VAL  37          HG13      VAL  37   2.376   0.917   7.133
  318   1HG2  VAL  37          HG21      VAL  37  -0.388   3.643   7.004
  319   2HG2  VAL  37          HG22      VAL  37  -1.045   2.916   8.470
  320   3HG2  VAL  37          HG23      VAL  37  -0.987   1.986   6.973
  321    H    ARG  38           HN       ARG  38   0.732  -0.824   8.840
  322    HA   ARG  38           HA       ARG  38   3.662  -1.320   9.264
  323   1HB   ARG  38          HB2       ARG  38   1.708  -2.412  10.862
  324   2HB   ARG  38          HB1       ARG  38   1.994  -3.674   9.690
  325   1HG   ARG  38          HG2       ARG  38   4.508  -3.211  10.170
  326   2HG   ARG  38          HG1       ARG  38   3.918  -2.430  11.638
  327   1HD   ARG  38          HD2       ARG  38   3.901  -4.490  12.568
  328   2HD   ARG  38          HD1       ARG  38   2.495  -4.821  11.556
  329    HE   ARG  38           HE       ARG  38   5.268  -5.707  11.011
  330   1HH1  ARG  38          HH21      ARG  38   2.976  -7.613  11.085
  331   2HH1  ARG  38          HH22      ARG  38   2.633  -7.851   9.403
  332   1HH2  ARG  38          HH11      ARG  38   4.409  -5.048   8.375
  333   2HH2  ARG  38          HH12      ARG  38   3.447  -6.394   7.865
  334    H    CYS  39           HN       CYS  39   4.525  -2.797   7.740
  335    HA   CYS  39           HA       CYS  39   2.627  -3.662   5.621
  336   1HB   CYS  39          HB2       CYS  39   3.421  -2.272   4.029
  337   2HB   CYS  39          HB1       CYS  39   3.966  -1.311   5.396
  338    HG   CYS  39           HG       CYS  39   6.274  -2.828   5.115
  339    H    LEU  40           HN       LEU  40   3.467  -5.055   4.040
  340    HA   LEU  40           HA       LEU  40   5.578  -6.855   5.016
  341   1HB   LEU  40          HB2       LEU  40   3.214  -7.131   3.271
  342   2HB   LEU  40          HB1       LEU  40   4.640  -7.999   2.722
  343    HG   LEU  40           HG       LEU  40   3.522  -8.178   5.530
  344   1HD1  LEU  40          HD11      LEU  40   1.921  -9.176   4.012
  345   2HD1  LEU  40          HD12      LEU  40   2.813 -10.480   4.796
  346   3HD1  LEU  40          HD13      LEU  40   3.205 -10.014   3.140
  347   1HD2  LEU  40          HD21      LEU  40   5.838  -8.720   5.565
  348   2HD2  LEU  40          HD22      LEU  40   5.740  -9.579   4.027
  349   3HD2  LEU  40          HD23      LEU  40   5.011 -10.275   5.475
  350    H    ASP  41           HN       ASP  41   6.797  -7.763   3.016
  351    HA   ASP  41           HA       ASP  41   8.382  -7.385   1.329
  352   1HB   ASP  41          HB2       ASP  41   7.330  -4.531   1.131
  353   2HB   ASP  41          HB1       ASP  41   8.353  -5.373  -0.027
  354    H    GLY  42           HN       GLY  42   8.194  -6.832   4.276
  355   1HA   GLY  42          HA2       GLY  42   9.711  -6.384   5.958
  356   2HA   GLY  42          HA1       GLY  42  10.893  -6.017   4.720
  357    H    LYS  43           HN       LYS  43   7.840  -4.251   5.848
  358    HA   LYS  43           HA       LYS  43   9.716  -2.113   6.659
  359   1HB   LYS  43          HB2       LYS  43   8.884  -1.886   4.155
  360   2HB   LYS  43          HB1       LYS  43   7.507  -1.125   4.941
  361   1HG   LYS  43          HG2       LYS  43   9.113   0.613   4.479
  362   2HG   LYS  43          HG1       LYS  43   9.146   0.317   6.215
  363   1HD   LYS  43          HD2       LYS  43  10.998  -1.436   4.815
  364   2HD   LYS  43          HD1       LYS  43  11.343   0.259   4.477
  365   1HE   LYS  43          HE2       LYS  43  11.411   0.754   6.876
  366   2HE   LYS  43          HE1       LYS  43  10.988  -0.914   7.252
  367   1HZ   LYS  43          HZ1       LYS  43  13.426  -0.061   5.784
  368   2HZ   LYS  43          HZ2       LYS  43  13.026  -1.652   6.224
  369   3HZ   LYS  43          HZ3       LYS  43  13.377  -0.500   7.421
  370    H    THR  44           HN       THR  44   8.899  -0.533   7.996
  371    HA   THR  44           HA       THR  44   6.095  -0.787   9.008
  372    HB   THR  44           HB       THR  44   7.894  -1.960  10.531
  373    HG1  THR  44           HG1      THR  44   5.659  -0.971  11.014
  374   1HG2  THR  44          HG21      THR  44   9.192  -0.556  11.950
  375   2HG2  THR  44          HG22      THR  44   8.349   0.896  11.408
  376   3HG2  THR  44          HG23      THR  44   9.453   0.057  10.317
  377    H    ARG  45           HN       ARG  45   5.248   1.243   8.665
  378    HA   ARG  45           HA       ARG  45   7.011   3.598   9.096
  379   1HB   ARG  45          HB2       ARG  45   5.378   3.421   6.576
  380   2HB   ARG  45          HB1       ARG  45   6.746   4.469   6.929
  381   1HG   ARG  45          HG2       ARG  45   7.764   2.898   5.562
  382   2HG   ARG  45          HG1       ARG  45   8.040   2.163   7.138
  383   1HD   ARG  45          HD2       ARG  45   7.165   0.384   5.866
  384   2HD   ARG  45          HD1       ARG  45   5.755   0.978   6.736
  385    HE   ARG  45           HE       ARG  45   6.246   2.075   4.031
  386   1HH1  ARG  45          HH21      ARG  45   3.719   1.960   5.923
  387   2HH1  ARG  45          HH22      ARG  45   2.717   0.918   4.970
  388   1HH2  ARG  45          HH11      ARG  45   5.275  -0.101   2.890
  389   2HH2  ARG  45          HH12      ARG  45   3.594  -0.247   3.257
  390    H    LEU  46           HN       LEU  46   5.908   5.635   9.001
  391    HA   LEU  46           HA       LEU  46   3.054   5.473   9.886
  392   1HB   LEU  46          HB2       LEU  46   3.810   8.147  10.114
  393   2HB   LEU  46          HB1       LEU  46   3.764   6.998  11.445
  394    HG   LEU  46           HG       LEU  46   6.223   7.195   9.715
  395   1HD1  LEU  46          HD11      LEU  46   5.753   9.492  10.400
  396   2HD1  LEU  46          HD12      LEU  46   7.117   8.862  11.324
  397   3HD1  LEU  46          HD13      LEU  46   5.522   8.970  12.069
  398   1HD2  LEU  46          HD21      LEU  46   7.245   6.050  11.447
  399   2HD2  LEU  46          HD22      LEU  46   5.595   5.470  11.675
  400   3HD2  LEU  46          HD23      LEU  46   6.213   6.783  12.677
  401    H    GLY  47           HN       GLY  47   1.606   5.957   8.247
  402   1HA   GLY  47          HA2       GLY  47   2.751   6.996   5.728
  403   2HA   GLY  47          HA1       GLY  47   1.183   6.223   5.901
  404    H    ARG  48           HN       ARG  48   2.090   8.788   4.658
  405    HA   ARG  48           HA       ARG  48   0.531  10.747   6.227
  406   1HB   ARG  48          HB2       ARG  48   1.443  12.436   4.638
  407   2HB   ARG  48          HB1       ARG  48   2.692  11.578   5.529
  408   1HG   ARG  48          HG2       ARG  48   3.631  11.034   3.555
  409   2HG   ARG  48          HG1       ARG  48   2.223  10.027   3.227
  410   1HD   ARG  48          HD2       ARG  48   2.351  11.519   1.383
  411   2HD   ARG  48          HD1       ARG  48   1.073  12.170   2.408
  412    HE   ARG  48           HE       ARG  48   3.863  13.260   2.392
  413   1HH1  ARG  48          HH11      ARG  48   1.800  14.622   0.693
  414   2HH1  ARG  48          HH12      ARG  48   1.218  15.863   1.751
  415   1HH2  ARG  48          HH21      ARG  48   2.534  14.408   4.618
  416   2HH2  ARG  48          HH22      ARG  48   1.635  15.743   3.976
  417    H    ILE  49           HN       ILE  49  -1.343  11.645   5.442
  418    HA   ILE  49           HA       ILE  49  -2.321  10.625   2.802
  419    HB   ILE  49           HB       ILE  49  -4.600  10.476   3.867
  420   1HG1  ILE  49          HG12      ILE  49  -3.399  10.431   6.581
  421   2HG1  ILE  49          HG11      ILE  49  -3.556  12.026   5.845
  422   1HG2  ILE  49          HG21      ILE  49  -3.143   8.487   3.633
  423   2HG2  ILE  49          HG22      ILE  49  -4.147   8.392   5.080
  424   3HG2  ILE  49          HG23      ILE  49  -2.443   8.827   5.216
  425   1HD1  ILE  49          HD11      ILE  49  -5.977  10.691   5.288
  426   2HD1  ILE  49          HD12      ILE  49  -5.730  12.014   6.428
  427   3HD1  ILE  49          HD13      ILE  49  -5.615  10.342   6.978
  428    HA   PRO  50           HA       PRO  50  -3.597  14.770   1.950
  429   1HB   PRO  50          HB2       PRO  50  -6.043  14.413   0.740
  430   2HB   PRO  50          HB1       PRO  50  -4.492  14.056  -0.041
  431   1HG   PRO  50          HG2       PRO  50  -6.502  12.166   1.100
  432   2HG   PRO  50          HG1       PRO  50  -5.344  11.912  -0.216
  433   1HD   PRO  50          HD2       PRO  50  -5.049  10.974   2.417
  434   2HD   PRO  50          HD1       PRO  50  -3.749  11.088   1.214
  435    H    GLY  51           HN       GLY  51  -5.750  12.849   3.949
  436   1HA   GLY  51          HA2       GLY  51  -6.538  13.987   6.035
  437   2HA   GLY  51          HA1       GLY  51  -6.934  15.377   5.031
  438    H    ARG  52           HN       ARG  52  -7.758  12.739   3.198
  439    HA   ARG  52           HA       ARG  52 -10.580  13.169   3.469
  440   1HB   ARG  52          HB2       ARG  52  -8.846  11.201   2.028
  441   2HB   ARG  52          HB1       ARG  52 -10.563  10.834   2.195
  442   1HG   ARG  52          HG2       ARG  52 -11.103  12.335   0.608
  443   2HG   ARG  52          HG1       ARG  52 -10.204  13.605   1.439
  444   1HD   ARG  52          HD2       ARG  52  -8.178  13.047   0.331
  445   2HD   ARG  52          HD1       ARG  52  -8.811  11.494  -0.215
  446    HE   ARG  52           HE       ARG  52 -10.305  12.782  -1.758
  447   1HH1  ARG  52          HH11      ARG  52  -9.995  15.495  -0.555
  448   2HH1  ARG  52          HH12      ARG  52  -8.846  16.242  -1.613
  449   1HH2  ARG  52          HH21      ARG  52  -7.790  13.245  -3.020
  450   2HH2  ARG  52          HH22      ARG  52  -7.595  14.966  -3.011
  451    H    LEU  53           HN       LEU  53  -8.378  10.801   4.927
  452    HA   LEU  53           HA       LEU  53 -10.207   8.903   5.912
  453   1HB   LEU  53          HB2       LEU  53  -7.502   9.813   6.633
  454   2HB   LEU  53          HB1       LEU  53  -8.401   9.114   7.979
  455    HG   LEU  53           HG       LEU  53  -8.385   7.712   5.323
  456   1HD1  LEU  53          HD11      LEU  53  -6.364   6.512   5.927
  457   2HD1  LEU  53          HD12      LEU  53  -6.262   7.378   7.461
  458   3HD1  LEU  53          HD13      LEU  53  -6.008   8.240   5.943
  459   1HD2  LEU  53          HD21      LEU  53  -8.747   6.970   8.228
  460   2HD2  LEU  53          HD22      LEU  53  -8.429   5.744   7.000
  461   3HD2  LEU  53          HD23      LEU  53  -9.876   6.747   6.891
  462    H    LYS  54           HN       LYS  54  -9.446  12.123   7.203
  463    HA   LYS  54           HA       LYS  54 -10.603  11.982   9.753
  464   1HB   LYS  54          HB2       LYS  54  -9.832  14.056   7.922
  465   2HB   LYS  54          HB1       LYS  54 -11.391  14.476   8.629
  466   1HG   LYS  54          HG2       LYS  54 -10.463  14.898  10.643
  467   2HG   LYS  54          HG1       LYS  54  -9.564  13.381  10.622
  468   1HD   LYS  54          HD2       LYS  54  -7.691  14.339   9.677
  469   2HD   LYS  54          HD1       LYS  54  -8.623  15.560   8.811
  470   1HE   LYS  54          HE2       LYS  54  -7.568  16.814  10.495
  471   2HE   LYS  54          HE1       LYS  54  -9.160  16.497  11.185
  472   1HZ   LYS  54          HZ1       LYS  54  -8.243  14.641  12.404
  473   2HZ   LYS  54          HZ2       LYS  54  -7.366  16.050  12.759
  474   3HZ   LYS  54          HZ3       LYS  54  -6.717  14.886  11.706
  475    H    ASN  55           HN       ASN  55 -12.276  12.669   6.658
  476    HA   ASN  55           HA       ASN  55 -14.892  12.531   8.050
  477   1HB   ASN  55          HB2       ASN  55 -15.830  13.224   5.856
  478   2HB   ASN  55          HB1       ASN  55 -14.591  14.335   6.430
  479   1HD2  ASN  55          HD21      ASN  55 -15.317  11.893   3.972
  480   2HD2  ASN  55          HD22      ASN  55 -13.946  12.194   3.018
  481    H    ARG  56           HN       ARG  56 -12.964  10.712   5.710
  482    HA   ARG  56           HA       ARG  56 -14.998   8.891   4.857
  483   1HB   ARG  56          HB2       ARG  56 -12.464   9.307   4.071
  484   2HB   ARG  56          HB1       ARG  56 -12.196   7.901   5.099
  485   1HG   ARG  56          HG2       ARG  56 -12.905   6.604   3.400
  486   2HG   ARG  56          HG1       ARG  56 -14.510   7.305   3.606
  487   1HD   ARG  56          HD2       ARG  56 -12.345   8.620   1.948
  488   2HD   ARG  56          HD1       ARG  56 -13.530   7.507   1.266
  489    HE   ARG  56           HE       ARG  56 -14.077  10.238   2.232
  490   1HH1  ARG  56          HH11      ARG  56 -14.995   8.995  -0.398
  491   2HH1  ARG  56          HH12      ARG  56 -16.683   8.760  -0.088
  492   1HH2  ARG  56          HH21      ARG  56 -16.377   9.151   3.351
  493   2HH2  ARG  56          HH22      ARG  56 -17.466   8.848   2.040
  494    H    ILE  57           HN       ILE  57 -12.331   8.174   7.173
  495    HA   ILE  57           HA       ILE  57 -13.837   5.899   8.241
  496    HB   ILE  57           HB       ILE  57 -11.226   6.259   8.013
  497   1HG1  ILE  57          HG12      ILE  57 -11.646   4.957  10.575
  498   2HG1  ILE  57          HG11      ILE  57 -12.898   4.505   9.418
  499   1HG2  ILE  57          HG21      ILE  57 -11.412   6.951  10.910
  500   2HG2  ILE  57          HG22      ILE  57 -11.587   8.263   9.745
  501   3HG2  ILE  57          HG23      ILE  57 -10.120   7.285   9.756
  502   1HD1  ILE  57          HD11      ILE  57 -10.728   4.338   7.814
  503   2HD1  ILE  57          HD12      ILE  57 -11.324   2.975   8.761
  504   3HD1  ILE  57          HD13      ILE  57  -9.981   3.946   9.362
  505    H    TRP  58           HN       TRP  58 -14.236   5.721  10.647
  506    HA   TRP  58           HA       TRP  58 -14.380   8.076  12.296
  507   1HB   TRP  58          HB2       TRP  58 -16.249   8.353  10.468
  508   2HB   TRP  58          HB1       TRP  58 -17.123   7.186  11.458
  509    HD1  TRP  58           HD1      TRP  58 -17.957   7.943  13.827
  510    HE1  TRP  58           HE1      TRP  58 -18.137  10.244  14.973
  511    HE3  TRP  58           HE3      TRP  58 -15.081  10.731  10.659
  512    HZ2  TRP  58           HZ2      TRP  58 -17.185  12.917  14.595
  513    HZ3  TRP  58           HZ3      TRP  58 -14.734  13.148  11.075
  514    HH2  TRP  58           HH2      TRP  58 -15.782  14.244  13.037
  515    H    VAL  59           HN       VAL  59 -15.992   4.924  11.665
  516    HA   VAL  59           HA       VAL  59 -15.971   4.485  14.625
  517    HB   VAL  59           HB       VAL  59 -17.676   2.584  13.865
  518   1HG1  VAL  59          HG11      VAL  59 -18.160   4.416  15.427
  519   2HG1  VAL  59          HG12      VAL  59 -19.499   4.197  14.301
  520   3HG1  VAL  59          HG13      VAL  59 -18.366   5.530  14.076
  521   1HG2  VAL  59          HG21      VAL  59 -18.141   4.738  11.778
  522   2HG2  VAL  59          HG22      VAL  59 -19.030   3.227  11.972
  523   3HG2  VAL  59          HG23      VAL  59 -17.356   3.200  11.422
  524    H    ARG  60           HN       ARG  60 -15.562   2.636  11.556
  525    HA   ARG  60           HA       ARG  60 -13.956   0.666  13.128
  526   1HB   ARG  60          HB2       ARG  60 -15.395   0.431  10.475
  527   2HB   ARG  60          HB1       ARG  60 -14.316  -0.814  11.107
  528   1HG   ARG  60          HG2       ARG  60 -16.056  -0.124  13.231
  529   2HG   ARG  60          HG1       ARG  60 -17.070  -0.296  11.798
  530   1HD   ARG  60          HD2       ARG  60 -16.593  -2.536  11.559
  531   2HD   ARG  60          HD1       ARG  60 -14.972  -2.372  12.235
  532    HE   ARG  60           HE       ARG  60 -15.881  -2.751  14.387
  533   1HH1  ARG  60          HH21      ARG  60 -17.912  -4.520  13.202
  534   2HH1  ARG  60          HH22      ARG  60 -19.404  -3.833  13.749
  535   1HH2  ARG  60          HH11      ARG  60 -17.989  -0.780  14.616
  536   2HH2  ARG  60          HH12      ARG  60 -19.449  -1.711  14.552
  537    H    GLU  61           HN       GLU  61 -11.931  -0.054  12.314
  538    HA   GLU  61           HA       GLU  61 -10.679   1.737  10.263
  539   1HB   GLU  61          HB2       GLU  61  -9.385   0.548  12.740
  540   2HB   GLU  61          HB1       GLU  61  -8.573   1.552  11.538
  541   1HG   GLU  61          HG2       GLU  61  -9.167   3.314  12.825
  542   2HG   GLU  61          HG1       GLU  61 -10.800   3.062  12.212
  543    H    GLY  62           HN       GLY  62  -8.272   0.419   9.927
  544   1HA   GLY  62          HA2       GLY  62  -7.274  -1.664   9.271
  545   2HA   GLY  62          HA1       GLY  62  -8.851  -2.442   9.424
  546    H    ASP  63           HN       ASP  63  -6.883  -0.339   7.368
  547    HA   ASP  63           HA       ASP  63  -8.694  -1.056   5.073
  548   1HB   ASP  63          HB2       ASP  63  -7.821   1.569   6.041
  549   2HB   ASP  63          HB1       ASP  63  -7.478   1.322   4.329
  550    H    VAL  64           HN       VAL  64  -7.527  -0.965   2.904
  551    HA   VAL  64           HA       VAL  64  -4.751  -2.012   3.271
  552    HB   VAL  64           HB       VAL  64  -5.990  -3.505   1.900
  553   1HG1  VAL  64          HG11      VAL  64  -7.230  -2.643  -0.145
  554   2HG1  VAL  64          HG12      VAL  64  -7.003  -1.021   0.501
  555   3HG1  VAL  64          HG13      VAL  64  -7.943  -2.207   1.404
  556   1HG2  VAL  64          HG21      VAL  64  -4.714  -3.556  -0.056
  557   2HG2  VAL  64          HG22      VAL  64  -3.731  -2.519   0.977
  558   3HG2  VAL  64          HG23      VAL  64  -4.770  -1.805  -0.258
  559    H    VAL  65           HN       VAL  65  -2.977  -0.886   2.491
  560    HA   VAL  65           HA       VAL  65  -3.515   1.540   0.853
  561    HB   VAL  65           HB       VAL  65  -3.231   1.727   3.563
  562   1HG1  VAL  65          HG11      VAL  65  -0.957   2.643   3.990
  563   2HG1  VAL  65          HG12      VAL  65  -0.471   2.125   2.378
  564   3HG1  VAL  65          HG13      VAL  65  -0.923   0.930   3.588
  565   1HG2  VAL  65          HG21      VAL  65  -2.698   4.097   3.166
  566   2HG2  VAL  65          HG22      VAL  65  -3.915   3.518   2.034
  567   3HG2  VAL  65          HG23      VAL  65  -2.246   3.716   1.505
  568    H    ILE  66           HN       ILE  66  -1.919   2.023  -0.611
  569    HA   ILE  66           HA       ILE  66   0.455   0.184  -0.656
  570    HB   ILE  66           HB       ILE  66   0.723   0.747  -2.989
  571   1HG1  ILE  66          HG12      ILE  66  -1.350   2.393  -3.763
  572   2HG1  ILE  66          HG11      ILE  66  -0.872   3.098  -2.220
  573   1HG2  ILE  66          HG21      ILE  66  -1.337  -0.064  -3.925
  574   2HG2  ILE  66          HG22      ILE  66  -2.264   0.523  -2.545
  575   3HG2  ILE  66          HG23      ILE  66  -1.150  -0.831  -2.348
  576   1HD1  ILE  66          HD11      ILE  66   1.393   3.384  -2.949
  577   2HD1  ILE  66          HD12      ILE  66   0.371   3.990  -4.253
  578   3HD1  ILE  66          HD13      ILE  66   1.120   2.399  -4.386
  579    H    VAL  67           HN       VAL  67   2.591   1.194  -0.520
  580    HA   VAL  67           HA       VAL  67   2.469   4.140  -0.083
  581    HB   VAL  67           HB       VAL  67   2.993   4.049   2.103
  582   1HG1  VAL  67          HG11      VAL  67   2.496   1.070   1.900
  583   2HG1  VAL  67          HG12      VAL  67   1.203   2.265   1.825
  584   3HG1  VAL  67          HG13      VAL  67   2.186   2.120   3.282
  585   1HG2  VAL  67          HG21      VAL  67   5.319   3.254   1.469
  586   2HG2  VAL  67          HG22      VAL  67   4.732   1.607   1.688
  587   3HG2  VAL  67          HG23      VAL  67   4.756   2.725   3.049
  588    H    LYS  68           HN       LYS  68   4.400   5.249   0.045
  589    HA   LYS  68           HA       LYS  68   6.605   4.206  -1.612
  590   1HB   LYS  68          HB2       LYS  68   5.269   6.726  -1.451
  591   2HB   LYS  68          HB1       LYS  68   6.945   6.960  -0.957
  592   1HG   LYS  68          HG2       LYS  68   7.727   5.895  -3.027
  593   2HG   LYS  68          HG1       LYS  68   6.061   5.589  -3.516
  594   1HD   LYS  68          HD2       LYS  68   6.837   7.591  -4.654
  595   2HD   LYS  68          HD1       LYS  68   5.644   8.063  -3.445
  596   1HE   LYS  68          HE2       LYS  68   7.577   9.574  -3.357
  597   2HE   LYS  68          HE1       LYS  68   7.481   8.628  -1.874
  598   1HZ   LYS  68          HZ1       LYS  68   9.228   7.257  -2.553
  599   2HZ   LYS  68          HZ2       LYS  68   9.735   8.818  -2.992
  600   3HZ   LYS  68          HZ3       LYS  68   9.129   7.756  -4.171
  601    HA   PRO  69           HA       PRO  69   9.018   4.093   2.108
  602   1HB   PRO  69          HB2       PRO  69  11.488   3.833   0.980
  603   2HB   PRO  69          HB1       PRO  69  10.290   2.529   0.991
  604   1HG   PRO  69          HG2       PRO  69  11.206   4.189  -1.292
  605   2HG   PRO  69          HG1       PRO  69  10.398   2.615  -1.310
  606   1HD   PRO  69          HD2       PRO  69   9.206   5.200  -1.776
  607   2HD   PRO  69          HD1       PRO  69   8.391   3.619  -1.747
  608    H    TRP  70           HN       TRP  70  10.088   5.472   3.453
  609    HA   TRP  70           HA       TRP  70  11.143   8.039   2.344
  610   1HB   TRP  70          HB2       TRP  70   9.689   7.495   4.922
  611   2HB   TRP  70          HB1       TRP  70  10.646   8.945   4.679
  612    HD1  TRP  70           HD1      TRP  70   8.536   7.116   2.172
  613    HE1  TRP  70           HE1      TRP  70   6.785   8.671   1.390
  614    HE3  TRP  70           HE3      TRP  70   9.456  11.102   5.190
  615    HZ2  TRP  70           HZ2      TRP  70   5.792  11.264   1.906
  616    HZ3  TRP  70           HZ3      TRP  70   8.053  13.144   5.015
  617    HH2  TRP  70           HH2      TRP  70   6.206  13.237   3.360
  618    H    GLU  71           HN       GLU  71  13.436   8.026   2.722
  619    HA   GLU  71           HA       GLU  71  14.722   6.147   4.484
  620   1HB   GLU  71          HB2       GLU  71  16.761   7.625   4.139
  621   2HB   GLU  71          HB1       GLU  71  16.030   6.979   2.676
  622   1HG   GLU  71          HG2       GLU  71  14.842   9.534   3.445
  623   2HG   GLU  71          HG1       GLU  71  16.581   9.667   3.194
  624    H    VAL  72           HN       VAL  72  15.246   6.287   6.589
  625    HA   VAL  72           HA       VAL  72  15.813   8.568   8.131
  626    HB   VAL  72           HB       VAL  72  13.639   9.466   7.924
  627   1HG1  VAL  72          HG11      VAL  72  11.680   7.725   8.592
  628   2HG1  VAL  72          HG12      VAL  72  12.825   6.614   7.841
  629   3HG1  VAL  72          HG13      VAL  72  12.207   7.991   6.931
  630   1HG2  VAL  72          HG21      VAL  72  12.784   9.457  10.124
  631   2HG2  VAL  72          HG22      VAL  72  14.482   9.030  10.337
  632   3HG2  VAL  72          HG23      VAL  72  13.243   7.775  10.392
  633    H    GLN  73           HN       GLN  73  17.208   7.354   9.327
  634    HA   GLN  73           HA       GLN  73  16.863   4.666  10.147
  635   1HB   GLN  73          HB2       GLN  73  18.644   5.135  11.820
  636   2HB   GLN  73          HB1       GLN  73  19.044   5.743  10.216
  637   1HG   GLN  73          HG2       GLN  73  17.741   7.902  11.294
  638   2HG   GLN  73          HG1       GLN  73  18.539   7.229  12.716
  639   1HE2  GLN  73          HE21      GLN  73  19.111   8.724   9.555
  640   2HE2  GLN  73          HE22      GLN  73  20.778   8.958   9.772
  641    H    GLY  74           HN       GLY  74  16.077   3.705  12.019
  642   1HA   GLY  74          HA2       GLY  74  15.203   3.763  14.294
  643   2HA   GLY  74          HA1       GLY  74  14.757   5.449  14.045
  644    H    ASP  75           HN       ASP  75  13.462   5.157  11.507
  645    HA   ASP  75           HA       ASP  75  11.439   3.088  11.570
  646   1HB   ASP  75          HB2       ASP  75   9.505   4.613  12.041
  647   2HB   ASP  75          HB1       ASP  75  10.534   4.358  13.446
  648    H    GLN  76           HN       GLN  76  10.078   3.232   9.623
  649    HA   GLN  76           HA       GLN  76  11.275   5.140   7.669
  650   1HB   GLN  76          HB2       GLN  76  10.123   2.463   7.507
  651   2HB   GLN  76          HB1       GLN  76   9.527   3.538   6.252
  652   1HG   GLN  76          HG2       GLN  76  11.635   2.290   5.634
  653   2HG   GLN  76          HG1       GLN  76  11.761   4.043   5.513
  654   1HE2  GLN  76          HE21      GLN  76  13.570   4.917   6.521
  655   2HE2  GLN  76          HE22      GLN  76  14.434   4.185   7.785
  656    H    LYS  77           HN       LYS  77   9.952   6.329   6.232
  657    HA   LYS  77           HA       LYS  77   7.211   6.951   7.333
  658   1HB   LYS  77          HB2       LYS  77   9.397   8.700   6.362
  659   2HB   LYS  77          HB1       LYS  77   7.776   9.124   5.811
  660   1HG   LYS  77          HG2       LYS  77   7.078   9.726   7.901
  661   2HG   LYS  77          HG1       LYS  77   7.997   8.441   8.684
  662   1HD   LYS  77          HD2       LYS  77  10.094   9.819   8.065
  663   2HD   LYS  77          HD1       LYS  77   8.971  11.148   7.768
  664   1HE   LYS  77          HE2       LYS  77   8.827   9.608  10.350
  665   2HE   LYS  77          HE1       LYS  77  10.024  10.886  10.151
  666   1HZ   LYS  77          HZ1       LYS  77   7.090  11.183   9.789
  667   2HZ   LYS  77          HZ2       LYS  77   8.240  12.415   9.574
  668   3HZ   LYS  77          HZ3       LYS  77   7.990  11.744  11.113
  669    H    CYS  78           HN       CYS  78   5.518   7.306   5.657
  670    HA   CYS  78           HA       CYS  78   6.402   6.421   2.966
  671   1HB   CYS  78          HB2       CYS  78   4.523   4.749   2.888
  672   2HB   CYS  78          HB1       CYS  78   5.834   4.329   3.987
  673    HG   CYS  78           HG       CYS  78   3.202   4.250   4.968
  674    H    ASP  79           HN       ASP  79   4.925   6.841   1.246
  675    HA   ASP  79           HA       ASP  79   2.873   8.962   2.004
  676   1HB   ASP  79          HB2       ASP  79   4.246   9.838   0.246
  677   2HB   ASP  79          HB1       ASP  79   4.341   8.284  -0.579
  678    H    ILE  80           HN       ILE  80   0.802   8.076   2.183
  679    HA   ILE  80           HA       ILE  80   0.425   5.504   0.696
  680    HB   ILE  80           HB       ILE  80  -1.288   5.063   2.596
  681   1HG1  ILE  80          HG12      ILE  80   0.558   6.847   4.159
  682   2HG1  ILE  80          HG11      ILE  80  -0.872   7.535   3.394
  683   1HG2  ILE  80          HG21      ILE  80   0.934   3.958   2.143
  684   2HG2  ILE  80          HG22      ILE  80   0.429   3.952   3.831
  685   3HG2  ILE  80          HG23      ILE  80   1.651   5.098   3.278
  686   1HD1  ILE  80          HD11      ILE  80  -0.879   5.187   5.312
  687   2HD1  ILE  80          HD12      ILE  80  -2.301   5.915   4.565
  688   3HD1  ILE  80          HD13      ILE  80  -1.343   6.839   5.720
  689    H    ILE  81           HN       ILE  81  -1.479   4.873  -0.076
  690    HA   ILE  81           HA       ILE  81  -3.706   6.867  -0.236
  691    HB   ILE  81           HB       ILE  81  -4.195   5.871  -2.550
  692   1HG1  ILE  81          HG12      ILE  81  -1.271   5.178  -2.634
  693   2HG1  ILE  81          HG11      ILE  81  -2.430   3.985  -2.047
  694   1HG2  ILE  81          HG21      ILE  81  -1.626   7.448  -2.213
  695   2HG2  ILE  81          HG22      ILE  81  -3.251   8.133  -2.222
  696   3HG2  ILE  81          HG23      ILE  81  -2.606   7.373  -3.676
  697   1HD1  ILE  81          HD11      ILE  81  -1.795   4.363  -4.693
  698   2HD1  ILE  81          HD12      ILE  81  -3.257   5.335  -4.533
  699   3HD1  ILE  81          HD13      ILE  81  -3.287   3.621  -4.118
  700    H    TRP  82           HN       TRP  82  -5.403   5.945   0.796
  701    HA   TRP  82           HA       TRP  82  -5.404   2.989   1.122
  702   1HB   TRP  82          HB2       TRP  82  -7.165   3.614   2.959
  703   2HB   TRP  82          HB1       TRP  82  -5.447   3.861   3.265
  704    HD1  TRP  82           HD1      TRP  82  -4.530   6.318   3.272
  705    HE1  TRP  82           HE1      TRP  82  -5.691   8.617   3.461
  706    HE3  TRP  82           HE3      TRP  82  -9.351   4.941   2.344
  707    HZ2  TRP  82           HZ2      TRP  82  -8.320   9.716   3.244
  708    HZ3  TRP  82           HZ3      TRP  82 -11.165   6.630   2.341
  709    HH2  TRP  82           HH2      TRP  82 -10.655   9.013   2.791
  710    H    ARG  83           HN       ARG  83  -7.417   1.845   1.208
  711    HA   ARG  83           HA       ARG  83  -9.938   2.800   0.333
  712   1HB   ARG  83          HB2       ARG  83  -8.068   2.616  -1.795
  713   2HB   ARG  83          HB1       ARG  83  -9.147   1.232  -1.965
  714   1HG   ARG  83          HG2       ARG  83 -11.100   2.692  -1.899
  715   2HG   ARG  83          HG1       ARG  83 -10.075   4.095  -1.600
  716   1HD   ARG  83          HD2       ARG  83  -8.907   3.575  -3.793
  717   2HD   ARG  83          HD1       ARG  83 -10.178   2.392  -4.100
  718    HE   ARG  83           HE       ARG  83 -10.487   5.317  -4.164
  719   1HH1  ARG  83          HH21      ARG  83 -12.763   4.367  -2.540
  720   2HH1  ARG  83          HH22      ARG  83 -13.946   3.948  -3.734
  721   1HH2  ARG  83          HH11      ARG  83 -11.656   3.840  -6.347
  722   2HH2  ARG  83          HH12      ARG  83 -13.317   3.649  -5.896
  723    H    TYR  84           HN       TYR  84 -11.127   0.680  -0.777
  724    HA   TYR  84           HA       TYR  84 -12.056  -1.377  -0.138
  725   1HB   TYR  84          HB2       TYR  84  -9.168  -1.795  -0.753
  726   2HB   TYR  84          HB1       TYR  84 -10.045  -3.140  -0.033
  727    HD1  TYR  84           HD1      TYR  84 -10.215  -0.652  -2.816
  728    HD2  TYR  84           HD2      TYR  84 -11.469  -4.489  -1.344
  729    HE1  TYR  84           HE1      TYR  84 -11.250  -1.156  -5.013
  730    HE2  TYR  84           HE2      TYR  84 -12.504  -4.993  -3.541
  731    HH   TYR  84           HH       TYR  84 -11.853  -3.795  -6.199
  732    H    THR  85           HN       THR  85 -12.719  -0.722   2.016
  733    HA   THR  85           HA       THR  85 -11.063  -0.884   4.333
  734    HB   THR  85           HB       THR  85 -13.350   0.194   4.184
  735    HG1  THR  85           HG1      THR  85 -12.908   0.107   6.227
  736   1HG2  THR  85          HG21      THR  85 -14.362  -2.618   4.659
  737   2HG2  THR  85          HG22      THR  85 -14.406  -1.834   3.079
  738   3HG2  THR  85          HG23      THR  85 -15.318  -1.155   4.427
  739    H    LYS  86           HN       LYS  86 -12.549  -3.410   2.427
  740    HA   LYS  86           HA       LYS  86 -12.411  -5.419   4.544
  741   1HB   LYS  86          HB2       LYS  86 -14.069  -5.473   2.637
  742   2HB   LYS  86          HB1       LYS  86 -12.732  -5.885   1.568
  743   1HG   LYS  86          HG2       LYS  86 -12.269  -7.906   2.840
  744   2HG   LYS  86          HG1       LYS  86 -13.481  -7.467   4.043
  745   1HD   LYS  86          HD2       LYS  86 -15.095  -8.432   2.812
  746   2HD   LYS  86          HD1       LYS  86 -14.697  -7.396   1.441
  747   1HE   LYS  86          HE2       LYS  86 -12.624  -9.211   1.407
  748   2HE   LYS  86          HE1       LYS  86 -13.980 -10.208   1.935
  749   1HZ   LYS  86          HZ1       LYS  86 -13.831 -10.165  -0.465
  750   2HZ   LYS  86          HZ2       LYS  86 -13.928  -8.470  -0.473
  751   3HZ   LYS  86          HZ3       LYS  86 -15.256  -9.397   0.041
  752    H    THR  87           HN       THR  87 -10.896  -5.750   1.305
  753    HA   THR  87           HA       THR  87  -8.213  -5.989   2.495
  754    HB   THR  87           HB       THR  87  -8.039  -8.344   1.324
  755    HG1  THR  87           HG1      THR  87  -9.997  -8.657   0.494
  756   1HG2  THR  87          HG21      THR  87  -9.599  -8.352   3.887
  757   2HG2  THR  87          HG22      THR  87  -7.990  -7.629   3.848
  758   3HG2  THR  87          HG23      THR  87  -8.204  -9.328   3.428
  759    H    GLN  88           HN       GLN  88  -6.559  -6.499   0.785
  760    HA   GLN  88           HA       GLN  88  -7.054  -6.477  -2.007
  761   1HB   GLN  88          HB2       GLN  88  -7.942  -4.146  -1.363
  762   2HB   GLN  88          HB1       GLN  88  -6.258  -3.717  -1.072
  763   1HG   GLN  88          HG2       GLN  88  -6.616  -3.083  -3.317
  764   2HG   GLN  88          HG1       GLN  88  -5.813  -4.648  -3.445
  765   1HE2  GLN  88          HE21      GLN  88  -7.132  -6.513  -4.098
  766   2HE2  GLN  88          HE22      GLN  88  -8.664  -6.301  -4.795
  767    H    VAL  89           HN       VAL  89  -4.900  -5.609   0.657
  768    HA   VAL  89           HA       VAL  89  -2.450  -5.220  -0.631
  769    HB   VAL  89           HB       VAL  89  -2.965  -6.794   1.916
  770   1HG1  VAL  89          HG11      VAL  89  -0.741  -7.300   1.356
  771   2HG1  VAL  89          HG12      VAL  89  -0.566  -5.874   2.378
  772   3HG1  VAL  89          HG13      VAL  89  -0.464  -5.719   0.624
  773   1HG2  VAL  89          HG21      VAL  89  -2.350  -4.599   2.986
  774   2HG2  VAL  89          HG22      VAL  89  -3.856  -4.537   2.070
  775   3HG2  VAL  89          HG23      VAL  89  -2.378  -3.864   1.383
  776    H    GLU  90           HN       GLU  90  -4.107  -8.311   0.011
  777    HA   GLU  90           HA       GLU  90  -2.023 -10.082  -0.752
  778   1HB   GLU  90          HB2       GLU  90  -4.602 -10.411   0.087
  779   2HB   GLU  90          HB1       GLU  90  -4.748 -10.854  -1.613
  780   1HG   GLU  90          HG2       GLU  90  -2.661 -11.996   0.269
  781   2HG   GLU  90          HG1       GLU  90  -4.183 -12.795  -0.122
  782    H    TRP  91           HN       TRP  91  -4.523  -8.491  -2.758
  783    HA   TRP  91           HA       TRP  91  -3.847  -9.685  -5.247
  784   1HB   TRP  91          HB2       TRP  91  -5.866  -8.271  -4.858
  785   2HB   TRP  91          HB1       TRP  91  -4.821  -6.855  -4.779
  786    HD1  TRP  91           HD1      TRP  91  -6.317  -9.349  -7.208
  787    HE1  TRP  91           HE1      TRP  91  -5.851  -8.570  -9.620
  788    HE3  TRP  91           HE3      TRP  91  -3.102  -5.492  -6.283
  789    HZ2  TRP  91           HZ2      TRP  91  -4.317  -6.572 -10.977
  790    HZ3  TRP  91           HZ3      TRP  91  -2.154  -4.169  -8.150
  791    HH2  TRP  91           HH2      TRP  91  -2.756  -4.704 -10.495
  792    H    LEU  92           HN       LEU  92  -2.610  -6.695  -3.719
  793    HA   LEU  92           HA       LEU  92  -0.782  -6.005  -5.822
  794   1HB   LEU  92          HB2       LEU  92  -0.788  -5.373  -2.858
  795   2HB   LEU  92          HB1       LEU  92   0.394  -4.701  -3.982
  796    HG   LEU  92           HG       LEU  92  -2.345  -4.439  -4.974
  797   1HD1  LEU  92          HD11      LEU  92  -1.594  -3.066  -2.376
  798   2HD1  LEU  92          HD12      LEU  92  -2.875  -4.261  -2.582
  799   3HD1  LEU  92          HD13      LEU  92  -3.008  -2.681  -3.355
  800   1HD2  LEU  92          HD21      LEU  92  -0.201  -2.393  -4.315
  801   2HD2  LEU  92          HD22      LEU  92  -1.592  -2.146  -5.370
  802   3HD2  LEU  92          HD23      LEU  92  -0.314  -3.267  -5.843
  803    H    LYS  93           HN       LYS  93  -0.487  -8.136  -3.005
  804    HA   LYS  93           HA       LYS  93   2.346  -8.571  -3.157
  805   1HB   LYS  93          HB2       LYS  93   0.057  -9.727  -1.742
  806   2HB   LYS  93          HB1       LYS  93   1.262 -10.939  -2.174
  807   1HG   LYS  93          HG2       LYS  93   2.553 -10.237  -0.473
  808   2HG   LYS  93          HG1       LYS  93   2.676  -8.654  -1.240
  809   1HD   LYS  93          HD2       LYS  93   0.465  -8.059  -0.182
  810   2HD   LYS  93          HD1       LYS  93   0.552  -9.575   0.715
  811   1HE   LYS  93          HE2       LYS  93   1.479  -7.993   2.203
  812   2HE   LYS  93          HE1       LYS  93   2.890  -8.759   1.473
  813   1HZ   LYS  93          HZ1       LYS  93   3.399  -6.913   0.286
  814   2HZ   LYS  93          HZ2       LYS  93   2.610  -6.151   1.583
  815   3HZ   LYS  93          HZ3       LYS  93   1.786  -6.417   0.122
  816    H    ARG  94           HN       ARG  94  -0.403 -10.480  -4.450
  817    HA   ARG  94           HA       ARG  94   1.071 -12.501  -5.765
  818   1HB   ARG  94          HB2       ARG  94  -1.528 -11.193  -6.620
  819   2HB   ARG  94          HB1       ARG  94  -0.902 -12.710  -7.267
  820   1HG   ARG  94          HG2       ARG  94  -0.771 -13.157  -4.555
  821   2HG   ARG  94          HG1       ARG  94  -2.230 -12.175  -4.693
  822   1HD   ARG  94          HD2       ARG  94  -1.676 -14.637  -6.374
  823   2HD   ARG  94          HD1       ARG  94  -2.661 -14.639  -4.912
  824    HE   ARG  94           HE       ARG  94  -3.853 -12.679  -6.423
  825   1HH1  ARG  94          HH21      ARG  94  -2.563 -14.307  -8.716
  826   2HH1  ARG  94          HH22      ARG  94  -3.893 -15.321  -9.167
  827   1HH2  ARG  94          HH11      ARG  94  -5.706 -14.682  -6.272
  828   2HH2  ARG  94          HH12      ARG  94  -5.676 -15.533  -7.779
  829    H    LYS  95           HN       LYS  95   0.187  -9.248  -6.860
  830    HA   LYS  95           HA       LYS  95   1.182  -9.455  -9.529
  831   1HB   LYS  95          HB2       LYS  95  -0.299  -7.624  -8.667
  832   2HB   LYS  95          HB1       LYS  95   1.086  -6.975  -7.789
  833   1HG   LYS  95          HG2       LYS  95   2.214  -6.369  -9.749
  834   2HG   LYS  95          HG1       LYS  95   1.308  -7.512 -10.740
  835   1HD   LYS  95          HD2       LYS  95   0.366  -5.432 -11.320
  836   2HD   LYS  95          HD1       LYS  95  -0.764  -6.071 -10.126
  837   1HE   LYS  95          HE2       LYS  95  -0.451  -3.962  -9.241
  838   2HE   LYS  95          HE1       LYS  95   0.876  -4.801  -8.440
  839   1HZ   LYS  95          HZ1       LYS  95   1.109  -3.314 -11.000
  840   2HZ   LYS  95          HZ2       LYS  95   2.378  -4.049 -10.143
  841   3HZ   LYS  95          HZ3       LYS  95   1.568  -2.709  -9.484
  842    H    GLY  96           HN       GLY  96   2.796  -8.732  -6.446
  843   1HA   GLY  96          HA2       GLY  96   5.259  -7.762  -7.570
  844   2HA   GLY  96          HA1       GLY  96   5.063  -8.414  -5.943
  845    H    TYR  97           HN       TYR  97   4.125 -11.014  -6.696
  846    HA   TYR  97           HA       TYR  97   6.634 -12.356  -7.103
  847   1HB   TYR  97          HB2       TYR  97   3.965 -13.679  -7.561
  848   2HB   TYR  97          HB1       TYR  97   5.441 -14.378  -6.899
  849    HD1  TYR  97           HD1      TYR  97   6.270 -12.348  -4.930
  850    HD2  TYR  97           HD2      TYR  97   2.361 -13.870  -5.850
  851    HE1  TYR  97           HE1      TYR  97   5.504 -11.746  -2.652
  852    HE2  TYR  97           HE2      TYR  97   1.593 -13.272  -3.572
  853    HH   TYR  97           HH       TYR  97   3.032 -12.962  -1.174
  854    H    LEU  98           HN       LEU  98   3.780 -12.144  -9.290
  855    HA   LEU  98           HA       LEU  98   5.070 -13.454 -11.480
  856   1HB   LEU  98          HB2       LEU  98   3.293 -12.423 -12.896
  857   2HB   LEU  98          HB1       LEU  98   2.653 -13.214 -11.460
  858    HG   LEU  98           HG       LEU  98   3.066 -10.674 -10.522
  859   1HD1  LEU  98          HD11      LEU  98   2.737  -9.059 -12.128
  860   2HD1  LEU  98          HD12      LEU  98   1.759 -10.120 -13.142
  861   3HD1  LEU  98          HD13      LEU  98   3.515 -10.270 -13.146
  862   1HD2  LEU  98          HD21      LEU  98   0.574 -10.403 -10.944
  863   2HD2  LEU  98          HD22      LEU  98   1.030 -11.906 -10.144
  864   3HD2  LEU  98          HD23      LEU  98   0.642 -11.906 -11.863
  865    H    ASP  99           HN       ASP  99   4.926 -10.024 -10.560
  866    HA   ASP  99           HA       ASP  99   6.201  -9.000 -12.925
  867   1HB   ASP  99          HB2       ASP  99   4.952  -7.715 -11.040
  868   2HB   ASP  99          HB1       ASP  99   6.501  -7.747 -10.198
  869    H    GLU 100           HN       GLU 100   7.490  -9.971  -9.738
  870    HA   GLU 100           HA       GLU 100  10.232  -9.350 -10.301
  871   1HB   GLU 100          HB2       GLU 100   9.081  -9.889  -8.032
  872   2HB   GLU 100          HB1       GLU 100   9.382 -11.575  -8.452
  873   1HG   GLU 100          HG2       GLU 100  11.732 -11.268  -8.480
  874   2HG   GLU 100          HG1       GLU 100  11.585  -9.511  -8.555
  875    H    LEU 101           HN       LEU 101   8.275 -12.251 -10.883
  876    HA   LEU 101           HA       LEU 101  10.374 -14.063 -11.519
  877   1HB   LEU 101          HB2       LEU 101   7.498 -13.980 -11.762
  878   2HB   LEU 101          HB1       LEU 101   8.198 -14.640 -13.240
  879    HG   LEU 101           HG       LEU 101   9.176 -15.594 -10.559
  880   1HD1  LEU 101          HD11      LEU 101   6.713 -15.815 -10.518
  881   2HD1  LEU 101          HD12      LEU 101   7.491 -17.394 -10.637
  882   3HD1  LEU 101          HD13      LEU 101   6.766 -16.658 -12.067
  883   1HD2  LEU 101          HD21      LEU 101   8.937 -16.855 -13.312
  884   2HD2  LEU 101          HD22      LEU 101   9.627 -17.640 -11.891
  885   3HD2  LEU 101          HD23      LEU 101  10.418 -16.225 -12.588
  886    H    LEU 102           HN       LEU 102   8.356 -12.167 -13.805
  887    HA   LEU 102           HA       LEU 102   8.894 -11.177 -15.854
  888   1HB   LEU 102          HB2       LEU 102  11.047 -10.552 -14.585
  889   2HB   LEU 102          HB1       LEU 102  11.788 -11.927 -15.404
  890    HG   LEU 102           HG       LEU 102  10.927 -10.912 -17.588
  891   1HD1  LEU 102          HD11      LEU 102  10.634  -8.372 -17.383
  892   2HD1  LEU 102          HD12      LEU 102  10.408  -8.644 -15.654
  893   3HD1  LEU 102          HD13      LEU 102   9.289  -9.361 -16.814
  894   1HD2  LEU 102          HD21      LEU 102  12.846  -9.459 -17.787
  895   2HD2  LEU 102          HD22      LEU 102  13.302 -10.783 -16.714
  896   3HD2  LEU 102          HD23      LEU 102  12.898  -9.202 -16.043
  Start of MODEL    5
    1   1H    MET   1          HT1       MET   1 -18.930  12.179 -10.484
    2   2H    MET   1          HT2       MET   1 -19.462  13.754 -10.839
    3   3H    MET   1          HT3       MET   1 -18.013  13.172 -11.511
    4    HA   MET   1           HA       MET   1 -19.776  13.161 -13.158
    5   1HB   MET   1          HB2       MET   1 -18.237  10.856 -12.283
    6   2HB   MET   1          HB1       MET   1 -19.737  10.351 -13.063
    7   1HG   MET   1          HG2       MET   1 -18.251  10.566 -14.873
    8   2HG   MET   1          HG1       MET   1 -19.112  12.106 -14.884
    9   1HE   MET   1          HE1       MET   1 -16.723  11.847 -16.446
   10   2HE   MET   1          HE2       MET   1 -15.772  10.722 -15.479
   11   3HE   MET   1          HE3       MET   1 -15.154  12.342 -15.794
   12    H    ALA   2           HN       ALA   2 -21.953  13.337 -13.242
   13    HA   ALA   2           HA       ALA   2 -23.598  11.486 -11.560
   14   1HB   ALA   2          HB1       ALA   2 -25.156  13.305 -11.105
   15   2HB   ALA   2          HB2       ALA   2 -24.228  14.401 -12.129
   16   3HB   ALA   2          HB3       ALA   2 -23.537  13.810 -10.619
   17    H    GLU   3           HN       GLU   3 -22.847  11.113 -14.325
   18    HA   GLU   3           HA       GLU   3 -25.556  11.237 -15.572
   19   1HB   GLU   3          HB2       GLU   3 -22.914  12.071 -16.787
   20   2HB   GLU   3          HB1       GLU   3 -24.300  11.631 -17.784
   21   1HG   GLU   3          HG2       GLU   3 -25.576  13.453 -17.053
   22   2HG   GLU   3          HG1       GLU   3 -24.632  13.646 -15.575
   23    H    GLN   4           HN       GLN   4 -24.373   9.024 -14.201
   24    HA   GLN   4           HA       GLN   4 -24.483   7.020 -16.336
   25   1HB   GLN   4          HB2       GLN   4 -22.293   5.977 -15.673
   26   2HB   GLN   4          HB1       GLN   4 -22.120   7.537 -16.472
   27   1HG   GLN   4          HG2       GLN   4 -21.087   8.407 -14.670
   28   2HG   GLN   4          HG1       GLN   4 -22.417   7.921 -13.620
   29   1HE2  GLN   4          HE21      GLN   4 -22.323   5.669 -12.715
   30   2HE2  GLN   4          HE22      GLN   4 -20.820   4.895 -12.560
   31    H    GLN   5           HN       GLN   5 -25.061   4.977 -15.532
   32    HA   GLN   5           HA       GLN   5 -26.084   4.946 -12.779
   33   1HB   GLN   5          HB2       GLN   5 -26.213   3.033 -15.110
   34   2HB   GLN   5          HB1       GLN   5 -26.745   2.544 -13.501
   35   1HG   GLN   5          HG2       GLN   5 -28.031   4.903 -13.664
   36   2HG   GLN   5          HG1       GLN   5 -27.958   4.509 -15.383
   37   1HE2  GLN   5          HE21      GLN   5 -29.157   3.322 -12.233
   38   2HE2  GLN   5          HE22      GLN   5 -30.283   2.234 -12.890
   39    H    GLN   6           HN       GLN   6 -25.615   2.974 -11.382
   40    HA   GLN   6           HA       GLN   6 -22.820   2.769 -10.843
   41   1HB   GLN   6          HB2       GLN   6 -23.455   0.924  -9.297
   42   2HB   GLN   6          HB1       GLN   6 -24.480   2.342  -9.099
   43   1HG   GLN   6          HG2       GLN   6 -25.964   1.064 -10.921
   44   2HG   GLN   6          HG1       GLN   6 -25.152  -0.341 -10.230
   45   1HE2  GLN   6          HE21      GLN   6 -25.415  -0.682  -7.841
   46   2HE2  GLN   6          HE22      GLN   6 -26.774  -0.042  -7.052
   47    H    GLU   7           HN       GLU   7 -21.322   1.717 -12.016
   48    HA   GLU   7           HA       GLU   7 -22.111  -0.801 -13.431
   49   1HB   GLU   7          HB2       GLU   7 -21.068   1.664 -14.507
   50   2HB   GLU   7          HB1       GLU   7 -19.898   0.373 -14.772
   51   1HG   GLU   7          HG2       GLU   7 -21.462   0.461 -16.652
   52   2HG   GLU   7          HG1       GLU   7 -21.707  -1.033 -15.747
   53    H    GLN   8           HN       GLN   8 -19.549  -1.549 -14.293
   54    HA   GLN   8           HA       GLN   8 -18.461  -2.788 -11.964
   55   1HB   GLN   8          HB2       GLN   8 -16.642  -3.528 -13.405
   56   2HB   GLN   8          HB1       GLN   8 -18.158  -3.639 -14.294
   57   1HG   GLN   8          HG2       GLN   8 -17.018  -2.495 -15.905
   58   2HG   GLN   8          HG1       GLN   8 -17.395  -1.089 -14.911
   59   1HE2  GLN   8          HE21      GLN   8 -14.872  -3.679 -15.120
   60   2HE2  GLN   8          HE22      GLN   8 -13.587  -2.655 -14.693
   61    H    GLN   9           HN       GLN   9 -16.315  -2.446 -11.011
   62    HA   GLN   9           HA       GLN   9 -15.570   0.449 -10.975
   63   1HB   GLN   9          HB2       GLN   9 -14.512  -0.101  -8.754
   64   2HB   GLN   9          HB1       GLN   9 -16.262  -0.305  -8.786
   65   1HG   GLN   9          HG2       GLN   9 -16.103  -2.666  -8.874
   66   2HG   GLN   9          HG1       GLN   9 -14.406  -2.618  -9.354
   67   1HE2  GLN   9          HE21      GLN   9 -12.800  -2.059  -7.672
   68   2HE2  GLN   9          HE22      GLN   9 -13.195  -2.194  -6.026
   69    H    ILE  10           HN       ILE  10 -13.400   1.038 -11.240
   70    HA   ILE  10           HA       ILE  10 -11.449  -1.141 -11.798
   71    HB   ILE  10           HB       ILE  10 -12.372  -0.424 -13.970
   72   1HG1  ILE  10          HG12      ILE  10 -10.001   0.735 -14.708
   73   2HG1  ILE  10          HG11      ILE  10  -9.548  -0.027 -13.183
   74   1HG2  ILE  10          HG21      ILE  10 -12.767   1.733 -14.511
   75   2HG2  ILE  10          HG22      ILE  10 -11.177   2.250 -13.951
   76   3HG2  ILE  10          HG23      ILE  10 -12.505   2.088 -12.804
   77   1HD1  ILE  10          HD11      ILE  10  -9.252  -1.533 -15.166
   78   2HD1  ILE  10          HD12      ILE  10 -10.992  -1.453 -15.435
   79   3HD1  ILE  10          HD13      ILE  10 -10.361  -2.182 -13.958
   80    H    ARG  11           HN       ARG  11 -10.849  -0.407  -9.573
   81    HA   ARG  11           HA       ARG  11  -9.297   2.141  -9.572
   82   1HB   ARG  11          HB2       ARG  11 -10.992   0.812  -7.631
   83   2HB   ARG  11          HB1       ARG  11  -9.394   1.130  -6.965
   84   1HG   ARG  11          HG2       ARG  11 -10.345   3.176  -6.511
   85   2HG   ARG  11          HG1       ARG  11  -9.818   3.502  -8.162
   86   1HD   ARG  11          HD2       ARG  11 -12.053   4.149  -8.276
   87   2HD   ARG  11          HD1       ARG  11 -12.162   2.468  -8.797
   88    HE   ARG  11           HE       ARG  11 -12.506   2.289  -6.068
   89   1HH1  ARG  11          HH21      ARG  11 -14.792   1.731  -7.857
   90   2HH1  ARG  11          HH22      ARG  11 -15.941   2.947  -7.412
   91   1HH2  ARG  11          HH11      ARG  11 -13.602   4.939  -5.788
   92   2HH2  ARG  11          HH12      ARG  11 -15.266   4.768  -6.236
   93    H    VAL  12           HN       VAL  12  -8.584  -0.718 -10.479
   94    HA   VAL  12           HA       VAL  12  -6.276  -1.301  -8.719
   95    HB   VAL  12           HB       VAL  12  -7.923  -3.051  -9.761
   96   1HG1  VAL  12          HG11      VAL  12  -7.504  -2.084 -12.102
   97   2HG1  VAL  12          HG12      VAL  12  -7.419  -3.839 -11.946
   98   3HG1  VAL  12          HG13      VAL  12  -5.936  -2.888 -12.032
   99   1HG2  VAL  12          HG21      VAL  12  -5.503  -3.269  -8.634
  100   2HG2  VAL  12          HG22      VAL  12  -5.082  -3.823 -10.254
  101   3HG2  VAL  12          HG23      VAL  12  -6.331  -4.660  -9.333
  102    H    ARG  13           HN       ARG  13  -4.174  -1.899  -9.989
  103    HA   ARG  13           HA       ARG  13  -2.420  -1.266 -11.402
  104   1HB   ARG  13          HB2       ARG  13  -4.521  -1.338 -13.100
  105   2HB   ARG  13          HB1       ARG  13  -4.149   0.382 -13.181
  106   1HG   ARG  13          HG2       ARG  13  -2.342  -0.014 -14.462
  107   2HG   ARG  13          HG1       ARG  13  -1.705  -1.160 -13.283
  108   1HD   ARG  13          HD2       ARG  13  -2.331  -2.919 -14.546
  109   2HD   ARG  13          HD1       ARG  13  -3.971  -2.292 -14.705
  110    HE   ARG  13           HE       ARG  13  -2.363  -0.752 -16.435
  111   1HH1  ARG  13          HH11      ARG  13  -0.856  -3.191 -17.023
  112   2HH1  ARG  13          HH12      ARG  13  -1.814  -3.977 -18.233
  113   1HH2  ARG  13          HH21      ARG  13  -4.674  -2.125 -17.552
  114   2HH2  ARG  13          HH22      ARG  13  -3.982  -3.372 -18.533
  115    H    ILE  14           HN       ILE  14  -1.400   0.091  -9.933
  116    HA   ILE  14           HA       ILE  14  -2.124   2.990 -10.084
  117    HB   ILE  14           HB       ILE  14  -2.515   1.909  -7.849
  118   1HG1  ILE  14          HG12      ILE  14  -0.955   3.600  -6.597
  119   2HG1  ILE  14          HG11      ILE  14  -0.518   4.132  -8.221
  120   1HG2  ILE  14          HG21      ILE  14  -0.478   0.362  -8.134
  121   2HG2  ILE  14          HG22      ILE  14  -0.720   1.076  -6.540
  122   3HG2  ILE  14          HG23      ILE  14   0.494   1.746  -7.630
  123   1HD1  ILE  14          HD11      ILE  14  -3.215   4.213  -6.877
  124   2HD1  ILE  14          HD12      ILE  14  -3.083   4.249  -8.635
  125   3HD1  ILE  14          HD13      ILE  14  -2.339   5.522  -7.668
  126    HA   PRO  15           HA       PRO  15   1.953   3.438 -11.765
  127   1HB   PRO  15          HB2       PRO  15   1.954   6.191 -11.794
  128   2HB   PRO  15          HB1       PRO  15   1.105   5.197 -12.989
  129   1HG   PRO  15          HG2       PRO  15  -0.016   6.765 -10.712
  130   2HG   PRO  15          HG1       PRO  15  -0.778   6.310 -12.245
  131   1HD   PRO  15          HD2       PRO  15  -1.212   5.058  -9.750
  132   2HD   PRO  15          HD1       PRO  15  -1.687   4.414 -11.336
  133    H    ARG  16           HN       ARG  16   3.701   5.519 -11.124
  134    HA   ARG  16           HA       ARG  16   5.235   6.262  -9.522
  135   1HB   ARG  16          HB2       ARG  16   2.933   6.854  -8.358
  136   2HB   ARG  16          HB1       ARG  16   3.371   5.523  -7.286
  137   1HG   ARG  16          HG2       ARG  16   5.519   6.603  -6.784
  138   2HG   ARG  16          HG1       ARG  16   5.132   7.917  -7.895
  139   1HD   ARG  16          HD2       ARG  16   3.274   7.238  -5.623
  140   2HD   ARG  16          HD1       ARG  16   4.674   8.275  -5.358
  141    HE   ARG  16           HE       ARG  16   2.515   8.921  -7.330
  142   1HH1  ARG  16          HH21      ARG  16   5.103  10.465  -7.468
  143   2HH1  ARG  16          HH22      ARG  16   4.743  11.849  -6.491
  144   1HH2  ARG  16          HH11      ARG  16   1.956  10.404  -5.001
  145   2HH2  ARG  16          HH12      ARG  16   2.958  11.813  -5.091
  146    H    LYS  17           HN       LYS  17   6.665   4.534  -9.949
  147    HA   LYS  17           HA       LYS  17   7.119   2.721  -7.721
  148   1HB   LYS  17          HB2       LYS  17   7.032   0.654  -9.273
  149   2HB   LYS  17          HB1       LYS  17   5.492   1.296  -8.701
  150   1HG   LYS  17          HG2       LYS  17   5.063   2.387 -10.788
  151   2HG   LYS  17          HG1       LYS  17   6.715   2.120 -11.344
  152   1HD   LYS  17          HD2       LYS  17   6.278  -0.356 -11.236
  153   2HD   LYS  17          HD1       LYS  17   4.587   0.012 -10.889
  154   1HE   LYS  17          HE2       LYS  17   4.503   1.343 -13.017
  155   2HE   LYS  17          HE1       LYS  17   6.135   0.784 -13.379
  156   1HZ   LYS  17          HZ1       LYS  17   5.327  -1.500 -13.275
  157   2HZ   LYS  17          HZ2       LYS  17   4.494  -0.605 -14.454
  158   3HZ   LYS  17          HZ3       LYS  17   3.754  -0.944 -12.963
  159    H    GLU  18           HN       GLU  18   9.005   4.251  -8.075
  160    HA   GLU  18           HA       GLU  18  10.727   4.101 -10.338
  161   1HB   GLU  18          HB2       GLU  18  10.854   5.804  -8.476
  162   2HB   GLU  18          HB1       GLU  18  11.588   4.559  -7.466
  163   1HG   GLU  18          HG2       GLU  18  12.818   4.900 -10.142
  164   2HG   GLU  18          HG1       GLU  18  13.018   6.264  -9.042
  165    H    GLU  19           HN       GLU  19  11.137   2.449  -7.169
  166    HA   GLU  19           HA       GLU  19  12.766   0.381  -8.587
  167   1HB   GLU  19          HB2       GLU  19  13.142   1.808  -6.111
  168   2HB   GLU  19          HB1       GLU  19  13.005   0.082  -5.773
  169   1HG   GLU  19          HG2       GLU  19  14.879  -0.458  -7.041
  170   2HG   GLU  19          HG1       GLU  19  14.733   0.977  -8.056
  171    H    ASN  20           HN       ASN  20  10.799   0.421  -5.584
  172    HA   ASN  20           HA       ASN  20   8.978  -1.614  -6.665
  173   1HB   ASN  20          HB2       ASN  20  11.176  -2.271  -4.752
  174   2HB   ASN  20          HB1       ASN  20   9.602  -3.010  -4.461
  175   1HD2  ASN  20          HD21      ASN  20   8.596  -4.058  -6.557
  176   2HD2  ASN  20          HD22      ASN  20   9.680  -4.882  -7.571
  177    H    GLU  21           HN       GLU  21   7.036  -0.903  -5.949
  178    HA   GLU  21           HA       GLU  21   6.775   0.859  -3.646
  179   1HB   GLU  21          HB2       GLU  21   5.268   0.493  -5.863
  180   2HB   GLU  21          HB1       GLU  21   4.369  -0.521  -4.734
  181   1HG   GLU  21          HG2       GLU  21   4.807   1.689  -3.193
  182   2HG   GLU  21          HG1       GLU  21   4.680   2.422  -4.792
  183    H    ILE  22           HN       ILE  22   5.493   0.331  -1.689
  184    HA   ILE  22           HA       ILE  22   5.646  -2.596  -1.047
  185    HB   ILE  22           HB       ILE  22   5.572  -1.496   1.408
  186   1HG1  ILE  22          HG12      ILE  22   6.977   0.543  -0.362
  187   2HG1  ILE  22          HG11      ILE  22   5.526   0.830   0.595
  188   1HG2  ILE  22          HG21      ILE  22   8.255  -1.371   0.202
  189   2HG2  ILE  22          HG22      ILE  22   7.367  -2.855  -0.143
  190   3HG2  ILE  22          HG23      ILE  22   7.658  -2.370   1.528
  191   1HD1  ILE  22          HD11      ILE  22   8.342   0.343   1.553
  192   2HD1  ILE  22          HD12      ILE  22   6.961   0.087   2.620
  193   3HD1  ILE  22          HD13      ILE  22   7.266   1.686   1.940
  194    H    LEU  23           HN       LEU  23   3.926  -3.399   0.526
  195    HA   LEU  23           HA       LEU  23   1.390  -1.802   0.029
  196   1HB   LEU  23          HB2       LEU  23   0.241  -4.095   0.243
  197   2HB   LEU  23          HB1       LEU  23   1.146  -3.792  -1.237
  198    HG   LEU  23           HG       LEU  23   2.816  -4.932   0.886
  199   1HD1  LEU  23          HD11      LEU  23   0.869  -6.138   1.574
  200   2HD1  LEU  23          HD12      LEU  23   1.788  -7.241   0.551
  201   3HD1  LEU  23          HD13      LEU  23   0.371  -6.415  -0.094
  202   1HD2  LEU  23          HD21      LEU  23   3.339  -4.702  -1.585
  203   2HD2  LEU  23          HD22      LEU  23   2.140  -5.959  -1.887
  204   3HD2  LEU  23          HD23      LEU  23   3.579  -6.324  -0.936
  205    H    GLY  24           HN       GLY  24   0.365  -1.099   1.925
  206   1HA   GLY  24          HA2       GLY  24   0.876  -2.747   4.360
  207   2HA   GLY  24          HA1       GLY  24   1.243  -1.030   4.407
  208    H    ILE  25           HN       ILE  25  -0.498  -2.242   6.174
  209    HA   ILE  25           HA       ILE  25  -3.188  -1.251   5.331
  210    HB   ILE  25           HB       ILE  25  -4.080  -2.613   7.203
  211   1HG1  ILE  25          HG12      ILE  25  -2.003  -4.377   7.808
  212   2HG1  ILE  25          HG11      ILE  25  -1.229  -2.793   7.848
  213   1HG2  ILE  25          HG21      ILE  25  -3.701  -4.805   6.183
  214   2HG2  ILE  25          HG22      ILE  25  -2.266  -4.198   5.359
  215   3HG2  ILE  25          HG23      ILE  25  -3.860  -3.581   4.923
  216   1HD1  ILE  25          HD11      ILE  25  -2.482  -3.770   9.986
  217   2HD1  ILE  25          HD12      ILE  25  -3.890  -3.081   9.179
  218   3HD1  ILE  25          HD13      ILE  25  -2.527  -2.048   9.608
  219    H    ILE  26           HN       ILE  26  -4.194   0.315   6.657
  220    HA   ILE  26           HA       ILE  26  -2.318   1.724   8.470
  221    HB   ILE  26           HB       ILE  26  -4.186   3.511   8.403
  222   1HG1  ILE  26          HG12      ILE  26  -4.891   2.150   5.804
  223   2HG1  ILE  26          HG11      ILE  26  -5.774   1.781   7.283
  224   1HG2  ILE  26          HG21      ILE  26  -2.328   2.750   6.184
  225   2HG2  ILE  26          HG22      ILE  26  -2.198   4.067   7.349
  226   3HG2  ILE  26          HG23      ILE  26  -3.361   4.170   6.028
  227   1HD1  ILE  26          HD11      ILE  26  -6.363   4.136   7.565
  228   2HD1  ILE  26          HD12      ILE  26  -6.860   3.593   5.963
  229   3HD1  ILE  26          HD13      ILE  26  -5.404   4.569   6.150
  230    H    GLU  27           HN       GLU  27  -2.891   2.481  10.443
  231    HA   GLU  27           HA       GLU  27  -5.328   1.409  11.770
  232   1HB   GLU  27          HB2       GLU  27  -2.477   0.791  12.463
  233   2HB   GLU  27          HB1       GLU  27  -3.630   0.999  13.780
  234   1HG   GLU  27          HG2       GLU  27  -4.888  -0.851  13.157
  235   2HG   GLU  27          HG1       GLU  27  -4.382  -0.758  11.471
  236    H    GLN  28           HN       GLN  28  -6.280   3.114  12.753
  237    HA   GLN  28           HA       GLN  28  -4.786   5.603  13.181
  238   1HB   GLN  28          HB2       GLN  28  -7.039   6.416  14.070
  239   2HB   GLN  28          HB1       GLN  28  -7.016   5.912  12.383
  240   1HG   GLN  28          HG2       GLN  28  -8.505   4.263  12.768
  241   2HG   GLN  28          HG1       GLN  28  -7.587   3.668  14.150
  242   1HE2  GLN  28          HE21      GLN  28  -8.319   4.246  16.256
  243   2HE2  GLN  28          HE22      GLN  28  -9.674   5.231  16.534
  244    H    MET  29           HN       MET  29  -3.431   5.574  14.910
  245    HA   MET  29           HA       MET  29  -3.923   4.053  17.319
  246   1HB   MET  29          HB2       MET  29  -1.996   5.418  18.241
  247   2HB   MET  29          HB1       MET  29  -1.635   4.539  16.757
  248   1HG   MET  29          HG2       MET  29  -1.229   6.449  15.622
  249   2HG   MET  29          HG1       MET  29  -2.713   7.197  16.206
  250   1HE   MET  29          HE1       MET  29  -2.136   9.213  16.315
  251   2HE   MET  29          HE2       MET  29  -0.929  10.051  17.287
  252   3HE   MET  29          HE3       MET  29  -2.407   9.465  18.044
  253    H    LEU  30           HN       LEU  30  -4.577   7.398  16.367
  254    HA   LEU  30           HA       LEU  30  -6.476   7.706  18.536
  255   1HB   LEU  30          HB2       LEU  30  -3.894   8.331  19.222
  256   2HB   LEU  30          HB1       LEU  30  -4.480   9.886  18.633
  257    HG   LEU  30           HG       LEU  30  -5.019   9.859  20.950
  258   1HD1  LEU  30          HD11      LEU  30  -7.547   8.845  19.635
  259   2HD1  LEU  30          HD12      LEU  30  -6.884  10.443  19.294
  260   3HD1  LEU  30          HD13      LEU  30  -7.399  10.033  20.929
  261   1HD2  LEU  30          HD21      LEU  30  -6.323   7.150  20.569
  262   2HD2  LEU  30          HD22      LEU  30  -6.005   7.984  22.089
  263   3HD2  LEU  30          HD23      LEU  30  -4.665   7.346  21.136
  264    H    GLY  31           HN       GLY  31  -4.441   9.724  16.365
  265   1HA   GLY  31          HA2       GLY  31  -6.473  10.386  14.518
  266   2HA   GLY  31          HA1       GLY  31  -6.515  11.618  15.780
  267    H    ALA  32           HN       ALA  32  -5.318  13.377  15.289
  268    HA   ALA  32           HA       ALA  32  -3.605  14.731  14.442
  269   1HB   ALA  32          HB1       ALA  32  -1.422  13.953  14.674
  270   2HB   ALA  32          HB2       ALA  32  -1.833  12.329  14.124
  271   3HB   ALA  32          HB3       ALA  32  -2.289  12.853  15.745
  272    H    SER  33           HN       SER  33  -1.722  14.411  12.473
  273    HA   SER  33           HA       SER  33  -3.412  13.772  10.103
  274   1HB   SER  33          HB2       SER  33  -1.473  15.833  10.730
  275   2HB   SER  33          HB1       SER  33  -1.013  14.984   9.259
  276    HG   SER  33           HG       SER  33  -3.279  16.516   9.834
  277    H    ARG  34           HN       ARG  34  -1.396  12.025  11.927
  278    HA   ARG  34           HA       ARG  34  -0.297  10.563   9.567
  279   1HB   ARG  34          HB2       ARG  34   1.738  10.040  10.980
  280   2HB   ARG  34          HB1       ARG  34   1.610  11.711  10.447
  281   1HG   ARG  34          HG2       ARG  34   0.212  11.603  12.893
  282   2HG   ARG  34          HG1       ARG  34   1.677  10.658  13.147
  283   1HD   ARG  34          HD2       ARG  34   2.023  13.228  11.700
  284   2HD   ARG  34          HD1       ARG  34   1.600  13.349  13.409
  285    HE   ARG  34           HE       ARG  34   3.655  12.132  13.945
  286   1HH1  ARG  34          HH21      ARG  34   4.018  10.569  11.438
  287   2HH1  ARG  34          HH22      ARG  34   5.300  11.420  10.645
  288   1HH2  ARG  34          HH11      ARG  34   4.960  14.282  12.586
  289   2HH2  ARG  34          HH12      ARG  34   5.839  13.527  11.299
  290    H    VAL  35           HN       VAL  35  -0.610   8.408   9.666
  291    HA   VAL  35           HA       VAL  35  -1.786   7.248  12.146
  292    HB   VAL  35           HB       VAL  35  -2.381   7.069   9.275
  293   1HG1  VAL  35          HG11      VAL  35  -2.334   4.553  10.938
  294   2HG1  VAL  35          HG12      VAL  35  -1.416   4.862   9.465
  295   3HG1  VAL  35          HG13      VAL  35  -3.172   4.717   9.397
  296   1HG2  VAL  35          HG21      VAL  35  -3.742   7.673  11.548
  297   2HG2  VAL  35          HG22      VAL  35  -4.232   5.996  11.304
  298   3HG2  VAL  35          HG23      VAL  35  -4.513   7.191  10.038
  299    H    ARG  36           HN       ARG  36  -1.188   4.928  12.525
  300    HA   ARG  36           HA       ARG  36   1.678   4.475  11.786
  301   1HB   ARG  36          HB2       ARG  36   1.402   2.557  13.543
  302   2HB   ARG  36          HB1       ARG  36   1.540   4.216  14.106
  303   1HG   ARG  36          HG2       ARG  36  -0.663   4.315  14.782
  304   2HG   ARG  36          HG1       ARG  36  -1.205   3.211  13.519
  305   1HD   ARG  36          HD2       ARG  36   0.533   2.250  15.789
  306   2HD   ARG  36          HD1       ARG  36  -1.220   2.334  15.950
  307    HE   ARG  36           HE       ARG  36  -0.563   0.935  13.536
  308   1HH1  ARG  36          HH11      ARG  36  -2.580  -0.021  15.523
  309   2HH1  ARG  36          HH12      ARG  36  -1.819  -1.436  16.171
  310   1HH2  ARG  36          HH21      ARG  36   1.340  -0.602  14.991
  311   2HH2  ARG  36          HH22      ARG  36   0.407  -1.763  15.871
  312    H    VAL  37           HN       VAL  37   2.197   2.839  10.347
  313    HA   VAL  37           HA       VAL  37   0.000   0.973   9.634
  314    HB   VAL  37           HB       VAL  37   1.731   2.777   8.031
  315   1HG1  VAL  37          HG11      VAL  37   0.723   0.099   7.143
  316   2HG1  VAL  37          HG12      VAL  37   2.380   0.704   7.107
  317   3HG1  VAL  37          HG13      VAL  37   1.166   1.387   6.025
  318   1HG2  VAL  37          HG21      VAL  37  -0.951   1.915   7.153
  319   2HG2  VAL  37          HG22      VAL  37  -0.256   3.534   7.221
  320   3HG2  VAL  37          HG23      VAL  37  -0.897   2.788   8.684
  321    H    ARG  38           HN       ARG  38   0.584  -1.038   9.035
  322    HA   ARG  38           HA       ARG  38   3.476  -1.866   9.317
  323   1HB   ARG  38          HB2       ARG  38   2.349  -4.205   9.814
  324   2HB   ARG  38          HB1       ARG  38   2.504  -3.033  11.116
  325   1HG   ARG  38          HG2       ARG  38   0.139  -2.245  10.458
  326   2HG   ARG  38          HG1       ARG  38   0.038  -3.733   9.517
  327   1HD   ARG  38          HD2       ARG  38  -0.886  -4.287  11.638
  328   2HD   ARG  38          HD1       ARG  38   0.749  -4.949  11.666
  329    HE   ARG  38           HE       ARG  38   0.690  -2.255  12.727
  330   1HH1  ARG  38          HH11      ARG  38  -1.514  -3.761  14.188
  331   2HH1  ARG  38          HH12      ARG  38  -0.647  -4.397  15.546
  332   1HH2  ARG  38          HH21      ARG  38   2.484  -3.848  14.141
  333   2HH2  ARG  38          HH22      ARG  38   1.622  -4.447  15.519
  334    H    CYS  39           HN       CYS  39   4.225  -3.112   7.489
  335    HA   CYS  39           HA       CYS  39   2.109  -3.741   5.488
  336   1HB   CYS  39          HB2       CYS  39   2.833  -2.201   4.016
  337   2HB   CYS  39          HB1       CYS  39   3.623  -1.463   5.400
  338    HG   CYS  39           HG       CYS  39   5.034  -2.918   3.119
  339    H    LEU  40           HN       LEU  40   2.740  -5.023   3.734
  340    HA   LEU  40           HA       LEU  40   4.786  -7.043   4.367
  341   1HB   LEU  40          HB2       LEU  40   2.279  -6.982   2.814
  342   2HB   LEU  40          HB1       LEU  40   3.579  -7.912   2.082
  343    HG   LEU  40           HG       LEU  40   2.690  -8.236   4.960
  344   1HD1  LEU  40          HD11      LEU  40   1.496  -9.193   2.502
  345   2HD1  LEU  40          HD12      LEU  40   0.939  -9.404   4.163
  346   3HD1  LEU  40          HD13      LEU  40   2.087 -10.546   3.467
  347   1HD2  LEU  40          HD21      LEU  40   4.936  -8.983   4.711
  348   2HD2  LEU  40          HD22      LEU  40   4.608  -9.690   3.129
  349   3HD2  LEU  40          HD23      LEU  40   3.959 -10.446   4.585
  350    H    ASP  41           HN       ASP  41   5.798  -7.866   2.218
  351    HA   ASP  41           HA       ASP  41   7.278  -7.430   0.435
  352   1HB   ASP  41          HB2       ASP  41   5.447  -5.560  -0.171
  353   2HB   ASP  41          HB1       ASP  41   6.663  -4.483   0.510
  354    H    GLY  42           HN       GLY  42   7.332  -7.135   3.432
  355   1HA   GLY  42          HA2       GLY  42   8.936  -6.832   5.073
  356   2HA   GLY  42          HA1       GLY  42  10.087  -6.516   3.789
  357    H    LYS  43           HN       LYS  43   7.243  -4.613   5.178
  358    HA   LYS  43           HA       LYS  43   9.274  -2.552   5.830
  359   1HB   LYS  43          HB2       LYS  43   7.671  -2.372   3.504
  360   2HB   LYS  43          HB1       LYS  43   7.135  -1.127   4.616
  361   1HG   LYS  43          HG2       LYS  43   8.897   0.065   3.821
  362   2HG   LYS  43          HG1       LYS  43   9.870  -0.972   4.865
  363   1HD   LYS  43          HD2       LYS  43   9.725  -2.611   2.768
  364   2HD   LYS  43          HD1       LYS  43   9.475  -1.096   1.902
  365   1HE   LYS  43          HE2       LYS  43  11.631  -0.460   2.172
  366   2HE   LYS  43          HE1       LYS  43  11.652  -0.951   3.865
  367   1HZ   LYS  43          HZ1       LYS  43  13.144  -2.234   2.328
  368   2HZ   LYS  43          HZ2       LYS  43  11.743  -2.897   1.632
  369   3HZ   LYS  43          HZ3       LYS  43  12.092  -3.170   3.273
  370    H    THR  44           HN       THR  44   8.573  -0.909   7.219
  371    HA   THR  44           HA       THR  44   5.893  -1.110   8.476
  372    HB   THR  44           HB       THR  44   8.328  -0.822  10.227
  373    HG1  THR  44           HG1      THR  44   8.667  -2.811   9.399
  374   1HG2  THR  44          HG21      THR  44   6.775  -1.536  11.962
  375   2HG2  THR  44          HG22      THR  44   5.524  -1.809  10.749
  376   3HG2  THR  44          HG23      THR  44   6.098  -0.174  11.068
  377    H    ARG  45           HN       ARG  45   5.121   0.954   8.219
  378    HA   ARG  45           HA       ARG  45   6.997   3.207   8.697
  379   1HB   ARG  45          HB2       ARG  45   5.268   3.332   6.255
  380   2HB   ARG  45          HB1       ARG  45   6.774   4.173   6.589
  381   1HG   ARG  45          HG2       ARG  45   7.406   2.564   5.000
  382   2HG   ARG  45          HG1       ARG  45   7.839   1.796   6.524
  383   1HD   ARG  45          HD2       ARG  45   6.647   0.065   5.586
  384   2HD   ARG  45          HD1       ARG  45   5.322   0.917   6.365
  385    HE   ARG  45           HE       ARG  45   5.905   1.698   3.585
  386   1HH1  ARG  45          HH11      ARG  45   3.413   1.653   5.624
  387   2HH1  ARG  45          HH12      ARG  45   2.341   0.677   4.677
  388   1HH2  ARG  45          HH21      ARG  45   4.786  -0.311   2.440
  389   2HH2  ARG  45          HH22      ARG  45   3.117  -0.434   2.871
  390    H    LEU  46           HN       LEU  46   5.928   5.315   8.685
  391    HA   LEU  46           HA       LEU  46   3.173   5.136   9.839
  392   1HB   LEU  46          HB2       LEU  46   4.892   7.631   9.652
  393   2HB   LEU  46          HB1       LEU  46   3.550   7.319  10.749
  394    HG   LEU  46           HG       LEU  46   5.368   5.252  11.272
  395   1HD1  LEU  46          HD11      LEU  46   6.908   7.840  11.353
  396   2HD1  LEU  46          HD12      LEU  46   6.952   6.820   9.915
  397   3HD1  LEU  46          HD13      LEU  46   7.516   6.189  11.462
  398   1HD2  LEU  46          HD21      LEU  46   4.063   6.311  12.993
  399   2HD2  LEU  46          HD22      LEU  46   4.790   7.883  12.660
  400   3HD2  LEU  46          HD23      LEU  46   5.757   6.602  13.392
  401    H    GLY  47           HN       GLY  47   1.507   5.665   8.429
  402   1HA   GLY  47          HA2       GLY  47   2.283   6.608   5.740
  403   2HA   GLY  47          HA1       GLY  47   0.728   5.915   6.178
  404    H    ARG  48           HN       ARG  48   1.883   8.556   4.950
  405    HA   ARG  48           HA       ARG  48   0.311  10.438   6.611
  406   1HB   ARG  48          HB2       ARG  48   1.456  12.207   5.170
  407   2HB   ARG  48          HB1       ARG  48   2.474  11.338   6.312
  408   1HG   ARG  48          HG2       ARG  48   3.718  10.415   4.661
  409   2HG   ARG  48          HG1       ARG  48   2.292   9.989   3.718
  410   1HD   ARG  48          HD2       ARG  48   3.757  11.634   2.547
  411   2HD   ARG  48          HD1       ARG  48   2.134  12.255   2.841
  412    HE   ARG  48           HE       ARG  48   3.869  12.997   5.013
  413   1HH1  ARG  48          HH21      ARG  48   2.159  14.169   2.376
  414   2HH1  ARG  48          HH22      ARG  48   3.135  15.578   2.141
  415   1HH2  ARG  48          HH11      ARG  48   5.570  14.611   4.419
  416   2HH2  ARG  48          HH12      ARG  48   5.066  15.829   3.295
  417    H    ILE  49           HN       ILE  49  -1.518  11.343   5.849
  418    HA   ILE  49           HA       ILE  49  -2.233  10.822   2.993
  419    HB   ILE  49           HB       ILE  49  -3.565  10.006   5.419
  420   1HG1  ILE  49          HG12      ILE  49  -4.634   9.753   2.609
  421   2HG1  ILE  49          HG11      ILE  49  -3.211   8.858   3.132
  422   1HG2  ILE  49          HG21      ILE  49  -5.824  10.834   5.001
  423   2HG2  ILE  49          HG22      ILE  49  -5.256  11.771   3.620
  424   3HG2  ILE  49          HG23      ILE  49  -4.737  12.201   5.250
  425   1HD1  ILE  49          HD11      ILE  49  -4.932   7.348   3.608
  426   2HD1  ILE  49          HD12      ILE  49  -6.046   8.623   4.099
  427   3HD1  ILE  49          HD13      ILE  49  -4.716   8.158   5.160
  428    HA   PRO  50           HA       PRO  50  -2.850  15.186   2.757
  429   1HB   PRO  50          HB2       PRO  50  -4.561  15.255   0.596
  430   2HB   PRO  50          HB1       PRO  50  -2.820  14.957   0.464
  431   1HG   PRO  50          HG2       PRO  50  -5.078  13.022   0.222
  432   2HG   PRO  50          HG1       PRO  50  -3.458  12.952  -0.493
  433   1HD   PRO  50          HD2       PRO  50  -4.328  11.506   1.775
  434   2HD   PRO  50          HD1       PRO  50  -2.641  11.716   1.256
  435    H    GLY  51           HN       GLY  51  -6.064  14.276   1.562
  436   1HA   GLY  51          HA2       GLY  51  -7.282  15.123   4.147
  437   2HA   GLY  51          HA1       GLY  51  -7.790  15.916   2.658
  438    H    ARG  52           HN       ARG  52  -7.047  12.661   2.036
  439    HA   ARG  52           HA       ARG  52  -9.767  11.981   1.414
  440   1HB   ARG  52          HB2       ARG  52  -7.296  10.251   1.734
  441   2HB   ARG  52          HB1       ARG  52  -8.840   9.662   1.118
  442   1HG   ARG  52          HG2       ARG  52  -8.486  11.873  -0.441
  443   2HG   ARG  52          HG1       ARG  52  -6.812  11.371  -0.195
  444   1HD   ARG  52          HD2       ARG  52  -7.426   9.070  -0.924
  445   2HD   ARG  52          HD1       ARG  52  -9.066   9.634  -1.244
  446    HE   ARG  52           HE       ARG  52  -6.844  11.018  -2.643
  447   1HH1  ARG  52          HH11      ARG  52  -9.602  11.449  -3.563
  448   2HH1  ARG  52          HH12      ARG  52  -9.765  10.325  -4.872
  449   1HH2  ARG  52          HH21      ARG  52  -7.005   8.431  -3.938
  450   2HH2  ARG  52          HH22      ARG  52  -8.290   8.613  -5.084
  451    H    LEU  53           HN       LEU  53  -7.598  10.805   4.020
  452    HA   LEU  53           HA       LEU  53  -9.583   9.252   5.362
  453   1HB   LEU  53          HB2       LEU  53  -7.165   8.947   5.682
  454   2HB   LEU  53          HB1       LEU  53  -7.051  10.548   6.405
  455    HG   LEU  53           HG       LEU  53  -9.010   9.463   7.943
  456   1HD1  LEU  53          HD11      LEU  53  -7.215   7.232   6.974
  457   2HD1  LEU  53          HD12      LEU  53  -8.977   7.267   7.024
  458   3HD1  LEU  53          HD13      LEU  53  -8.056   7.150   8.523
  459   1HD2  LEU  53          HD21      LEU  53  -6.018   9.151   8.325
  460   2HD2  LEU  53          HD22      LEU  53  -7.226   9.134   9.610
  461   3HD2  LEU  53          HD23      LEU  53  -6.945  10.608   8.684
  462    H    LYS  54           HN       LYS  54  -8.464  12.615   5.846
  463    HA   LYS  54           HA       LYS  54  -9.993  13.150   8.197
  464   1HB   LYS  54          HB2       LYS  54  -8.597  14.762   6.134
  465   2HB   LYS  54          HB1       LYS  54  -9.854  15.598   7.046
  466   1HG   LYS  54          HG2       LYS  54  -7.947  13.909   8.598
  467   2HG   LYS  54          HG1       LYS  54  -7.331  15.424   7.942
  468   1HD   LYS  54          HD2       LYS  54  -8.254  16.448   9.728
  469   2HD   LYS  54          HD1       LYS  54  -9.824  16.108   9.001
  470   1HE   LYS  54          HE2       LYS  54 -10.102  15.088  11.065
  471   2HE   LYS  54          HE1       LYS  54  -9.464  13.734  10.132
  472   1HZ   LYS  54          HZ1       LYS  54  -7.258  14.240  10.947
  473   2HZ   LYS  54          HZ2       LYS  54  -8.318  14.002  12.252
  474   3HZ   LYS  54          HZ3       LYS  54  -7.845  15.573  11.813
  475    H    ASN  55           HN       ASN  55 -10.963  13.053   4.815
  476    HA   ASN  55           HA       ASN  55 -13.572  14.319   5.485
  477   1HB   ASN  55          HB2       ASN  55 -12.116  13.719   2.924
  478   2HB   ASN  55          HB1       ASN  55 -13.860  13.979   2.901
  479   1HD2  ASN  55          HD21      ASN  55 -14.640  16.137   3.220
  480   2HD2  ASN  55          HD22      ASN  55 -13.609  17.472   3.407
  481    H    ARG  56           HN       ARG  56 -12.217  11.251   4.291
  482    HA   ARG  56           HA       ARG  56 -14.899  10.042   4.089
  483   1HB   ARG  56          HB2       ARG  56 -12.098   9.087   3.525
  484   2HB   ARG  56          HB1       ARG  56 -13.460   7.968   3.542
  485   1HG   ARG  56          HG2       ARG  56 -13.685  10.506   1.963
  486   2HG   ARG  56          HG1       ARG  56 -12.755   9.165   1.295
  487   1HD   ARG  56          HD2       ARG  56 -15.555   8.780   2.367
  488   2HD   ARG  56          HD1       ARG  56 -15.256   9.251   0.694
  489    HE   ARG  56           HE       ARG  56 -13.992   7.110   0.435
  490   1HH1  ARG  56          HH21      ARG  56 -16.904   6.519   1.110
  491   2HH1  ARG  56          HH22      ARG  56 -16.728   5.292   2.319
  492   1HH2  ARG  56          HH11      ARG  56 -13.368   5.964   2.894
  493   2HH2  ARG  56          HH12      ARG  56 -14.722   4.976   3.332
  494    H    ILE  57           HN       ILE  57 -12.616  10.464   6.582
  495    HA   ILE  57           HA       ILE  57 -12.579   8.071   8.011
  496    HB   ILE  57           HB       ILE  57 -11.353   9.965   8.842
  497   1HG1  ILE  57          HG12      ILE  57 -12.224  10.052  11.250
  498   2HG1  ILE  57          HG11      ILE  57 -13.535   9.009  10.703
  499   1HG2  ILE  57          HG21      ILE  57 -12.960  11.716   8.103
  500   2HG2  ILE  57          HG22      ILE  57 -12.449  11.948   9.774
  501   3HG2  ILE  57          HG23      ILE  57 -14.034  11.259   9.424
  502   1HD1  ILE  57          HD11      ILE  57 -11.948   7.307   9.990
  503   2HD1  ILE  57          HD12      ILE  57 -11.607   7.734  11.666
  504   3HD1  ILE  57          HD13      ILE  57 -10.590   8.365  10.369
  505    H    TRP  58           HN       TRP  58 -13.989   6.895   9.161
  506    HA   TRP  58           HA       TRP  58 -16.411   7.827  10.371
  507   1HB   TRP  58          HB2       TRP  58 -16.596   7.341   7.543
  508   2HB   TRP  58          HB1       TRP  58 -17.531   6.109   8.388
  509    HD1  TRP  58           HD1      TRP  58 -19.125   7.246  10.483
  510    HE1  TRP  58           HE1      TRP  58 -20.659   9.306  10.281
  511    HE3  TRP  58           HE3      TRP  58 -17.093   9.458   6.351
  512    HZ2  TRP  58           HZ2      TRP  58 -20.984  11.590   8.590
  513    HZ3  TRP  58           HZ3      TRP  58 -18.035  11.572   5.467
  514    HH2  TRP  58           HH2      TRP  58 -19.976  12.641   6.581
  515    H    VAL  59           HN       VAL  59 -14.929   5.028   8.714
  516    HA   VAL  59           HA       VAL  59 -16.170   3.041  10.402
  517    HB   VAL  59           HB       VAL  59 -14.484   1.494   9.447
  518   1HG1  VAL  59          HG11      VAL  59 -15.525   3.376   7.315
  519   2HG1  VAL  59          HG12      VAL  59 -16.548   2.223   8.172
  520   3HG1  VAL  59          HG13      VAL  59 -15.220   1.645   7.165
  521   1HG2  VAL  59          HG21      VAL  59 -12.776   2.313   7.916
  522   2HG2  VAL  59          HG22      VAL  59 -12.599   3.154   9.455
  523   3HG2  VAL  59          HG23      VAL  59 -13.362   3.967   8.089
  524    H    ARG  60           HN       ARG  60 -14.637   1.484  11.703
  525    HA   ARG  60           HA       ARG  60 -13.501   3.024  13.880
  526   1HB   ARG  60          HB2       ARG  60 -13.969   0.158  13.266
  527   2HB   ARG  60          HB1       ARG  60 -12.630   0.492  14.363
  528   1HG   ARG  60          HG2       ARG  60 -14.258   2.004  15.645
  529   2HG   ARG  60          HG1       ARG  60 -15.537   1.249  14.693
  530   1HD   ARG  60          HD2       ARG  60 -14.740  -0.987  15.478
  531   2HD   ARG  60          HD1       ARG  60 -13.572  -0.169  16.516
  532    HE   ARG  60           HE       ARG  60 -16.468  -0.333  16.972
  533   1HH1  ARG  60          HH11      ARG  60 -14.452  -0.706  19.137
  534   2HH1  ARG  60          HH12      ARG  60 -14.538   0.798  19.992
  535   1HH2  ARG  60          HH21      ARG  60 -16.174   2.470  17.422
  536   2HH2  ARG  60          HH22      ARG  60 -15.515   2.600  19.018
  537    H    GLU  61           HN       GLU  61 -11.820   0.373  12.157
  538    HA   GLU  61           HA       GLU  61  -9.647   2.029  11.220
  539   1HB   GLU  61          HB2       GLU  61  -7.906   0.985  12.768
  540   2HB   GLU  61          HB1       GLU  61  -8.950   2.200  13.501
  541   1HG   GLU  61          HG2       GLU  61 -10.292  -0.286  13.781
  542   2HG   GLU  61          HG1       GLU  61  -8.613  -0.566  14.241
  543    H    GLY  62           HN       GLY  62  -7.703   0.508  10.586
  544   1HA   GLY  62          HA2       GLY  62  -6.940  -1.591   9.725
  545   2HA   GLY  62          HA1       GLY  62  -8.534  -2.276  10.039
  546    H    ASP  63           HN       ASP  63  -6.857   0.051   7.912
  547    HA   ASP  63           HA       ASP  63  -8.887  -0.598   5.786
  548   1HB   ASP  63          HB2       ASP  63  -8.093   1.912   6.839
  549   2HB   ASP  63          HB1       ASP  63  -7.391   1.804   5.225
  550    H    VAL  64           HN       VAL  64  -7.976  -0.578   3.503
  551    HA   VAL  64           HA       VAL  64  -5.172  -1.612   3.592
  552    HB   VAL  64           HB       VAL  64  -6.612  -3.176   2.508
  553   1HG1  VAL  64          HG11      VAL  64  -8.531  -1.803   1.985
  554   2HG1  VAL  64          HG12      VAL  64  -7.945  -2.500   0.476
  555   3HG1  VAL  64          HG13      VAL  64  -7.582  -0.822   0.868
  556   1HG2  VAL  64          HG21      VAL  64  -4.368  -2.340   1.384
  557   2HG2  VAL  64          HG22      VAL  64  -5.465  -1.794   0.115
  558   3HG2  VAL  64          HG23      VAL  64  -5.407  -3.499   0.557
  559    H    VAL  65           HN       VAL  65  -3.542  -0.507   2.647
  560    HA   VAL  65           HA       VAL  65  -4.234   1.805   0.894
  561    HB   VAL  65           HB       VAL  65  -2.611   3.225   2.134
  562   1HG1  VAL  65          HG11      VAL  65  -5.161   2.275   3.165
  563   2HG1  VAL  65          HG12      VAL  65  -4.503   3.910   3.126
  564   3HG1  VAL  65          HG13      VAL  65  -4.099   2.832   4.455
  565   1HG2  VAL  65          HG21      VAL  65  -1.789   2.492   4.327
  566   2HG2  VAL  65          HG22      VAL  65  -1.243   1.381   3.072
  567   3HG2  VAL  65          HG23      VAL  65  -2.587   0.935   4.123
  568    H    ILE  66           HN       ILE  66  -2.598   2.455  -0.531
  569    HA   ILE  66           HA       ILE  66  -0.365   0.471  -0.853
  570    HB   ILE  66           HB       ILE  66  -0.145   1.206  -3.139
  571   1HG1  ILE  66          HG12      ILE  66  -2.110   3.072  -3.675
  572   2HG1  ILE  66          HG11      ILE  66  -1.500   3.597  -2.106
  573   1HG2  ILE  66          HG21      ILE  66  -2.304   0.670  -4.069
  574   2HG2  ILE  66          HG22      ILE  66  -3.122   1.162  -2.586
  575   3HG2  ILE  66          HG23      ILE  66  -2.107  -0.281  -2.596
  576   1HD1  ILE  66          HD11      ILE  66   0.141   3.103  -4.606
  577   2HD1  ILE  66          HD12      ILE  66   0.825   3.477  -3.024
  578   3HD1  ILE  66          HD13      ILE  66  -0.184   4.664  -3.852
  579    H    VAL  67           HN       VAL  67   1.839   1.312  -0.684
  580    HA   VAL  67           HA       VAL  67   1.922   4.224  -0.055
  581    HB   VAL  67           HB       VAL  67   2.393   3.953   2.113
  582   1HG1  VAL  67          HG11      VAL  67   1.725   1.871   3.168
  583   2HG1  VAL  67          HG12      VAL  67   1.925   0.995   1.652
  584   3HG1  VAL  67          HG13      VAL  67   0.638   2.188   1.817
  585   1HG2  VAL  67          HG21      VAL  67   4.220   1.628   1.468
  586   2HG2  VAL  67          HG22      VAL  67   4.194   2.582   2.948
  587   3HG2  VAL  67          HG23      VAL  67   4.728   3.315   1.443
  588    H    LYS  68           HN       LYS  68   3.915   5.234  -0.005
  589    HA   LYS  68           HA       LYS  68   5.988   4.003  -1.699
  590   1HB   LYS  68          HB2       LYS  68   6.545   6.091  -2.525
  591   2HB   LYS  68          HB1       LYS  68   4.837   6.338  -2.184
  592   1HG   LYS  68          HG2       LYS  68   5.298   7.508  -0.170
  593   2HG   LYS  68          HG1       LYS  68   6.966   6.946  -0.130
  594   1HD   LYS  68          HD2       LYS  68   7.061   9.210  -0.887
  595   2HD   LYS  68          HD1       LYS  68   7.314   8.209  -2.317
  596   1HE   LYS  68          HE2       LYS  68   4.687   8.379  -2.528
  597   2HE   LYS  68          HE1       LYS  68   4.906   9.819  -1.534
  598   1HZ   LYS  68          HZ1       LYS  68   6.414  10.714  -3.141
  599   2HZ   LYS  68          HZ2       LYS  68   4.984  10.266  -3.940
  600   3HZ   LYS  68          HZ3       LYS  68   6.368   9.290  -4.063
  601    HA   PRO  69           HA       PRO  69   8.619   3.839   1.834
  602   1HB   PRO  69          HB2       PRO  69  11.014   3.513   0.566
  603   2HB   PRO  69          HB1       PRO  69   9.771   2.251   0.626
  604   1HG   PRO  69          HG2       PRO  69  10.612   3.929  -1.676
  605   2HG   PRO  69          HG1       PRO  69   9.777   2.367  -1.676
  606   1HD   PRO  69          HD2       PRO  69   8.602   4.969  -2.056
  607   2HD   PRO  69          HD1       PRO  69   7.761   3.406  -1.973
  608    H    TRP  70           HN       TRP  70   9.878   5.125   3.113
  609    HA   TRP  70           HA       TRP  70  10.934   7.689   1.992
  610   1HB   TRP  70          HB2       TRP  70   9.639   7.133   4.650
  611   2HB   TRP  70          HB1       TRP  70  10.635   8.552   4.379
  612    HD1  TRP  70           HD1      TRP  70   8.264   6.864   2.009
  613    HE1  TRP  70           HE1      TRP  70   6.536   8.510   1.385
  614    HE3  TRP  70           HE3      TRP  70   9.596  10.761   4.996
  615    HZ2  TRP  70           HZ2      TRP  70   5.704  11.127   2.004
  616    HZ3  TRP  70           HZ3      TRP  70   8.277  12.864   4.949
  617    HH2  TRP  70           HH2      TRP  70   6.317  13.060   3.442
  618    H    GLU  71           HN       GLU  71  13.268   7.586   2.244
  619    HA   GLU  71           HA       GLU  71  14.498   5.602   3.966
  620   1HB   GLU  71          HB2       GLU  71  16.631   6.928   3.487
  621   2HB   GLU  71          HB1       GLU  71  15.807   6.234   2.096
  622   1HG   GLU  71          HG2       GLU  71  15.382   8.274   1.205
  623   2HG   GLU  71          HG1       GLU  71  14.827   8.916   2.751
  624    H    VAL  72           HN       VAL  72  15.074   5.757   6.051
  625    HA   VAL  72           HA       VAL  72  15.872   8.082   7.460
  626    HB   VAL  72           HB       VAL  72  13.683   9.011   7.281
  627   1HG1  VAL  72          HG11      VAL  72  12.872   6.219   7.305
  628   2HG1  VAL  72          HG12      VAL  72  11.997   7.631   6.712
  629   3HG1  VAL  72          HG13      VAL  72  11.890   7.179   8.413
  630   1HG2  VAL  72          HG21      VAL  72  13.027   9.226   9.545
  631   2HG2  VAL  72          HG22      VAL  72  14.740   8.813   9.635
  632   3HG2  VAL  72          HG23      VAL  72  13.518   7.576   9.935
  633    H    GLN  73           HN       GLN  73  17.302   6.841   8.585
  634    HA   GLN  73           HA       GLN  73  17.011   4.217   9.523
  635   1HB   GLN  73          HB2       GLN  73  18.778   4.800  11.204
  636   2HB   GLN  73          HB1       GLN  73  19.171   5.299   9.562
  637   1HG   GLN  73          HG2       GLN  73  17.850   7.517  10.492
  638   2HG   GLN  73          HG1       GLN  73  18.652   6.949  11.956
  639   1HE2  GLN  73          HE21      GLN  73  19.170   8.444   8.836
  640   2HE2  GLN  73          HE22      GLN  73  20.855   8.609   8.974
  641    H    GLY  74           HN       GLY  74  16.203   3.260  11.362
  642   1HA   GLY  74          HA2       GLY  74  15.409   3.368  13.690
  643   2HA   GLY  74          HA1       GLY  74  14.844   5.008  13.371
  644    H    ASP  75           HN       ASP  75  13.481   4.694  10.982
  645    HA   ASP  75           HA       ASP  75  11.667   2.424  11.003
  646   1HB   ASP  75          HB2       ASP  75  10.798   3.713  12.970
  647   2HB   ASP  75          HB1       ASP  75  10.524   5.091  11.907
  648    H    GLN  76           HN       GLN  76  10.109   2.605   9.161
  649    HA   GLN  76           HA       GLN  76  11.236   4.453   7.126
  650   1HB   GLN  76          HB2       GLN  76   9.406   2.060   6.962
  651   2HB   GLN  76          HB1       GLN  76   9.739   3.087   5.572
  652   1HG   GLN  76          HG2       GLN  76  11.939   1.831   7.227
  653   2HG   GLN  76          HG1       GLN  76  11.234   1.027   5.824
  654   1HE2  GLN  76          HE21      GLN  76  13.485   3.480   6.831
  655   2HE2  GLN  76          HE22      GLN  76  13.905   4.023   5.279
  656    H    LYS  77           HN       LYS  77   9.958   5.909   5.927
  657    HA   LYS  77           HA       LYS  77   7.314   6.588   7.212
  658   1HB   LYS  77          HB2       LYS  77   9.514   8.254   6.172
  659   2HB   LYS  77          HB1       LYS  77   7.906   8.750   5.642
  660   1HG   LYS  77          HG2       LYS  77   7.131   8.916   7.926
  661   2HG   LYS  77          HG1       LYS  77   8.633   8.216   8.533
  662   1HD   LYS  77          HD2       LYS  77   9.805  10.201   7.360
  663   2HD   LYS  77          HD1       LYS  77   8.201  10.932   7.290
  664   1HE   LYS  77          HE2       LYS  77   9.322   9.843   9.873
  665   2HE   LYS  77          HE1       LYS  77   9.664  11.491   9.345
  666   1HZ   LYS  77          HZ1       LYS  77   7.734  11.420  10.784
  667   2HZ   LYS  77          HZ2       LYS  77   6.964  10.316   9.749
  668   3HZ   LYS  77          HZ3       LYS  77   7.282  11.901   9.222
  669    H    CYS  78           HN       CYS  78   5.505   7.007   5.693
  670    HA   CYS  78           HA       CYS  78   6.168   6.209   2.914
  671   1HB   CYS  78          HB2       CYS  78   4.325   4.555   2.880
  672   2HB   CYS  78          HB1       CYS  78   5.619   4.104   3.986
  673    HG   CYS  78           HG       CYS  78   3.573   3.839   5.461
  674    H    ASP  79           HN       ASP  79   4.565   6.682   1.328
  675    HA   ASP  79           HA       ASP  79   2.652   8.837   2.315
  676   1HB   ASP  79          HB2       ASP  79   4.305   9.157   0.251
  677   2HB   ASP  79          HB1       ASP  79   3.117   8.176  -0.608
  678    H    ILE  80           HN       ILE  80   0.642   7.995   2.691
  679    HA   ILE  80           HA       ILE  80   0.023   5.465   1.234
  680    HB   ILE  80           HB       ILE  80   0.081   6.134   4.026
  681   1HG1  ILE  80          HG12      ILE  80  -0.833   3.512   2.891
  682   2HG1  ILE  80          HG11      ILE  80   0.813   4.065   2.613
  683   1HG2  ILE  80          HG21      ILE  80  -2.082   5.093   4.694
  684   2HG2  ILE  80          HG22      ILE  80  -2.597   5.137   3.009
  685   3HG2  ILE  80          HG23      ILE  80  -2.302   6.642   3.881
  686   1HD1  ILE  80          HD11      ILE  80   1.430   3.711   4.769
  687   2HD1  ILE  80          HD12      ILE  80   0.005   2.675   4.834
  688   3HD1  ILE  80          HD13      ILE  80  -0.089   4.342   5.402
  689    H    ILE  81           HN       ILE  81  -1.987   5.023   0.491
  690    HA   ILE  81           HA       ILE  81  -4.060   7.177   0.634
  691    HB   ILE  81           HB       ILE  81  -4.784   6.457  -1.687
  692   1HG1  ILE  81          HG12      ILE  81  -2.067   5.453  -2.285
  693   2HG1  ILE  81          HG11      ILE  81  -3.068   4.360  -1.330
  694   1HG2  ILE  81          HG21      ILE  81  -3.068   7.793  -2.833
  695   2HG2  ILE  81          HG22      ILE  81  -1.985   7.603  -1.454
  696   3HG2  ILE  81          HG23      ILE  81  -3.479   8.522  -1.281
  697   1HD1  ILE  81          HD11      ILE  81  -3.187   4.787  -4.123
  698   2HD1  ILE  81          HD12      ILE  81  -4.646   5.516  -3.452
  699   3HD1  ILE  81          HD13      ILE  81  -4.286   3.818  -3.142
  700    H    TRP  82           HN       TRP  82  -5.784   6.342   1.697
  701    HA   TRP  82           HA       TRP  82  -5.944   3.406   1.991
  702   1HB   TRP  82          HB2       TRP  82  -7.100   3.758   4.003
  703   2HB   TRP  82          HB1       TRP  82  -5.921   5.061   3.955
  704    HD1  TRP  82           HD1      TRP  82  -7.457   7.048   2.005
  705    HE1  TRP  82           HE1      TRP  82  -9.561   8.270   2.843
  706    HE3  TRP  82           HE3      TRP  82  -8.788   3.978   5.864
  707    HZ2  TRP  82           HZ2      TRP  82 -11.546   7.988   4.879
  708    HZ3  TRP  82           HZ3      TRP  82 -10.791   4.480   7.234
  709    HH2  TRP  82           HH2      TRP  82 -12.171   6.481   6.746
  710    H    ARG  83           HN       ARG  83  -7.940   2.283   1.990
  711    HA   ARG  83           HA       ARG  83 -10.392   3.304   0.923
  712   1HB   ARG  83          HB2       ARG  83  -8.587   3.250  -1.064
  713   2HB   ARG  83          HB1       ARG  83  -9.070   1.556  -1.116
  714   1HG   ARG  83          HG2       ARG  83 -10.502   2.769  -2.633
  715   2HG   ARG  83          HG1       ARG  83 -11.470   2.328  -1.229
  716   1HD   ARG  83          HD2       ARG  83 -11.299   4.543  -0.313
  717   2HD   ARG  83          HD1       ARG  83 -10.083   5.005  -1.502
  718    HE   ARG  83           HE       ARG  83 -11.864   5.542  -2.933
  719   1HH1  ARG  83          HH11      ARG  83 -13.665   5.122  -0.407
  720   2HH1  ARG  83          HH12      ARG  83 -14.906   4.128  -1.093
  721   1HH2  ARG  83          HH21      ARG  83 -13.089   3.372  -3.957
  722   2HH2  ARG  83          HH22      ARG  83 -14.580   3.135  -3.108
  723    H    TYR  84           HN       TYR  84 -11.916   1.482   0.442
  724    HA   TYR  84           HA       TYR  84 -12.956  -0.482   1.197
  725   1HB   TYR  84          HB2       TYR  84 -10.320  -1.854   0.706
  726   2HB   TYR  84          HB1       TYR  84 -11.947  -2.446   0.384
  727    HD1  TYR  84           HD1      TYR  84 -13.341  -0.734  -1.244
  728    HD2  TYR  84           HD2      TYR  84  -9.076  -1.249  -1.160
  729    HE1  TYR  84           HE1      TYR  84 -13.191   0.133  -3.562
  730    HE2  TYR  84           HE2      TYR  84  -8.927  -0.382  -3.480
  731    HH   TYR  84           HH       TYR  84 -10.849   1.365  -4.914
  732    H    THR  85           HN       THR  85 -11.456  -2.784   2.406
  733    HA   THR  85           HA       THR  85 -10.456  -1.671   4.958
  734    HB   THR  85           HB       THR  85 -12.012  -3.376   6.161
  735    HG1  THR  85           HG1      THR  85 -13.594  -2.884   3.867
  736   1HG2  THR  85          HG21      THR  85 -12.136  -0.843   6.225
  737   2HG2  THR  85          HG22      THR  85 -13.664  -1.677   6.511
  738   3HG2  THR  85          HG23      THR  85 -13.338  -0.948   4.938
  739    H    LYS  86           HN       LYS  86  -8.486  -2.639   4.835
  740    HA   LYS  86           HA       LYS  86  -6.850  -4.284   4.440
  741   1HB   LYS  86          HB2       LYS  86  -7.172  -6.260   5.950
  742   2HB   LYS  86          HB1       LYS  86  -7.432  -4.713   6.752
  743   1HG   LYS  86          HG2       LYS  86  -9.856  -4.968   6.527
  744   2HG   LYS  86          HG1       LYS  86  -9.637  -6.474   5.634
  745   1HD   LYS  86          HD2       LYS  86  -8.464  -7.429   7.627
  746   2HD   LYS  86          HD1       LYS  86  -8.848  -5.953   8.514
  747   1HE   LYS  86          HE2       LYS  86 -11.005  -7.570   7.156
  748   2HE   LYS  86          HE1       LYS  86 -10.461  -7.955   8.788
  749   1HZ   LYS  86          HZ1       LYS  86 -10.948  -5.641   9.414
  750   2HZ   LYS  86          HZ2       LYS  86 -12.331  -6.481   8.895
  751   3HZ   LYS  86          HZ3       LYS  86 -11.576  -5.362   7.863
  752    H    THR  87           HN       THR  87  -8.445  -4.215   2.193
  753    HA   THR  87           HA       THR  87  -8.432  -7.076   1.378
  754    HB   THR  87           HB       THR  87 -10.584  -6.483   0.021
  755    HG1  THR  87           HG1      THR  87 -10.843  -4.366   0.424
  756   1HG2  THR  87          HG21      THR  87 -10.536  -8.133   1.828
  757   2HG2  THR  87          HG22      THR  87 -12.003  -7.160   1.941
  758   3HG2  THR  87          HG23      THR  87 -10.651  -6.848   3.029
  759    H    GLN  88           HN       GLN  88  -6.389  -6.255   0.409
  760    HA   GLN  88           HA       GLN  88  -6.598  -5.762  -2.375
  761   1HB   GLN  88          HB2       GLN  88  -6.960  -3.389  -0.835
  762   2HB   GLN  88          HB1       GLN  88  -5.379  -3.280  -1.609
  763   1HG   GLN  88          HG2       GLN  88  -7.860  -4.096  -3.135
  764   2HG   GLN  88          HG1       GLN  88  -7.375  -2.409  -2.966
  765   1HE2  GLN  88          HE21      GLN  88  -6.859  -5.267  -4.807
  766   2HE2  GLN  88          HE22      GLN  88  -5.497  -4.736  -5.668
  767    H    VAL  89           HN       VAL  89  -4.628  -5.304   0.551
  768    HA   VAL  89           HA       VAL  89  -2.065  -5.112  -0.605
  769    HB   VAL  89           HB       VAL  89  -1.257  -6.261   1.522
  770   1HG1  VAL  89          HG11      VAL  89  -1.775  -3.753   1.161
  771   2HG1  VAL  89          HG12      VAL  89  -1.651  -4.330   2.822
  772   3HG1  VAL  89          HG13      VAL  89  -3.236  -4.059   2.099
  773   1HG2  VAL  89          HG21      VAL  89  -2.890  -6.730   3.254
  774   2HG2  VAL  89          HG22      VAL  89  -3.350  -7.635   1.813
  775   3HG2  VAL  89          HG23      VAL  89  -4.206  -6.151   2.232
  776    H    GLU  90           HN       GLU  90  -4.078  -7.999  -0.119
  777    HA   GLU  90           HA       GLU  90  -2.136 -10.004  -0.634
  778   1HB   GLU  90          HB2       GLU  90  -4.721 -10.149  -0.036
  779   2HB   GLU  90          HB1       GLU  90  -4.893 -10.279  -1.786
  780   1HG   GLU  90          HG2       GLU  90  -4.439 -12.479  -1.546
  781   2HG   GLU  90          HG1       GLU  90  -2.778 -12.000  -1.196
  782    H    TRP  91           HN       TRP  91  -4.107  -8.070  -2.890
  783    HA   TRP  91           HA       TRP  91  -3.175  -9.312  -5.306
  784   1HB   TRP  91          HB2       TRP  91  -5.166  -7.963  -5.399
  785   2HB   TRP  91          HB1       TRP  91  -4.320  -6.572  -4.730
  786    HD1  TRP  91           HD1      TRP  91  -4.324  -8.777  -7.894
  787    HE1  TRP  91           HE1      TRP  91  -3.500  -7.349  -9.876
  788    HE3  TRP  91           HE3      TRP  91  -3.125  -4.462  -5.437
  789    HZ2  TRP  91           HZ2      TRP  91  -2.469  -4.724 -10.356
  790    HZ3  TRP  91           HZ3      TRP  91  -2.225  -2.517  -6.680
  791    HH2  TRP  91           HH2      TRP  91  -1.895  -2.642  -9.134
  792    H    LEU  92           HN       LEU  92  -2.049  -6.481  -3.451
  793    HA   LEU  92           HA       LEU  92   0.011  -5.640  -5.230
  794   1HB   LEU  92          HB2       LEU  92  -0.481  -5.333  -2.281
  795   2HB   LEU  92          HB1       LEU  92   1.075  -4.841  -2.950
  796    HG   LEU  92           HG       LEU  92  -0.700  -3.747  -4.754
  797   1HD1  LEU  92          HD11      LEU  92  -1.896  -3.665  -1.974
  798   2HD1  LEU  92          HD12      LEU  92  -2.664  -4.225  -3.459
  799   3HD1  LEU  92          HD13      LEU  92  -2.321  -2.510  -3.237
  800   1HD2  LEU  92          HD21      LEU  92  -0.059  -1.625  -3.772
  801   2HD2  LEU  92          HD22      LEU  92   1.317  -2.719  -3.640
  802   3HD2  LEU  92          HD23      LEU  92   0.307  -2.398  -2.230
  803    H    LYS  93           HN       LYS  93  -0.045  -8.163  -2.738
  804    HA   LYS  93           HA       LYS  93   2.768  -8.698  -2.660
  805   1HB   LYS  93          HB2       LYS  93   0.290 -10.036  -1.785
  806   2HB   LYS  93          HB1       LYS  93   1.605 -11.143  -2.174
  807   1HG   LYS  93          HG2       LYS  93   3.099  -9.672  -0.720
  808   2HG   LYS  93          HG1       LYS  93   1.623  -8.881  -0.168
  809   1HD   LYS  93          HD2       LYS  93   1.155 -10.583   1.229
  810   2HD   LYS  93          HD1       LYS  93   1.318 -11.760  -0.075
  811   1HE   LYS  93          HE2       LYS  93   3.905 -11.305   0.268
  812   2HE   LYS  93          HE1       LYS  93   3.382 -10.790   1.871
  813   1HZ   LYS  93          HZ1       LYS  93   2.243 -12.926   2.123
  814   2HZ   LYS  93          HZ2       LYS  93   3.913 -13.127   1.877
  815   3HZ   LYS  93          HZ3       LYS  93   2.824 -13.420   0.607
  816    H    ARG  94           HN       ARG  94   0.167 -10.430  -4.441
  817    HA   ARG  94           HA       ARG  94   1.898 -12.099  -5.974
  818   1HB   ARG  94          HB2       ARG  94  -0.804 -11.896  -5.719
  819   2HB   ARG  94          HB1       ARG  94  -0.579 -11.170  -7.310
  820   1HG   ARG  94          HG2       ARG  94   0.084 -13.135  -8.261
  821   2HG   ARG  94          HG1       ARG  94   0.964 -13.651  -6.822
  822   1HD   ARG  94          HD2       ARG  94  -0.757 -14.968  -6.229
  823   2HD   ARG  94          HD1       ARG  94  -1.819 -13.562  -6.168
  824    HE   ARG  94           HE       ARG  94  -1.546 -14.284  -8.893
  825   1HH1  ARG  94          HH21      ARG  94  -1.669 -17.067  -7.975
  826   2HH1  ARG  94          HH22      ARG  94  -3.369 -17.363  -7.821
  827   1HH2  ARG  94          HH11      ARG  94  -4.223 -13.995  -7.812
  828   2HH2  ARG  94          HH12      ARG  94  -4.819 -15.619  -7.728
  829    H    LYS  95           HN       LYS  95   0.707  -8.821  -6.502
  830    HA   LYS  95           HA       LYS  95   1.667  -8.478  -9.181
  831   1HB   LYS  95          HB2       LYS  95   0.052  -6.994  -7.777
  832   2HB   LYS  95          HB1       LYS  95   1.524  -6.251  -7.151
  833   1HG   LYS  95          HG2       LYS  95   2.140  -6.139  -9.742
  834   2HG   LYS  95          HG1       LYS  95   0.384  -6.173  -9.914
  835   1HD   LYS  95          HD2       LYS  95   0.121  -4.203  -8.583
  836   2HD   LYS  95          HD1       LYS  95   1.798  -4.263  -8.042
  837   1HE   LYS  95          HE2       LYS  95   1.917  -2.644  -9.716
  838   2HE   LYS  95          HE1       LYS  95   2.333  -4.103 -10.614
  839   1HZ   LYS  95          HZ1       LYS  95  -0.107  -4.283 -11.129
  840   2HZ   LYS  95          HZ2       LYS  95   0.706  -2.990 -11.871
  841   3HZ   LYS  95          HZ3       LYS  95  -0.280  -2.711 -10.517
  842    H    GLY  96           HN       GLY  96   3.203  -8.151  -5.997
  843   1HA   GLY  96          HA2       GLY  96   5.572  -6.781  -6.856
  844   2HA   GLY  96          HA1       GLY  96   5.428  -7.751  -5.390
  845    H    TYR  97           HN       TYR  97   4.829 -10.255  -6.487
  846    HA   TYR  97           HA       TYR  97   7.449 -11.187  -7.249
  847   1HB   TYR  97          HB2       TYR  97   5.023 -12.836  -7.869
  848   2HB   TYR  97          HB1       TYR  97   6.571 -13.337  -7.203
  849    HD1  TYR  97           HD1      TYR  97   3.416 -13.530  -6.316
  850    HD2  TYR  97           HD2      TYR  97   6.917 -11.454  -4.941
  851    HE1  TYR  97           HE1      TYR  97   2.446 -13.397  -4.043
  852    HE2  TYR  97           HE2      TYR  97   5.945 -11.322  -2.666
  853    HH   TYR  97           HH       TYR  97   3.999 -12.975  -1.406
  854    H    LEU  98           HN       LEU  98   4.526 -10.434  -9.101
  855    HA   LEU  98           HA       LEU  98   5.256 -11.526 -11.599
  856   1HB   LEU  98          HB2       LEU  98   3.015 -10.577 -11.013
  857   2HB   LEU  98          HB1       LEU  98   3.710  -8.961 -11.093
  858    HG   LEU  98           HG       LEU  98   2.480  -9.831 -13.189
  859   1HD1  LEU  98          HD11      LEU  98   4.430  -7.997 -12.854
  860   2HD1  LEU  98          HD12      LEU  98   3.705  -8.348 -14.422
  861   3HD1  LEU  98          HD13      LEU  98   5.243  -9.085 -13.979
  862   1HD2  LEU  98          HD21      LEU  98   5.112 -11.205 -13.743
  863   2HD2  LEU  98          HD22      LEU  98   3.581 -11.371 -14.603
  864   3HD2  LEU  98          HD23      LEU  98   3.773 -12.080 -13.000
  865    H    ASP  99           HN       ASP  99   5.732  -8.113 -10.510
  866    HA   ASP  99           HA       ASP  99   7.390  -7.449 -12.770
  867   1HB   ASP  99          HB2       ASP  99   7.913  -5.389 -11.606
  868   2HB   ASP  99          HB1       ASP  99   6.206  -5.745 -11.366
  869    H    GLU 100           HN       GLU 100   8.084  -8.750  -9.562
  870    HA   GLU 100           HA       GLU 100  10.902  -8.401  -9.500
  871   1HB   GLU 100          HB2       GLU 100   9.622  -9.168  -7.551
  872   2HB   GLU 100          HB1       GLU 100   9.211 -10.665  -8.387
  873   1HG   GLU 100          HG2       GLU 100  12.102 -10.107  -8.316
  874   2HG   GLU 100          HG1       GLU 100  11.384 -10.338  -6.722
  875    H    LEU 101           HN       LEU 101   8.914 -10.905 -11.060
  876    HA   LEU 101           HA       LEU 101  11.125 -12.594 -11.834
  877   1HB   LEU 101          HB2       LEU 101   8.254 -12.567 -12.157
  878   2HB   LEU 101          HB1       LEU 101   9.021 -12.918 -13.704
  879    HG   LEU 101           HG       LEU 101   8.610 -14.994 -12.441
  880   1HD1  LEU 101          HD11      LEU 101  10.706 -14.605 -13.888
  881   2HD1  LEU 101          HD12      LEU 101  10.755 -15.955 -12.754
  882   3HD1  LEU 101          HD13      LEU 101  11.580 -14.446 -12.364
  883   1HD2  LEU 101          HD21      LEU 101   8.940 -13.680 -10.191
  884   2HD2  LEU 101          HD22      LEU 101  10.638 -14.108 -10.400
  885   3HD2  LEU 101          HD23      LEU 101   9.419 -15.376 -10.275
  886    H    LEU 102           HN       LEU 102   9.371  -9.952 -13.451
  887    HA   LEU 102           HA       LEU 102   9.687  -8.992 -15.577
  888   1HB   LEU 102          HB2       LEU 102  12.302  -8.258 -15.649
  889   2HB   LEU 102          HB1       LEU 102  11.080  -7.427 -14.696
  890    HG   LEU 102           HG       LEU 102  11.805  -9.358 -12.930
  891   1HD1  LEU 102          HD11      LEU 102  13.534 -10.247 -14.481
  892   2HD1  LEU 102          HD12      LEU 102  14.244  -9.613 -12.997
  893   3HD1  LEU 102          HD13      LEU 102  14.317  -8.667 -14.483
  894   1HD2  LEU 102          HD21      LEU 102  11.773  -6.776 -12.790
  895   2HD2  LEU 102          HD22      LEU 102  13.474  -6.865 -13.244
  896   3HD2  LEU 102          HD23      LEU 102  12.918  -7.632 -11.757
  Start of MODEL    6
    1   1H    MET   1          HT1       MET   1 -19.160 -17.479 -19.600
    2   2H    MET   1          HT2       MET   1 -18.811 -16.112 -20.548
    3   3H    MET   1          HT3       MET   1 -19.887 -15.989 -19.239
    4    HA   MET   1           HA       MET   1 -17.731 -15.041 -18.683
    5   1HB   MET   1          HB2       MET   1 -18.981 -17.322 -17.288
    6   2HB   MET   1          HB1       MET   1 -17.311 -17.010 -16.815
    7   1HG   MET   1          HG2       MET   1 -18.005 -15.283 -15.556
    8   2HG   MET   1          HG1       MET   1 -18.615 -14.486 -17.006
    9   1HE   MET   1          HE1       MET   1 -21.388 -13.607 -16.513
   10   2HE   MET   1          HE2       MET   1 -22.089 -14.986 -17.357
   11   3HE   MET   1          HE3       MET   1 -20.518 -14.364 -17.856
   12    H    ALA   2           HN       ALA   2 -15.680 -15.059 -19.433
   13    HA   ALA   2           HA       ALA   2 -14.519 -17.573 -20.485
   14   1HB   ALA   2          HB1       ALA   2 -13.333 -14.782 -20.508
   15   2HB   ALA   2          HB2       ALA   2 -14.388 -15.409 -21.774
   16   3HB   ALA   2          HB3       ALA   2 -12.821 -16.163 -21.478
   17    H    GLU   3           HN       GLU   3 -13.814 -15.080 -18.029
   18    HA   GLU   3           HA       GLU   3 -12.473 -15.148 -16.115
   19   1HB   GLU   3          HB2       GLU   3 -13.772 -17.544 -16.159
   20   2HB   GLU   3          HB1       GLU   3 -12.094 -18.087 -16.195
   21   1HG   GLU   3          HG2       GLU   3 -12.614 -17.909 -13.886
   22   2HG   GLU   3          HG1       GLU   3 -11.699 -16.446 -14.250
   23    H    GLN   4           HN       GLN   4 -11.240 -14.934 -18.771
   24    HA   GLN   4           HA       GLN   4  -8.493 -15.776 -18.011
   25   1HB   GLN   4          HB2       GLN   4 -10.017 -16.640 -20.434
   26   2HB   GLN   4          HB1       GLN   4  -8.309 -16.257 -20.640
   27   1HG   GLN   4          HG2       GLN   4  -9.258 -18.086 -18.433
   28   2HG   GLN   4          HG1       GLN   4  -8.901 -18.696 -20.049
   29   1HE2  GLN   4          HE21      GLN   4  -6.638 -18.469 -20.833
   30   2HE2  GLN   4          HE22      GLN   4  -5.370 -18.261 -19.724
   31    H    GLN   5           HN       GLN   5  -7.241 -13.986 -18.115
   32    HA   GLN   5           HA       GLN   5  -8.172 -11.613 -19.577
   33   1HB   GLN   5          HB2       GLN   5  -6.154 -10.524 -18.594
   34   2HB   GLN   5          HB1       GLN   5  -7.174 -11.285 -17.374
   35   1HG   GLN   5          HG2       GLN   5  -5.636 -12.943 -16.922
   36   2HG   GLN   5          HG1       GLN   5  -4.997 -12.948 -18.565
   37   1HE2  GLN   5          HE21      GLN   5  -4.880 -11.180 -15.464
   38   2HE2  GLN   5          HE22      GLN   5  -3.433 -10.359 -15.802
   39    H    GLN   6           HN       GLN   6  -7.123 -10.663 -21.350
   40    HA   GLN   6           HA       GLN   6  -5.003 -12.321 -22.664
   41   1HB   GLN   6          HB2       GLN   6  -7.463 -11.019 -23.840
   42   2HB   GLN   6          HB1       GLN   6  -6.066 -11.411 -24.842
   43   1HG   GLN   6          HG2       GLN   6  -7.296 -13.484 -23.030
   44   2HG   GLN   6          HG1       GLN   6  -7.953 -13.185 -24.638
   45   1HE2  GLN   6          HE21      GLN   6  -6.360 -13.423 -26.503
   46   2HE2  GLN   6          HE22      GLN   6  -5.079 -14.523 -26.334
   47    H    GLU   7           HN       GLU   7  -6.532  -9.077 -22.849
   48    HA   GLU   7           HA       GLU   7  -3.814  -7.867 -22.765
   49   1HB   GLU   7          HB2       GLU   7  -4.892  -8.170 -25.173
   50   2HB   GLU   7          HB1       GLU   7  -5.812  -6.742 -24.698
   51   1HG   GLU   7          HG2       GLU   7  -3.718  -5.541 -24.210
   52   2HG   GLU   7          HG1       GLU   7  -2.787  -6.969 -24.660
   53    H    GLN   8           HN       GLN   8  -7.290  -7.001 -23.039
   54    HA   GLN   8           HA       GLN   8  -7.022  -5.359 -20.584
   55   1HB   GLN   8          HB2       GLN   8  -8.238  -3.464 -21.716
   56   2HB   GLN   8          HB1       GLN   8  -6.603  -3.725 -22.321
   57   1HG   GLN   8          HG2       GLN   8  -7.914  -5.329 -24.027
   58   2HG   GLN   8          HG1       GLN   8  -9.223  -4.204 -23.667
   59   1HE2  GLN   8          HE21      GLN   8  -8.849  -1.886 -24.183
   60   2HE2  GLN   8          HE22      GLN   8  -7.660  -1.446 -25.311
   61    H    GLN   9           HN       GLN   9  -8.723  -5.797 -19.282
   62    HA   GLN   9           HA       GLN   9 -11.414  -6.223 -20.390
   63   1HB   GLN   9          HB2       GLN   9 -11.670  -8.449 -19.276
   64   2HB   GLN   9          HB1       GLN   9 -10.486  -8.474 -20.581
   65   1HG   GLN   9          HG2       GLN   9  -8.693  -8.709 -19.146
   66   2HG   GLN   9          HG1       GLN   9  -9.497  -7.852 -17.830
   67   1HE2  GLN   9          HE21      GLN   9 -10.095  -9.217 -16.145
   68   2HE2  GLN   9          HE22      GLN   9 -10.508 -10.855 -16.315
   69    H    ILE  10           HN       ILE  10 -12.526  -7.388 -18.019
   70    HA   ILE  10           HA       ILE  10 -12.744  -5.040 -16.346
   71    HB   ILE  10           HB       ILE  10 -14.174  -6.485 -14.911
   72   1HG1  ILE  10          HG12      ILE  10 -13.921  -8.753 -16.832
   73   2HG1  ILE  10          HG11      ILE  10 -12.608  -8.550 -15.671
   74   1HG2  ILE  10          HG21      ILE  10 -14.988  -5.405 -17.058
   75   2HG2  ILE  10          HG22      ILE  10 -15.918  -6.807 -16.527
   76   3HG2  ILE  10          HG23      ILE  10 -14.754  -6.968 -17.843
   77   1HD1  ILE  10          HD11      ILE  10 -14.766  -9.978 -15.057
   78   2HD1  ILE  10          HD12      ILE  10 -15.419  -8.390 -14.660
   79   3HD1  ILE  10          HD13      ILE  10 -13.968  -8.974 -13.847
   80    H    ARG  11           HN       ARG  11 -12.752  -6.087 -13.718
   81    HA   ARG  11           HA       ARG  11 -11.338  -6.598 -11.916
   82   1HB   ARG  11          HB2       ARG  11 -10.534  -8.381 -13.919
   83   2HB   ARG  11          HB1       ARG  11  -9.038  -7.606 -13.399
   84   1HG   ARG  11          HG2       ARG  11  -9.534  -8.161 -11.062
   85   2HG   ARG  11          HG1       ARG  11 -11.068  -8.885 -11.545
   86   1HD   ARG  11          HD2       ARG  11  -8.972 -10.021 -13.145
   87   2HD   ARG  11          HD1       ARG  11  -8.509 -10.129 -11.447
   88    HE   ARG  11           HE       ARG  11 -10.240 -11.703 -11.135
   89   1HH1  ARG  11          HH11      ARG  11  -9.894 -12.117 -14.185
   90   2HH1  ARG  11          HH12      ARG  11 -11.551 -12.107 -14.690
   91   1HH2  ARG  11          HH21      ARG  11 -12.727 -10.739 -11.720
   92   2HH2  ARG  11          HH22      ARG  11 -13.158 -11.325 -13.293
   93    H    VAL  12           HN       VAL  12  -8.885  -6.090 -11.227
   94    HA   VAL  12           HA       VAL  12  -8.464  -3.294 -11.961
   95    HB   VAL  12           HB       VAL  12  -8.093  -4.391  -9.642
   96   1HG1  VAL  12          HG11      VAL  12  -5.352  -4.868 -10.821
   97   2HG1  VAL  12          HG12      VAL  12  -6.545  -6.153 -10.634
   98   3HG1  VAL  12          HG13      VAL  12  -5.926  -5.313  -9.213
   99   1HG2  VAL  12          HG21      VAL  12  -7.512  -2.033 -10.347
  100   2HG2  VAL  12          HG22      VAL  12  -5.891  -2.618 -10.721
  101   3HG2  VAL  12          HG23      VAL  12  -6.493  -2.687  -9.065
  102    H    ARG  13           HN       ARG  13  -6.564  -2.439 -12.867
  103    HA   ARG  13           HA       ARG  13  -4.816  -4.348 -14.355
  104   1HB   ARG  13          HB2       ARG  13  -6.717  -3.189 -15.736
  105   2HB   ARG  13          HB1       ARG  13  -5.693  -1.758 -15.619
  106   1HG   ARG  13          HG2       ARG  13  -4.576  -2.567 -17.409
  107   2HG   ARG  13          HG1       ARG  13  -3.912  -3.783 -16.317
  108   1HD   ARG  13          HD2       ARG  13  -6.601  -4.182 -17.620
  109   2HD   ARG  13          HD1       ARG  13  -5.114  -4.609 -18.465
  110    HE   ARG  13           HE       ARG  13  -4.743  -5.922 -16.131
  111   1HH1  ARG  13          HH11      ARG  13  -7.602  -5.837 -15.424
  112   2HH1  ARG  13          HH12      ARG  13  -8.241  -7.251 -16.194
  113   1HH2  ARG  13          HH21      ARG  13  -5.517  -7.649 -18.315
  114   2HH2  ARG  13          HH22      ARG  13  -7.055  -8.281 -17.834
  115    H    ILE  14           HN       ILE  14  -5.160  -0.822 -13.955
  116    HA   ILE  14           HA       ILE  14  -3.104   0.589 -14.086
  117    HB   ILE  14           HB       ILE  14  -4.725   1.140 -12.347
  118   1HG1  ILE  14          HG12      ILE  14  -3.056   2.085 -10.634
  119   2HG1  ILE  14          HG11      ILE  14  -1.800   1.304 -11.594
  120   1HG2  ILE  14          HG21      ILE  14  -3.283  -0.215 -10.167
  121   2HG2  ILE  14          HG22      ILE  14  -4.110  -1.315 -11.271
  122   3HG2  ILE  14          HG23      ILE  14  -5.017  -0.051 -10.442
  123   1HD1  ILE  14          HD11      ILE  14  -2.397   2.584 -13.550
  124   2HD1  ILE  14          HD12      ILE  14  -2.232   3.717 -12.209
  125   3HD1  ILE  14          HD13      ILE  14  -3.834   3.225 -12.755
  126    HA   PRO  15           HA       PRO  15   0.296  -2.320 -13.181
  127   1HB   PRO  15          HB2       PRO  15   1.720  -1.654 -15.434
  128   2HB   PRO  15          HB1       PRO  15   0.458  -2.897 -15.409
  129   1HG   PRO  15          HG2       PRO  15   0.360  -0.152 -16.559
  130   2HG   PRO  15          HG1       PRO  15  -0.573  -1.589 -17.007
  131   1HD   PRO  15          HD2       PRO  15  -1.494   0.582 -15.423
  132   2HD   PRO  15          HD1       PRO  15  -2.310  -0.981 -15.645
  133    H    ARG  16           HN       ARG  16   2.302  -1.747 -12.242
  134    HA   ARG  16           HA       ARG  16   2.932   1.180 -12.186
  135   1HB   ARG  16          HB2       ARG  16   3.039  -0.971 -10.114
  136   2HB   ARG  16          HB1       ARG  16   4.268   0.293 -10.045
  137   1HG   ARG  16          HG2       ARG  16   2.338   1.969 -10.245
  138   2HG   ARG  16          HG1       ARG  16   1.264   0.612  -9.909
  139   1HD   ARG  16          HD2       ARG  16   1.744   0.685  -7.709
  140   2HD   ARG  16          HD1       ARG  16   3.477   0.656  -8.032
  141    HE   ARG  16           HE       ARG  16   2.270   3.269  -8.518
  142   1HH1  ARG  16          HH21      ARG  16   1.529   2.735  -5.701
  143   2HH1  ARG  16          HH22      ARG  16   2.928   3.264  -4.827
  144   1HH2  ARG  16          HH11      ARG  16   5.000   3.256  -7.617
  145   2HH2  ARG  16          HH12      ARG  16   4.897   3.564  -5.916
  146    H    LYS  17           HN       LYS  17   5.032   1.831 -12.648
  147    HA   LYS  17           HA       LYS  17   6.851  -0.298 -13.691
  148   1HB   LYS  17          HB2       LYS  17   7.864   1.444 -15.067
  149   2HB   LYS  17          HB1       LYS  17   6.117   1.467 -15.299
  150   1HG   LYS  17          HG2       LYS  17   6.883   3.176 -13.077
  151   2HG   LYS  17          HG1       LYS  17   7.737   3.637 -14.550
  152   1HD   LYS  17          HD2       LYS  17   5.556   3.663 -15.763
  153   2HD   LYS  17          HD1       LYS  17   4.737   3.322 -14.239
  154   1HE   LYS  17          HE2       LYS  17   6.592   5.686 -14.564
  155   2HE   LYS  17          HE1       LYS  17   4.872   5.789 -14.937
  156   1HZ   LYS  17          HZ1       LYS  17   5.181   6.473 -12.697
  157   2HZ   LYS  17          HZ2       LYS  17   6.105   5.096 -12.328
  158   3HZ   LYS  17          HZ3       LYS  17   4.445   4.946 -12.655
  159    H    GLU  18           HN       GLU  18   6.543   0.750 -10.807
  160    HA   GLU  18           HA       GLU  18   9.368   1.653 -10.415
  161   1HB   GLU  18          HB2       GLU  18   6.947   2.023  -8.621
  162   2HB   GLU  18          HB1       GLU  18   8.585   2.551  -8.233
  163   1HG   GLU  18          HG2       GLU  18   8.182   4.473  -9.333
  164   2HG   GLU  18          HG1       GLU  18   8.028   3.548 -10.825
  165    H    GLU  19           HN       GLU  19  10.703   0.202  -9.468
  166    HA   GLU  19           HA       GLU  19   9.631  -2.341  -8.469
  167   1HB   GLU  19          HB2       GLU  19  12.286  -1.264  -9.217
  168   2HB   GLU  19          HB1       GLU  19  12.298  -2.451  -7.914
  169   1HG   GLU  19          HG2       GLU  19  10.751  -2.947 -10.459
  170   2HG   GLU  19          HG1       GLU  19  12.467  -3.338 -10.342
  171    H    ASN  20           HN       ASN  20  11.181   0.551  -7.102
  172    HA   ASN  20           HA       ASN  20  11.375  -0.565  -4.420
  173   1HB   ASN  20          HB2       ASN  20  12.384   1.702  -5.746
  174   2HB   ASN  20          HB1       ASN  20  11.323   2.340  -4.491
  175   1HD2  ASN  20          HD21      ASN  20  11.709   1.369  -2.218
  176   2HD2  ASN  20          HD22      ASN  20  13.306   0.973  -1.800
  177    H    GLU  21           HN       GLU  21   9.334  -1.241  -3.736
  178    HA   GLU  21           HA       GLU  21   7.471   0.897  -2.933
  179   1HB   GLU  21          HB2       GLU  21   6.933  -0.983  -5.159
  180   2HB   GLU  21          HB1       GLU  21   5.641  -0.853  -3.966
  181   1HG   GLU  21          HG2       GLU  21   6.938   1.491  -5.394
  182   2HG   GLU  21          HG1       GLU  21   5.369   0.798  -5.800
  183    H    ILE  22           HN       ILE  22   6.518   0.368  -0.990
  184    HA   ILE  22           HA       ILE  22   6.811  -2.466  -0.060
  185    HB   ILE  22           HB       ILE  22   6.498  -1.129   2.260
  186   1HG1  ILE  22          HG12      ILE  22   6.529   1.050   0.777
  187   2HG1  ILE  22          HG11      ILE  22   7.439   1.021   2.282
  188   1HG2  ILE  22          HG21      ILE  22   9.090  -1.062   2.242
  189   2HG2  ILE  22          HG22      ILE  22   8.938  -1.750   0.625
  190   3HG2  ILE  22          HG23      ILE  22   8.285  -2.615   2.018
  191   1HD1  ILE  22          HD11      ILE  22   8.543   1.806  -0.040
  192   2HD1  ILE  22          HD12      ILE  22   8.861   0.076  -0.163
  193   3HD1  ILE  22          HD13      ILE  22   9.476   0.990   1.215
  194    H    LEU  23           HN       LEU  23   5.000  -3.214   1.483
  195    HA   LEU  23           HA       LEU  23   2.447  -1.738   0.721
  196   1HB   LEU  23          HB2       LEU  23   3.135  -4.340   0.039
  197   2HB   LEU  23          HB1       LEU  23   2.112  -4.549   1.456
  198    HG   LEU  23           HG       LEU  23   1.304  -2.747  -0.820
  199   1HD1  LEU  23          HD11      LEU  23  -0.144  -5.182  -0.910
  200   2HD1  LEU  23          HD12      LEU  23   1.563  -5.617  -0.833
  201   3HD1  LEU  23          HD13      LEU  23   0.980  -4.558  -2.116
  202   1HD2  LEU  23          HD21      LEU  23  -0.007  -4.015   1.578
  203   2HD2  LEU  23          HD22      LEU  23  -0.982  -3.572   0.177
  204   3HD2  LEU  23          HD23      LEU  23  -0.069  -2.337   1.041
  205    H    GLY  24           HN       GLY  24   1.150  -1.108   2.535
  206   1HA   GLY  24          HA2       GLY  24   1.718  -2.589   5.061
  207   2HA   GLY  24          HA1       GLY  24   1.910  -0.846   5.064
  208    H    ILE  25           HN       ILE  25   0.187  -2.363   6.710
  209    HA   ILE  25           HA       ILE  25  -2.555  -1.616   5.771
  210    HB   ILE  25           HB       ILE  25  -2.122  -3.950   6.694
  211   1HG1  ILE  25          HG12      ILE  25  -3.947  -2.536   8.613
  212   2HG1  ILE  25          HG11      ILE  25  -4.327  -2.508   6.891
  213   1HG2  ILE  25          HG21      ILE  25  -0.482  -3.001   8.458
  214   2HG2  ILE  25          HG22      ILE  25  -1.567  -4.299   8.958
  215   3HG2  ILE  25          HG23      ILE  25  -1.927  -2.629   9.396
  216   1HD1  ILE  25          HD11      ILE  25  -3.606  -5.126   8.156
  217   2HD1  ILE  25          HD12      ILE  25  -4.666  -4.802   6.784
  218   3HD1  ILE  25          HD13      ILE  25  -5.222  -4.472   8.425
  219    H    ILE  26           HN       ILE  26  -3.602   0.094   6.899
  220    HA   ILE  26           HA       ILE  26  -1.860   1.644   8.721
  221    HB   ILE  26           HB       ILE  26  -3.693   3.413   8.431
  222   1HG1  ILE  26          HG12      ILE  26  -4.361   1.742   5.998
  223   2HG1  ILE  26          HG11      ILE  26  -5.322   1.685   7.472
  224   1HG2  ILE  26          HG21      ILE  26  -2.803   3.808   5.998
  225   2HG2  ILE  26          HG22      ILE  26  -1.757   2.440   6.379
  226   3HG2  ILE  26          HG23      ILE  26  -1.706   3.896   7.374
  227   1HD1  ILE  26          HD11      ILE  26  -6.259   3.716   7.087
  228   2HD1  ILE  26          HD12      ILE  26  -5.736   3.461   5.424
  229   3HD1  ILE  26          HD13      ILE  26  -4.740   4.415   6.523
  230    H    GLU  27           HN       GLU  27  -2.486   2.483  10.602
  231    HA   GLU  27           HA       GLU  27  -5.014   1.575  11.871
  232   1HB   GLU  27          HB2       GLU  27  -2.571   0.301  12.376
  233   2HB   GLU  27          HB1       GLU  27  -2.775   1.409  13.732
  234   1HG   GLU  27          HG2       GLU  27  -5.211  -0.082  12.946
  235   2HG   GLU  27          HG1       GLU  27  -3.911  -1.065  13.620
  236    H    GLN  28           HN       GLN  28  -5.942   3.391  12.650
  237    HA   GLN  28           HA       GLN  28  -4.231   5.733  13.306
  238   1HB   GLN  28          HB2       GLN  28  -6.340   5.744  11.728
  239   2HB   GLN  28          HB1       GLN  28  -7.236   5.817  13.244
  240   1HG   GLN  28          HG2       GLN  28  -4.985   7.674  13.228
  241   2HG   GLN  28          HG1       GLN  28  -6.101   7.985  11.899
  242   1HE2  GLN  28          HE21      GLN  28  -8.411   8.405  12.487
  243   2HE2  GLN  28          HE22      GLN  28  -8.792   8.973  14.041
  244    H    MET  29           HN       MET  29  -3.677   4.302  15.310
  245    HA   MET  29           HA       MET  29  -5.745   4.601  17.437
  246   1HB   MET  29          HB2       MET  29  -3.743   2.607  16.859
  247   2HB   MET  29          HB1       MET  29  -3.442   3.291  18.457
  248   1HG   MET  29          HG2       MET  29  -5.825   2.898  19.048
  249   2HG   MET  29          HG1       MET  29  -6.071   2.145  17.473
  250   1HE   MET  29          HE1       MET  29  -6.963  -0.066  19.253
  251   2HE   MET  29          HE2       MET  29  -5.931  -1.273  18.491
  252   3HE   MET  29          HE3       MET  29  -6.570   0.060  17.533
  253    H    LEU  30           HN       LEU  30  -5.593   6.488  18.531
  254    HA   LEU  30           HA       LEU  30  -4.688   8.314  19.679
  255   1HB   LEU  30          HB2       LEU  30  -3.104   6.100  20.371
  256   2HB   LEU  30          HB1       LEU  30  -1.946   7.354  19.937
  257    HG   LEU  30           HG       LEU  30  -2.451   7.532  22.311
  258   1HD1  LEU  30          HD11      LEU  30  -3.977   9.732  20.900
  259   2HD1  LEU  30          HD12      LEU  30  -2.218   9.623  20.884
  260   3HD1  LEU  30          HD13      LEU  30  -3.074   9.844  22.409
  261   1HD2  LEU  30          HD21      LEU  30  -4.521   7.226  23.181
  262   2HD2  LEU  30          HD22      LEU  30  -4.972   6.634  21.583
  263   3HD2  LEU  30          HD23      LEU  30  -5.263   8.319  22.013
  264    H    GLY  31           HN       GLY  31  -4.709   8.429  16.869
  265   1HA   GLY  31          HA2       GLY  31  -2.242  10.038  16.326
  266   2HA   GLY  31          HA1       GLY  31  -2.929   8.973  15.100
  267    H    ALA  32           HN       ALA  32  -2.647  11.654  14.499
  268    HA   ALA  32           HA       ALA  32  -5.494  12.550  14.414
  269   1HB   ALA  32          HB1       ALA  32  -4.549  14.933  14.569
  270   2HB   ALA  32          HB2       ALA  32  -3.057  14.187  15.142
  271   3HB   ALA  32          HB3       ALA  32  -4.550  13.989  16.060
  272    H    SER  33           HN       SER  33  -2.348  13.711  13.109
  273    HA   SER  33           HA       SER  33  -3.631  13.985  10.446
  274   1HB   SER  33          HB2       SER  33  -2.028  15.714  11.666
  275   2HB   SER  33          HB1       SER  33  -0.767  14.706  10.961
  276    HG   SER  33           HG       SER  33  -1.867  16.597   9.736
  277    H    ARG  34           HN       ARG  34  -0.678  12.516  11.855
  278    HA   ARG  34           HA       ARG  34  -0.441  10.787   9.439
  279   1HB   ARG  34          HB2       ARG  34   1.579  11.994  10.189
  280   2HB   ARG  34          HB1       ARG  34   1.478  11.198  11.755
  281   1HG   ARG  34          HG2       ARG  34   1.483   8.996  10.318
  282   2HG   ARG  34          HG1       ARG  34   2.186  10.033   9.077
  283   1HD   ARG  34          HD2       ARG  34   3.271   9.794  11.897
  284   2HD   ARG  34          HD1       ARG  34   3.891   8.887  10.520
  285    HE   ARG  34           HE       ARG  34   4.572  11.588  11.130
  286   1HH1  ARG  34          HH21      ARG  34   5.277   9.292   8.916
  287   2HH1  ARG  34          HH22      ARG  34   5.377  10.334   7.537
  288   1HH2  ARG  34          HH11      ARG  34   3.993  13.071   9.170
  289   2HH2  ARG  34          HH12      ARG  34   4.651  12.478   7.681
  290    H    VAL  35           HN       VAL  35  -0.457   8.535   9.626
  291    HA   VAL  35           HA       VAL  35  -1.589   7.447  12.161
  292    HB   VAL  35           HB       VAL  35  -2.157   7.093   9.297
  293   1HG1  VAL  35          HG11      VAL  35  -2.857   4.718   9.569
  294   2HG1  VAL  35          HG12      VAL  35  -1.996   4.686  11.105
  295   3HG1  VAL  35          HG13      VAL  35  -1.110   4.946   9.602
  296   1HG2  VAL  35          HG21      VAL  35  -3.738   7.992  10.975
  297   2HG2  VAL  35          HG22      VAL  35  -3.715   6.433  11.797
  298   3HG2  VAL  35          HG23      VAL  35  -4.371   6.560  10.166
  299    H    ARG  36           HN       ARG  36  -0.866   5.167  12.650
  300    HA   ARG  36           HA       ARG  36   2.003   4.844  11.838
  301   1HB   ARG  36          HB2       ARG  36   1.662   4.856  14.247
  302   2HB   ARG  36          HB1       ARG  36   0.467   3.582  14.107
  303   1HG   ARG  36          HG2       ARG  36   2.642   2.498  12.802
  304   2HG   ARG  36          HG1       ARG  36   3.392   3.398  14.120
  305   1HD   ARG  36          HD2       ARG  36   2.937   1.236  15.013
  306   2HD   ARG  36          HD1       ARG  36   1.676   2.286  15.660
  307    HE   ARG  36           HE       ARG  36   1.090   0.732  13.191
  308   1HH1  ARG  36          HH11      ARG  36  -0.946   2.255  14.888
  309   2HH1  ARG  36          HH12      ARG  36  -1.705   0.956  15.746
  310   1HH2  ARG  36          HH21      ARG  36   0.798  -1.341  15.012
  311   2HH2  ARG  36          HH22      ARG  36  -0.714  -1.085  15.816
  312    H    VAL  37           HN       VAL  37   2.638   2.977  10.751
  313    HA   VAL  37           HA       VAL  37   0.467   1.083  10.048
  314    HB   VAL  37           HB       VAL  37   2.254   2.773   8.387
  315   1HG1  VAL  37          HG11      VAL  37   1.756   1.173   6.479
  316   2HG1  VAL  37          HG12      VAL  37   1.414  -0.020   7.732
  317   3HG1  VAL  37          HG13      VAL  37   3.019   0.707   7.618
  318   1HG2  VAL  37          HG21      VAL  37  -0.387   2.832   8.881
  319   2HG2  VAL  37          HG22      VAL  37  -0.380   1.750   7.487
  320   3HG2  VAL  37          HG23      VAL  37   0.303   3.369   7.350
  321    H    ARG  38           HN       ARG  38   1.076  -0.960   9.591
  322    HA   ARG  38           HA       ARG  38   3.922  -1.776  10.140
  323   1HB   ARG  38          HB2       ARG  38   2.819  -4.096  10.561
  324   2HB   ARG  38          HB1       ARG  38   2.680  -2.890  11.830
  325   1HG   ARG  38          HG2       ARG  38   0.433  -2.257  10.634
  326   2HG   ARG  38          HG1       ARG  38   0.578  -3.854   9.906
  327   1HD   ARG  38          HD2       ARG  38   0.982  -3.664  12.854
  328   2HD   ARG  38          HD1       ARG  38  -0.663  -3.466  12.253
  329    HE   ARG  38           HE       ARG  38  -0.238  -5.719  11.058
  330   1HH1  ARG  38          HH11      ARG  38  -0.950  -6.043  13.943
  331   2HH1  ARG  38          HH12      ARG  38   0.323  -7.063  14.526
  332   1HH2  ARG  38          HH21      ARG  38   2.404  -6.473  11.808
  333   2HH2  ARG  38          HH22      ARG  38   2.224  -7.308  13.315
  334    H    CYS  39           HN       CYS  39   4.849  -3.075   8.411
  335    HA   CYS  39           HA       CYS  39   2.940  -3.582   6.175
  336   1HB   CYS  39          HB2       CYS  39   3.812  -1.963   4.915
  337   2HB   CYS  39          HB1       CYS  39   4.691  -1.423   6.339
  338    HG   CYS  39           HG       CYS  39   6.663  -3.067   5.555
  339    H    LEU  40           HN       LEU  40   3.627  -4.880   4.496
  340    HA   LEU  40           HA       LEU  40   5.509  -7.017   5.216
  341   1HB   LEU  40          HB2       LEU  40   3.034  -7.098   4.135
  342   2HB   LEU  40          HB1       LEU  40   3.994  -7.069   2.667
  343    HG   LEU  40           HG       LEU  40   5.166  -9.061   3.303
  344   1HD1  LEU  40          HD11      LEU  40   5.641  -8.967   5.577
  345   2HD1  LEU  40          HD12      LEU  40   4.307 -10.119   5.591
  346   3HD1  LEU  40          HD13      LEU  40   4.014  -8.430   5.998
  347   1HD2  LEU  40          HD21      LEU  40   2.907  -9.383   2.396
  348   2HD2  LEU  40          HD22      LEU  40   2.233  -9.294   4.023
  349   3HD2  LEU  40          HD23      LEU  40   3.280 -10.641   3.575
  350    H    ASP  41           HN       ASP  41   6.729  -7.810   3.240
  351    HA   ASP  41           HA       ASP  41   8.372  -7.431   1.595
  352   1HB   ASP  41          HB2       ASP  41   6.638  -5.518   0.813
  353   2HB   ASP  41          HB1       ASP  41   7.843  -4.470   1.560
  354    H    GLY  42           HN       GLY  42   8.144  -7.083   4.583
  355   1HA   GLY  42          HA2       GLY  42   9.580  -6.773   6.366
  356   2HA   GLY  42          HA1       GLY  42  10.864  -6.554   5.193
  357    H    LYS  43           HN       LYS  43   8.000  -4.497   6.269
  358    HA   LYS  43           HA       LYS  43  10.053  -2.502   7.031
  359   1HB   LYS  43          HB2       LYS  43   9.178  -2.225   4.554
  360   2HB   LYS  43          HB1       LYS  43   7.859  -1.387   5.361
  361   1HG   LYS  43          HG2       LYS  43   9.407   0.334   4.995
  362   2HG   LYS  43          HG1       LYS  43   9.758  -0.150   6.652
  363   1HD   LYS  43          HD2       LYS  43  11.224  -1.673   4.584
  364   2HD   LYS  43          HD1       LYS  43  11.644   0.036   4.676
  365   1HE   LYS  43          HE2       LYS  43  11.583  -1.818   7.075
  366   2HE   LYS  43          HE1       LYS  43  13.042  -1.429   6.169
  367   1HZ   LYS  43          HZ1       LYS  43  12.964   0.052   7.978
  368   2HZ   LYS  43          HZ2       LYS  43  11.323   0.414   7.728
  369   3HZ   LYS  43          HZ3       LYS  43  12.495   0.964   6.627
  370    H    THR  44           HN       THR  44   9.382  -0.874   8.400
  371    HA   THR  44           HA       THR  44   6.596  -0.976   9.462
  372    HB   THR  44           HB       THR  44   8.521  -0.361  11.568
  373    HG1  THR  44           HG1      THR  44   9.818  -1.901  10.608
  374   1HG2  THR  44          HG21      THR  44   7.084  -1.834  12.830
  375   2HG2  THR  44          HG22      THR  44   6.422  -2.524  11.348
  376   3HG2  THR  44          HG23      THR  44   6.073  -0.849  11.772
  377    H    ARG  45           HN       ARG  45   5.809   1.039   9.164
  378    HA   ARG  45           HA       ARG  45   7.642   3.345   9.605
  379   1HB   ARG  45          HB2       ARG  45   5.927   3.329   7.153
  380   2HB   ARG  45          HB1       ARG  45   7.400   4.231   7.460
  381   1HG   ARG  45          HG2       ARG  45   8.774   2.419   6.969
  382   2HG   ARG  45          HG1       ARG  45   7.538   1.234   7.361
  383   1HD   ARG  45          HD2       ARG  45   7.665   2.999   4.912
  384   2HD   ARG  45          HD1       ARG  45   7.785   1.242   4.975
  385    HE   ARG  45           HE       ARG  45   5.292   2.758   5.614
  386   1HH1  ARG  45          HH21      ARG  45   6.873   0.255   3.872
  387   2HH1  ARG  45          HH22      ARG  45   5.448  -0.712   3.739
  388   1HH2  ARG  45          HH11      ARG  45   3.511   1.366   5.710
  389   2HH2  ARG  45          HH12      ARG  45   3.554  -0.098   4.791
  390    H    LEU  46           HN       LEU  46   6.570   5.419   9.605
  391    HA   LEU  46           HA       LEU  46   3.736   5.271  10.600
  392   1HB   LEU  46          HB2       LEU  46   5.443   7.774  10.585
  393   2HB   LEU  46          HB1       LEU  46   4.132   7.343  11.680
  394    HG   LEU  46           HG       LEU  46   5.992   5.324  12.102
  395   1HD1  LEU  46          HD11      LEU  46   7.478   7.057  10.714
  396   2HD1  LEU  46          HD12      LEU  46   8.144   6.171  12.087
  397   3HD1  LEU  46          HD13      LEU  46   7.603   7.838  12.291
  398   1HD2  LEU  46          HD21      LEU  46   4.698   6.450  13.839
  399   2HD2  LEU  46          HD22      LEU  46   5.589   7.949  13.571
  400   3HD2  LEU  46          HD23      LEU  46   6.412   6.541  14.244
  401    H    GLY  47           HN       GLY  47   2.294   5.653   8.901
  402   1HA   GLY  47          HA2       GLY  47   3.365   6.974   6.471
  403   2HA   GLY  47          HA1       GLY  47   1.941   5.950   6.532
  404    H    ARG  48           HN       ARG  48   2.188   8.550   5.315
  405    HA   ARG  48           HA       ARG  48   0.315  10.120   7.004
  406   1HB   ARG  48          HB2       ARG  48   2.623  10.897   5.469
  407   2HB   ARG  48          HB1       ARG  48   1.200  11.779   4.936
  408   1HG   ARG  48          HG2       ARG  48   1.670  11.492   7.877
  409   2HG   ARG  48          HG1       ARG  48   2.660  12.645   6.983
  410   1HD   ARG  48          HD2       ARG  48  -0.123  12.863   6.193
  411   2HD   ARG  48          HD1       ARG  48   0.048  13.060   7.938
  412    HE   ARG  48           HE       ARG  48   1.060  14.893   5.891
  413   1HH1  ARG  48          HH11      ARG  48  -0.167  15.727   8.508
  414   2HH1  ARG  48          HH12      ARG  48   1.216  16.270   9.397
  415   1HH2  ARG  48          HH21      ARG  48   3.507  14.721   7.293
  416   2HH2  ARG  48          HH22      ARG  48   3.303  15.698   8.708
  417    H    ILE  49           HN       ILE  49  -1.420  11.201   5.912
  418    HA   ILE  49           HA       ILE  49  -2.138  10.160   3.216
  419    HB   ILE  49           HB       ILE  49  -4.502   9.777   4.092
  420   1HG1  ILE  49          HG12      ILE  49  -3.323   9.417   6.816
  421   2HG1  ILE  49          HG11      ILE  49  -3.719  11.061   6.316
  422   1HG2  ILE  49          HG21      ILE  49  -2.339   8.030   5.300
  423   2HG2  ILE  49          HG22      ILE  49  -2.860   7.952   3.616
  424   3HG2  ILE  49          HG23      ILE  49  -3.988   7.543   4.909
  425   1HD1  ILE  49          HD11      ILE  49  -5.608   8.691   6.371
  426   2HD1  ILE  49          HD12      ILE  49  -6.018  10.275   5.715
  427   3HD1  ILE  49          HD13      ILE  49  -5.655  10.099   7.431
  428    HA   PRO  50           HA       PRO  50  -3.663  14.227   2.563
  429   1HB   PRO  50          HB2       PRO  50  -5.795  13.740   0.889
  430   2HB   PRO  50          HB1       PRO  50  -4.100  13.647   0.381
  431   1HG   PRO  50          HG2       PRO  50  -6.016  11.428   0.951
  432   2HG   PRO  50          HG1       PRO  50  -4.624  11.456  -0.145
  433   1HD   PRO  50          HD2       PRO  50  -4.667  10.264   2.405
  434   2HD   PRO  50          HD1       PRO  50  -3.205  10.660   1.476
  435    H    GLY  51           HN       GLY  51  -6.110  11.836   3.557
  436   1HA   GLY  51          HA2       GLY  51  -7.705  12.081   5.297
  437   2HA   GLY  51          HA1       GLY  51  -7.274  13.784   5.421
  438    H    ARG  52           HN       ARG  52  -7.883  12.891   2.182
  439    HA   ARG  52           HA       ARG  52 -10.196  14.585   1.980
  440   1HB   ARG  52          HB2       ARG  52  -8.928  12.564   0.126
  441   2HB   ARG  52          HB1       ARG  52 -10.413  13.408  -0.313
  442   1HG   ARG  52          HG2       ARG  52  -9.182  15.580   0.216
  443   2HG   ARG  52          HG1       ARG  52  -7.705  14.618   0.288
  444   1HD   ARG  52          HD2       ARG  52  -9.175  13.930  -2.092
  445   2HD   ARG  52          HD1       ARG  52  -8.962  15.679  -2.022
  446    HE   ARG  52           HE       ARG  52  -6.566  13.992  -1.553
  447   1HH1  ARG  52          HH21      ARG  52  -7.162  13.723  -4.398
  448   2HH1  ARG  52          HH22      ARG  52  -6.421  15.119  -5.107
  449   1HH2  ARG  52          HH11      ARG  52  -6.150  16.830  -2.094
  450   2HH2  ARG  52          HH12      ARG  52  -5.847  16.883  -3.799
  451    H    LEU  53           HN       LEU  53  -9.861  11.022   1.832
  452    HA   LEU  53           HA       LEU  53 -12.680  10.490   1.707
  453   1HB   LEU  53          HB2       LEU  53 -10.212   8.911   2.188
  454   2HB   LEU  53          HB1       LEU  53 -11.698   8.223   2.837
  455    HG   LEU  53           HG       LEU  53 -11.322   7.412   0.553
  456   1HD1  LEU  53          HD11      LEU  53 -13.496   7.773  -0.253
  457   2HD1  LEU  53          HD12      LEU  53 -13.535   9.441   0.321
  458   3HD1  LEU  53          HD13      LEU  53 -13.662   8.110   1.469
  459   1HD2  LEU  53          HD21      LEU  53 -11.137   8.880  -1.330
  460   2HD2  LEU  53          HD22      LEU  53 -10.010   9.496  -0.121
  461   3HD2  LEU  53          HD23      LEU  53 -11.568  10.289  -0.360
  462    H    LYS  54           HN       LYS  54 -10.442  10.939   4.421
  463    HA   LYS  54           HA       LYS  54 -12.013   9.950   6.545
  464   1HB   LYS  54          HB2       LYS  54  -9.606  11.094   6.460
  465   2HB   LYS  54          HB1       LYS  54 -10.529  12.518   6.942
  466   1HG   LYS  54          HG2       LYS  54 -11.287  11.494   8.937
  467   2HG   LYS  54          HG1       LYS  54 -10.856   9.880   8.372
  468   1HD   LYS  54          HD2       LYS  54  -9.045  10.270   9.746
  469   2HD   LYS  54          HD1       LYS  54  -8.421  10.986   8.260
  470   1HE   LYS  54          HE2       LYS  54  -9.223  13.206   8.993
  471   2HE   LYS  54          HE1       LYS  54  -9.832  12.490  10.485
  472   1HZ   LYS  54          HZ1       LYS  54  -7.573  11.786  11.015
  473   2HZ   LYS  54          HZ2       LYS  54  -7.665  13.472  10.828
  474   3HZ   LYS  54          HZ3       LYS  54  -6.998  12.514   9.595
  475    H    ASN  55           HN       ASN  55 -12.094  13.184   5.023
  476    HA   ASN  55           HA       ASN  55 -14.220  14.156   6.755
  477   1HB   ASN  55          HB2       ASN  55 -12.499  15.572   5.488
  478   2HB   ASN  55          HB1       ASN  55 -13.472  15.276   4.048
  479   1HD2  ASN  55          HD21      ASN  55 -15.554  16.332   3.893
  480   2HD2  ASN  55          HD22      ASN  55 -16.055  17.508   5.009
  481    H    ARG  56           HN       ARG  56 -14.076  12.614   3.566
  482    HA   ARG  56           HA       ARG  56 -16.865  13.089   2.918
  483   1HB   ARG  56          HB2       ARG  56 -15.057  12.596   1.232
  484   2HB   ARG  56          HB1       ARG  56 -15.038  10.932   1.818
  485   1HG   ARG  56          HG2       ARG  56 -16.845  10.421   0.579
  486   2HG   ARG  56          HG1       ARG  56 -17.758  11.749   1.294
  487   1HD   ARG  56          HD2       ARG  56 -17.725  12.477  -0.893
  488   2HD   ARG  56          HD1       ARG  56 -16.209  13.191  -0.345
  489    HE   ARG  56           HE       ARG  56 -15.017  11.554  -1.612
  490   1HH1  ARG  56          HH21      ARG  56 -17.292  12.022  -3.553
  491   2HH1  ARG  56          HH22      ARG  56 -17.772  10.401  -3.928
  492   1HH2  ARG  56          HH11      ARG  56 -16.114   9.001  -1.213
  493   2HH2  ARG  56          HH12      ARG  56 -17.103   8.687  -2.599
  494    H    ILE  57           HN       ILE  57 -15.159  10.033   3.731
  495    HA   ILE  57           HA       ILE  57 -17.698   9.089   5.008
  496    HB   ILE  57           HB       ILE  57 -17.052   7.921   2.861
  497   1HG1  ILE  57          HG12      ILE  57 -16.816   5.955   5.120
  498   2HG1  ILE  57          HG11      ILE  57 -18.287   6.915   4.964
  499   1HG2  ILE  57          HG21      ILE  57 -14.556   8.057   3.398
  500   2HG2  ILE  57          HG22      ILE  57 -15.130   6.505   2.788
  501   3HG2  ILE  57          HG23      ILE  57 -14.822   6.716   4.511
  502   1HD1  ILE  57          HD11      ILE  57 -18.505   6.144   2.605
  503   2HD1  ILE  57          HD12      ILE  57 -18.557   4.807   3.754
  504   3HD1  ILE  57          HD13      ILE  57 -17.086   5.121   2.834
  505    H    TRP  58           HN       TRP  58 -17.399   7.628   6.848
  506    HA   TRP  58           HA       TRP  58 -14.748   7.975   8.199
  507   1HB   TRP  58          HB2       TRP  58 -17.499   8.514   9.137
  508   2HB   TRP  58          HB1       TRP  58 -16.498   7.610  10.272
  509    HD1  TRP  58           HD1      TRP  58 -14.309   8.788  11.212
  510    HE1  TRP  58           HE1      TRP  58 -13.603  11.263  11.332
  511    HE3  TRP  58           HE3      TRP  58 -17.638  10.816   7.913
  512    HZ2  TRP  58           HZ2      TRP  58 -14.352  13.773  10.183
  513    HZ3  TRP  58           HZ3      TRP  58 -17.619  13.249   7.445
  514    HH2  TRP  58           HH2      TRP  58 -15.982  14.729   8.574
  515    H    VAL  59           HN       VAL  59 -13.767   6.096   8.736
  516    HA   VAL  59           HA       VAL  59 -15.443   3.635   9.027
  517    HB   VAL  59           HB       VAL  59 -13.593   2.362   7.914
  518   1HG1  VAL  59          HG11      VAL  59 -14.223   2.972   5.658
  519   2HG1  VAL  59          HG12      VAL  59 -14.707   4.586   6.180
  520   3HG1  VAL  59          HG13      VAL  59 -15.638   3.178   6.692
  521   1HG2  VAL  59          HG21      VAL  59 -11.884   3.572   6.673
  522   2HG2  VAL  59          HG22      VAL  59 -11.827   4.097   8.354
  523   3HG2  VAL  59          HG23      VAL  59 -12.588   5.120   7.136
  524    H    ARG  60           HN       ARG  60 -14.351   1.926  10.321
  525    HA   ARG  60           HA       ARG  60 -13.084   3.049  12.686
  526   1HB   ARG  60          HB2       ARG  60 -14.553   0.765  12.152
  527   2HB   ARG  60          HB1       ARG  60 -12.926   0.131  12.386
  528   1HG   ARG  60          HG2       ARG  60 -13.852   0.164  14.565
  529   2HG   ARG  60          HG1       ARG  60 -12.851   1.615  14.499
  530   1HD   ARG  60          HD2       ARG  60 -14.936   2.888  13.797
  531   2HD   ARG  60          HD1       ARG  60 -15.858   1.436  14.186
  532    HE   ARG  60           HE       ARG  60 -15.517   1.890  16.486
  533   1HH1  ARG  60          HH11      ARG  60 -15.488   4.791  15.656
  534   2HH1  ARG  60          HH12      ARG  60 -14.039   5.362  16.414
  535   1HH2  ARG  60          HH21      ARG  60 -12.760   2.179  16.969
  536   2HH2  ARG  60          HH22      ARG  60 -12.490   3.880  17.159
  537    H    GLU  61           HN       GLU  61 -11.016   1.995  13.566
  538    HA   GLU  61           HA       GLU  61  -8.843   2.462  11.744
  539   1HB   GLU  61          HB2       GLU  61  -8.997   1.205  14.490
  540   2HB   GLU  61          HB1       GLU  61  -7.472   1.374  13.620
  541   1HG   GLU  61          HG2       GLU  61  -7.331   3.552  14.164
  542   2HG   GLU  61          HG1       GLU  61  -8.949   3.863  13.538
  543    H    GLY  62           HN       GLY  62  -7.793   1.069  10.383
  544   1HA   GLY  62          HA2       GLY  62  -6.890  -1.315  10.205
  545   2HA   GLY  62          HA1       GLY  62  -8.548  -1.825  10.520
  546    H    ASP  63           HN       ASP  63  -6.556   0.023   8.213
  547    HA   ASP  63           HA       ASP  63  -8.437  -0.864   6.044
  548   1HB   ASP  63          HB2       ASP  63  -8.045   1.793   6.875
  549   2HB   ASP  63          HB1       ASP  63  -7.072   1.631   5.414
  550    H    VAL  64           HN       VAL  64  -7.280  -1.013   3.855
  551    HA   VAL  64           HA       VAL  64  -4.408  -1.720   4.366
  552    HB   VAL  64           HB       VAL  64  -5.650  -2.490   1.800
  553   1HG1  VAL  64          HG11      VAL  64  -4.259  -4.397   2.049
  554   2HG1  VAL  64          HG12      VAL  64  -4.105  -4.145   3.788
  555   3HG1  VAL  64          HG13      VAL  64  -3.313  -3.042   2.662
  556   1HG2  VAL  64          HG21      VAL  64  -6.778  -4.451   2.824
  557   2HG2  VAL  64          HG22      VAL  64  -7.508  -2.938   3.356
  558   3HG2  VAL  64          HG23      VAL  64  -6.407  -3.810   4.423
  559    H    VAL  65           HN       VAL  65  -2.787  -0.706   3.235
  560    HA   VAL  65           HA       VAL  65  -3.576   1.166   1.054
  561    HB   VAL  65           HB       VAL  65  -2.478   3.035   2.052
  562   1HG1  VAL  65          HG11      VAL  65  -4.706   2.082   3.140
  563   2HG1  VAL  65          HG12      VAL  65  -3.875   3.469   3.844
  564   3HG1  VAL  65          HG13      VAL  65  -3.654   1.862   4.534
  565   1HG2  VAL  65          HG21      VAL  65  -1.181   2.873   4.139
  566   2HG2  VAL  65          HG22      VAL  65  -0.501   1.806   2.911
  567   3HG2  VAL  65          HG23      VAL  65  -1.492   1.139   4.209
  568    H    ILE  66           HN       ILE  66  -1.770   1.894  -0.250
  569    HA   ILE  66           HA       ILE  66   0.534  -0.049  -0.215
  570    HB   ILE  66           HB       ILE  66  -0.885   0.387  -2.370
  571   1HG1  ILE  66          HG12      ILE  66   2.088   0.858  -2.650
  572   2HG1  ILE  66          HG11      ILE  66   1.432  -0.700  -2.146
  573   1HG2  ILE  66          HG21      ILE  66  -0.715   2.387  -3.472
  574   2HG2  ILE  66          HG22      ILE  66   0.931   2.678  -2.912
  575   3HG2  ILE  66          HG23      ILE  66  -0.434   3.002  -1.845
  576   1HD1  ILE  66          HD11      ILE  66   1.365  -1.110  -4.390
  577   2HD1  ILE  66          HD12      ILE  66   1.368   0.604  -4.803
  578   3HD1  ILE  66          HD13      ILE  66  -0.133  -0.181  -4.314
  579    H    VAL  67           HN       VAL  67   2.736   0.945  -0.122
  580    HA   VAL  67           HA       VAL  67   2.590   3.839   0.601
  581    HB   VAL  67           HB       VAL  67   3.347   3.539   2.696
  582   1HG1  VAL  67          HG11      VAL  67   2.493   1.634   3.738
  583   2HG1  VAL  67          HG12      VAL  67   2.962   0.572   2.414
  584   3HG1  VAL  67          HG13      VAL  67   1.584   1.654   2.229
  585   1HG2  VAL  67          HG21      VAL  67   5.582   2.686   1.576
  586   2HG2  VAL  67          HG22      VAL  67   5.013   1.110   2.115
  587   3HG2  VAL  67          HG23      VAL  67   5.283   2.400   3.280
  588    H    LYS  68           HN       LYS  68   4.465   5.019   0.633
  589    HA   LYS  68           HA       LYS  68   6.573   4.204  -1.260
  590   1HB   LYS  68          HB2       LYS  68   5.811   6.973  -0.307
  591   2HB   LYS  68          HB1       LYS  68   7.012   6.601  -1.546
  592   1HG   LYS  68          HG2       LYS  68   5.003   5.316  -2.678
  593   2HG   LYS  68          HG1       LYS  68   4.020   6.391  -1.685
  594   1HD   LYS  68          HD2       LYS  68   6.230   7.385  -3.503
  595   2HD   LYS  68          HD1       LYS  68   4.547   7.260  -4.011
  596   1HE   LYS  68          HE2       LYS  68   3.870   8.763  -2.178
  597   2HE   LYS  68          HE1       LYS  68   5.550   8.884  -1.653
  598   1HZ   LYS  68          HZ1       LYS  68   4.425   9.779  -4.250
  599   2HZ   LYS  68          HZ2       LYS  68   6.085   9.757  -3.888
  600   3HZ   LYS  68          HZ3       LYS  68   5.034  10.762  -3.010
  601    HA   PRO  69           HA       PRO  69   9.289   4.167   2.223
  602   1HB   PRO  69          HB2       PRO  69  11.669   4.258   0.890
  603   2HB   PRO  69          HB1       PRO  69  10.619   2.833   0.899
  604   1HG   PRO  69          HG2       PRO  69  11.147   4.746  -1.315
  605   2HG   PRO  69          HG1       PRO  69  10.546   3.082  -1.394
  606   1HD   PRO  69          HD2       PRO  69   9.003   5.497  -1.598
  607   2HD   PRO  69          HD1       PRO  69   8.393   3.826  -1.573
  608    H    TRP  70           HN       TRP  70  10.322   5.530   3.587
  609    HA   TRP  70           HA       TRP  70  11.115   8.255   2.634
  610   1HB   TRP  70          HB2       TRP  70   9.825   7.398   5.211
  611   2HB   TRP  70          HB1       TRP  70  10.684   8.922   5.070
  612    HD1  TRP  70           HD1      TRP  70   8.525   7.137   2.565
  613    HE1  TRP  70           HE1      TRP  70   6.682   8.660   1.949
  614    HE3  TRP  70           HE3      TRP  70   9.479  11.019   5.706
  615    HZ2  TRP  70           HZ2      TRP  70   5.625  11.184   2.647
  616    HZ3  TRP  70           HZ3      TRP  70   7.999  13.013   5.705
  617    HH2  TRP  70           HH2      TRP  70   6.053  13.108   4.165
  618    H    GLU  71           HN       GLU  71  13.442   8.380   2.926
  619    HA   GLU  71           HA       GLU  71  14.878   6.428   4.523
  620   1HB   GLU  71          HB2       GLU  71  15.981   9.065   3.547
  621   2HB   GLU  71          HB1       GLU  71  16.875   7.591   3.900
  622   1HG   GLU  71          HG2       GLU  71  14.764   7.134   1.937
  623   2HG   GLU  71          HG1       GLU  71  15.914   8.355   1.395
  624    H    VAL  72           HN       VAL  72  15.415   6.513   6.638
  625    HA   VAL  72           HA       VAL  72  15.992   8.872   8.133
  626    HB   VAL  72           HB       VAL  72  13.722   9.530   8.083
  627   1HG1  VAL  72          HG11      VAL  72  12.126   7.452   9.010
  628   2HG1  VAL  72          HG12      VAL  72  13.246   6.649   7.911
  629   3HG1  VAL  72          HG13      VAL  72  12.255   7.987   7.335
  630   1HG2  VAL  72          HG21      VAL  72  13.726   7.854  10.595
  631   2HG2  VAL  72          HG22      VAL  72  13.063   9.470  10.351
  632   3HG2  VAL  72          HG23      VAL  72  14.810   9.236  10.418
  633    H    GLN  73           HN       GLN  73  17.516   7.936   9.413
  634    HA   GLN  73           HA       GLN  73  17.608   5.193  10.159
  635   1HB   GLN  73          HB2       GLN  73  18.865   7.593  11.517
  636   2HB   GLN  73          HB1       GLN  73  19.270   5.918  11.879
  637   1HG   GLN  73          HG2       GLN  73  20.733   5.925  10.172
  638   2HG   GLN  73          HG1       GLN  73  19.395   6.195   9.055
  639   1HE2  GLN  73          HE21      GLN  73  19.350   8.201   7.991
  640   2HE2  GLN  73          HE22      GLN  73  20.311   9.534   8.418
  641    H    GLY  74           HN       GLY  74  16.949   4.090  12.010
  642   1HA   GLY  74          HA2       GLY  74  16.070   4.024  14.295
  643   2HA   GLY  74          HA1       GLY  74  15.328   5.598  14.013
  644    H    ASP  75           HN       ASP  75  14.140   5.096  11.486
  645    HA   ASP  75           HA       ASP  75  12.558   2.681  11.427
  646   1HB   ASP  75          HB2       ASP  75  11.632   4.700  13.237
  647   2HB   ASP  75          HB1       ASP  75  10.525   4.647  11.869
  648    H    GLN  76           HN       GLN  76  10.680   3.018   9.699
  649    HA   GLN  76           HA       GLN  76  11.776   5.029   7.755
  650   1HB   GLN  76          HB2       GLN  76  11.962   2.835   6.852
  651   2HB   GLN  76          HB1       GLN  76  10.330   2.407   7.351
  652   1HG   GLN  76          HG2       GLN  76   9.340   3.673   5.645
  653   2HG   GLN  76          HG1       GLN  76  10.754   4.705   5.457
  654   1HE2  GLN  76          HE21      GLN  76  12.840   3.277   4.789
  655   2HE2  GLN  76          HE22      GLN  76  12.550   2.165   3.539
  656    H    LYS  77           HN       LYS  77  10.252   6.187   6.399
  657    HA   LYS  77           HA       LYS  77   7.555   6.543   7.701
  658   1HB   LYS  77          HB2       LYS  77   9.550   8.491   6.708
  659   2HB   LYS  77          HB1       LYS  77   7.873   8.826   6.279
  660   1HG   LYS  77          HG2       LYS  77   7.216   8.718   8.625
  661   2HG   LYS  77          HG1       LYS  77   8.861   8.279   9.089
  662   1HD   LYS  77          HD2       LYS  77   9.523  10.481   7.834
  663   2HD   LYS  77          HD1       LYS  77   7.829  10.912   8.065
  664   1HE   LYS  77          HE2       LYS  77   9.427   9.891  10.393
  665   2HE   LYS  77          HE1       LYS  77   9.592  11.573   9.893
  666   1HZ   LYS  77          HZ1       LYS  77   7.197  11.829  10.089
  667   2HZ   LYS  77          HZ2       LYS  77   7.877  11.326  11.562
  668   3HZ   LYS  77          HZ3       LYS  77   7.046  10.213  10.585
  669    H    CYS  78           HN       CYS  78   5.761   7.008   6.107
  670    HA   CYS  78           HA       CYS  78   6.523   6.292   3.338
  671   1HB   CYS  78          HB2       CYS  78   4.952   4.478   3.154
  672   2HB   CYS  78          HB1       CYS  78   6.003   4.160   4.532
  673    HG   CYS  78           HG       CYS  78   3.311   3.896   5.032
  674    H    ASP  79           HN       ASP  79   4.919   6.693   1.734
  675    HA   ASP  79           HA       ASP  79   2.773   8.631   2.740
  676   1HB   ASP  79          HB2       ASP  79   4.678   9.229   0.867
  677   2HB   ASP  79          HB1       ASP  79   3.455   8.512  -0.181
  678    H    ILE  80           HN       ILE  80   0.804   7.530   2.742
  679    HA   ILE  80           HA       ILE  80   0.609   5.274   0.794
  680    HB   ILE  80           HB       ILE  80  -0.921   4.185   2.392
  681   1HG1  ILE  80          HG12      ILE  80  -1.226   6.630   3.532
  682   2HG1  ILE  80          HG11      ILE  80  -1.565   5.122   4.373
  683   1HG2  ILE  80          HG21      ILE  80   0.910   3.699   4.081
  684   2HG2  ILE  80          HG22      ILE  80   1.879   4.897   3.220
  685   3HG2  ILE  80          HG23      ILE  80   1.310   3.454   2.384
  686   1HD1  ILE  80          HD11      ILE  80   1.151   6.456   4.442
  687   2HD1  ILE  80          HD12      ILE  80   0.560   5.154   5.475
  688   3HD1  ILE  80          HD13      ILE  80  -0.106   6.779   5.637
  689    H    ILE  81           HN       ILE  81  -1.363   4.519   0.188
  690    HA   ILE  81           HA       ILE  81  -3.556   6.558   0.017
  691    HB   ILE  81           HB       ILE  81  -4.186   5.524  -2.171
  692   1HG1  ILE  81          HG12      ILE  81  -1.743   4.301  -2.920
  693   2HG1  ILE  81          HG11      ILE  81  -2.182   3.603  -1.363
  694   1HG2  ILE  81          HG21      ILE  81  -2.625   7.535  -1.923
  695   2HG2  ILE  81          HG22      ILE  81  -2.554   6.680  -3.463
  696   3HG2  ILE  81          HG23      ILE  81  -1.300   6.417  -2.252
  697   1HD1  ILE  81          HD11      ILE  81  -3.631   3.474  -3.974
  698   2HD1  ILE  81          HD12      ILE  81  -4.591   3.488  -2.494
  699   3HD1  ILE  81          HD13      ILE  81  -3.396   2.218  -2.758
  700    H    TRP  82           HN       TRP  82  -5.260   5.827   1.177
  701    HA   TRP  82           HA       TRP  82  -5.313   2.968   1.916
  702   1HB   TRP  82          HB2       TRP  82  -6.899   3.635   3.684
  703   2HB   TRP  82          HB1       TRP  82  -5.399   4.543   3.762
  704    HD1  TRP  82           HD1      TRP  82  -7.153   6.070   0.990
  705    HE1  TRP  82           HE1      TRP  82  -8.468   8.152   1.724
  706    HE3  TRP  82           HE3      TRP  82  -7.145   5.382   6.051
  707    HZ2  TRP  82           HZ2      TRP  82  -9.398   9.371   4.132
  708    HZ3  TRP  82           HZ3      TRP  82  -8.257   7.021   7.540
  709    HH2  TRP  82           HH2      TRP  82  -9.383   9.014   6.588
  710    H    ARG  83           HN       ARG  83  -7.229   1.745   1.982
  711    HA   ARG  83           HA       ARG  83  -9.755   2.337   0.941
  712   1HB   ARG  83          HB2       ARG  83  -7.731   2.216  -1.128
  713   2HB   ARG  83          HB1       ARG  83  -8.892   0.907  -1.346
  714   1HG   ARG  83          HG2       ARG  83 -10.034   3.570  -0.683
  715   2HG   ARG  83          HG1       ARG  83  -9.310   3.410  -2.283
  716   1HD   ARG  83          HD2       ARG  83 -11.394   2.620  -2.815
  717   2HD   ARG  83          HD1       ARG  83 -10.717   1.108  -2.213
  718    HE   ARG  83           HE       ARG  83 -11.812   2.444   0.020
  719   1HH1  ARG  83          HH11      ARG  83 -12.663  -0.297  -0.659
  720   2HH1  ARG  83          HH12      ARG  83 -14.313  -0.088  -1.141
  721   1HH2  ARG  83          HH21      ARG  83 -14.023   3.344  -1.606
  722   2HH2  ARG  83          HH22      ARG  83 -15.085   1.977  -1.677
  723    H    TYR  84           HN       TYR  84 -10.648   0.118  -0.201
  724    HA   TYR  84           HA       TYR  84 -11.200  -2.120   0.148
  725   1HB   TYR  84          HB2       TYR  84  -8.438  -2.713   1.155
  726   2HB   TYR  84          HB1       TYR  84  -9.457  -3.655   0.071
  727    HD1  TYR  84           HD1      TYR  84 -10.156  -2.121  -2.143
  728    HD2  TYR  84           HD2      TYR  84  -6.536  -1.840   0.153
  729    HE1  TYR  84           HE1      TYR  84  -9.000  -1.110  -4.089
  730    HE2  TYR  84           HE2      TYR  84  -5.380  -0.831  -1.793
  731    HH   TYR  84           HH       TYR  84  -6.531   0.611  -4.069
  732    H    THR  85           HN       THR  85 -12.612  -2.037   1.883
  733    HA   THR  85           HA       THR  85 -11.840  -1.536   4.603
  734    HB   THR  85           HB       THR  85 -14.189  -1.357   3.731
  735    HG1  THR  85           HG1      THR  85 -14.243  -1.431   5.853
  736   1HG2  THR  85          HG21      THR  85 -14.034  -3.541   2.429
  737   2HG2  THR  85          HG22      THR  85 -15.517  -3.312   3.355
  738   3HG2  THR  85          HG23      THR  85 -14.251  -4.373   3.969
  739    H    LYS  86           HN       LYS  86 -12.017  -4.477   2.653
  740    HA   LYS  86           HA       LYS  86 -11.289  -6.170   4.974
  741   1HB   LYS  86          HB2       LYS  86 -12.858  -6.653   2.769
  742   2HB   LYS  86          HB1       LYS  86 -11.328  -7.381   2.282
  743   1HG   LYS  86          HG2       LYS  86 -11.374  -8.425   4.693
  744   2HG   LYS  86          HG1       LYS  86 -13.101  -8.082   4.605
  745   1HD   LYS  86          HD2       LYS  86 -12.945 -10.266   3.740
  746   2HD   LYS  86          HD1       LYS  86 -12.999  -9.260   2.293
  747   1HE   LYS  86          HE2       LYS  86 -10.270  -9.538   3.228
  748   2HE   LYS  86          HE1       LYS  86 -11.001 -11.123   2.982
  749   1HZ   LYS  86          HZ1       LYS  86 -11.686 -10.407   0.765
  750   2HZ   LYS  86          HZ2       LYS  86  -9.999 -10.327   0.950
  751   3HZ   LYS  86          HZ3       LYS  86 -10.929  -8.907   1.003
  752    H    THR  87           HN       THR  87  -9.468  -7.862   4.370
  753    HA   THR  87           HA       THR  87  -7.014  -6.423   4.022
  754    HB   THR  87           HB       THR  87  -6.001  -8.747   3.825
  755    HG1  THR  87           HG1      THR  87  -7.484 -10.065   3.063
  756   1HG2  THR  87          HG21      THR  87  -7.443  -7.530   6.033
  757   2HG2  THR  87          HG22      THR  87  -5.902  -8.388   6.044
  758   3HG2  THR  87          HG23      THR  87  -7.412  -9.287   6.184
  759    H    GLN  88           HN       GLN  88  -5.860  -5.932   2.212
  760    HA   GLN  88           HA       GLN  88  -6.540  -7.307  -0.344
  761   1HB   GLN  88          HB2       GLN  88  -7.440  -4.772   0.210
  762   2HB   GLN  88          HB1       GLN  88  -5.921  -4.438  -0.624
  763   1HG   GLN  88          HG2       GLN  88  -7.251  -6.559  -2.016
  764   2HG   GLN  88          HG1       GLN  88  -8.412  -5.256  -1.764
  765   1HE2  GLN  88          HE21      GLN  88  -8.433  -4.163  -3.759
  766   2HE2  GLN  88          HE22      GLN  88  -7.045  -3.578  -4.544
  767    H    VAL  89           HN       VAL  89  -4.148  -6.842   1.792
  768    HA   VAL  89           HA       VAL  89  -1.950  -5.805   0.283
  769    HB   VAL  89           HB       VAL  89  -1.897  -7.910   2.477
  770   1HG1  VAL  89          HG11      VAL  89   0.400  -6.803   2.852
  771   2HG1  VAL  89          HG12      VAL  89   0.202  -6.126   1.236
  772   3HG1  VAL  89          HG13      VAL  89   0.248  -7.874   1.460
  773   1HG2  VAL  89          HG21      VAL  89  -1.903  -4.881   2.548
  774   2HG2  VAL  89          HG22      VAL  89  -1.342  -5.858   3.904
  775   3HG2  VAL  89          HG23      VAL  89  -3.014  -5.982   3.361
  776    H    GLU  90           HN       GLU  90  -3.428  -9.015   0.462
  777    HA   GLU  90           HA       GLU  90  -1.411 -10.488  -0.932
  778   1HB   GLU  90          HB2       GLU  90  -4.400 -10.890  -0.663
  779   2HB   GLU  90          HB1       GLU  90  -3.349 -12.043  -1.488
  780   1HG   GLU  90          HG2       GLU  90  -1.994 -12.276   0.569
  781   2HG   GLU  90          HG1       GLU  90  -3.061 -11.139   1.394
  782    H    TRP  91           HN       TRP  91  -4.393  -8.897  -2.157
  783    HA   TRP  91           HA       TRP  91  -4.122  -9.547  -4.893
  784   1HB   TRP  91          HB2       TRP  91  -6.007  -8.241  -3.641
  785   2HB   TRP  91          HB1       TRP  91  -5.042  -6.817  -4.012
  786    HD1  TRP  91           HD1      TRP  91  -4.217  -8.637  -6.874
  787    HE1  TRP  91           HE1      TRP  91  -5.838  -8.267  -8.842
  788    HE3  TRP  91           HE3      TRP  91  -8.199  -6.644  -4.374
  789    HZ2  TRP  91           HZ2      TRP  91  -8.477  -7.259  -9.298
  790    HZ3  TRP  91           HZ3      TRP  91 -10.251  -5.988  -5.598
  791    HH2  TRP  91           HH2      TRP  91 -10.396  -6.293  -8.054
  792    H    LEU  92           HN       LEU  92  -2.868  -6.671  -3.172
  793    HA   LEU  92           HA       LEU  92  -1.474  -5.535  -5.391
  794   1HB   LEU  92          HB2       LEU  92  -0.993  -5.357  -2.406
  795   2HB   LEU  92          HB1       LEU  92  -0.104  -4.395  -3.586
  796    HG   LEU  92           HG       LEU  92  -3.018  -4.313  -3.966
  797   1HD1  LEU  92          HD11      LEU  92  -2.541  -4.436  -1.376
  798   2HD1  LEU  92          HD12      LEU  92  -3.646  -3.214  -2.002
  799   3HD1  LEU  92          HD13      LEU  92  -1.987  -2.776  -1.597
  800   1HD2  LEU  92          HD21      LEU  92  -0.903  -2.171  -3.557
  801   2HD2  LEU  92          HD22      LEU  92  -2.530  -1.914  -4.189
  802   3HD2  LEU  92          HD23      LEU  92  -1.362  -2.856  -5.117
  803    H    LYS  93           HN       LYS  93  -0.479  -7.919  -2.939
  804    HA   LYS  93           HA       LYS  93   2.284  -8.069  -3.717
  805   1HB   LYS  93          HB2       LYS  93   0.414  -9.799  -2.142
  806   2HB   LYS  93          HB1       LYS  93   1.947 -10.489  -2.675
  807   1HG   LYS  93          HG2       LYS  93   1.933  -7.785  -1.369
  808   2HG   LYS  93          HG1       LYS  93   1.817  -9.231  -0.365
  809   1HD   LYS  93          HD2       LYS  93   3.843 -10.035  -1.881
  810   2HD   LYS  93          HD1       LYS  93   4.078  -8.300  -2.092
  811   1HE   LYS  93          HE2       LYS  93   3.627  -9.341   0.677
  812   2HE   LYS  93          HE1       LYS  93   5.208  -9.589  -0.061
  813   1HZ   LYS  93          HZ1       LYS  93   3.815  -7.016   0.413
  814   2HZ   LYS  93          HZ2       LYS  93   5.187  -7.156  -0.579
  815   3HZ   LYS  93          HZ3       LYS  93   5.286  -7.536   1.072
  816    H    ARG  94           HN       ARG  94  -0.623  -9.796  -4.806
  817    HA   ARG  94           HA       ARG  94   0.574 -11.792  -6.405
  818   1HB   ARG  94          HB2       ARG  94  -2.050 -10.448  -6.271
  819   2HB   ARG  94          HB1       ARG  94  -1.644 -11.037  -7.879
  820   1HG   ARG  94          HG2       ARG  94  -2.881 -12.737  -6.590
  821   2HG   ARG  94          HG1       ARG  94  -1.256 -13.291  -6.970
  822   1HD   ARG  94          HD2       ARG  94  -0.838 -13.581  -4.776
  823   2HD   ARG  94          HD1       ARG  94  -1.146 -11.869  -4.489
  824    HE   ARG  94           HE       ARG  94  -3.193 -12.513  -3.533
  825   1HH1  ARG  94          HH21      ARG  94  -1.992 -15.414  -3.704
  826   2HH1  ARG  94          HH22      ARG  94  -3.359 -16.254  -4.359
  827   1HH2  ARG  94          HH11      ARG  94  -5.034 -13.352  -5.285
  828   2HH2  ARG  94          HH12      ARG  94  -5.086 -15.082  -5.257
  829    H    LYS  95           HN       LYS  95  -0.553  -8.590  -7.381
  830    HA   LYS  95           HA       LYS  95   0.583  -8.604 -10.005
  831   1HB   LYS  95          HB2       LYS  95  -0.796  -6.721  -8.286
  832   2HB   LYS  95          HB1       LYS  95   0.560  -5.935  -9.096
  833   1HG   LYS  95          HG2       LYS  95  -0.287  -7.024 -11.254
  834   2HG   LYS  95          HG1       LYS  95  -1.763  -7.397 -10.364
  835   1HD   LYS  95          HD2       LYS  95  -0.810  -4.597 -10.139
  836   2HD   LYS  95          HD1       LYS  95  -1.386  -5.079 -11.733
  837   1HE   LYS  95          HE2       LYS  95  -3.351  -4.337 -10.689
  838   2HE   LYS  95          HE1       LYS  95  -3.416  -6.080 -10.435
  839   1HZ   LYS  95          HZ1       LYS  95  -2.699  -5.851  -8.232
  840   2HZ   LYS  95          HZ2       LYS  95  -3.848  -4.618  -8.438
  841   3HZ   LYS  95          HZ3       LYS  95  -2.190  -4.248  -8.458
  842    H    GLY  96           HN       GLY  96   1.948  -8.050  -6.838
  843   1HA   GLY  96          HA2       GLY  96   4.166  -6.418  -7.532
  844   2HA   GLY  96          HA1       GLY  96   4.115  -7.502  -6.148
  845    H    TYR  97           HN       TYR  97   4.216 -10.005  -7.048
  846    HA   TYR  97           HA       TYR  97   6.872 -10.158  -8.228
  847   1HB   TYR  97          HB2       TYR  97   6.355 -12.676  -8.344
  848   2HB   TYR  97          HB1       TYR  97   6.435 -11.915  -6.767
  849    HD1  TYR  97           HD1      TYR  97   4.131 -13.217  -9.352
  850    HD2  TYR  97           HD2      TYR  97   4.545 -11.755  -5.342
  851    HE1  TYR  97           HE1      TYR  97   1.856 -14.017  -8.823
  852    HE2  TYR  97           HE2      TYR  97   2.268 -12.548  -4.808
  853    HH   TYR  97           HH       TYR  97   0.778 -14.706  -6.064
  854    H    LEU  98           HN       LEU  98   3.615 -10.687  -9.473
  855    HA   LEU  98           HA       LEU  98   4.209 -11.790 -11.992
  856   1HB   LEU  98          HB2       LEU  98   1.942 -11.680 -11.272
  857   2HB   LEU  98          HB1       LEU  98   2.028  -9.938 -11.025
  858    HG   LEU  98           HG       LEU  98   2.380  -9.672 -13.496
  859   1HD1  LEU  98          HD11      LEU  98   1.815 -12.648 -13.411
  860   2HD1  LEU  98          HD12      LEU  98   3.248 -11.853 -14.063
  861   3HD1  LEU  98          HD13      LEU  98   1.694 -11.677 -14.878
  862   1HD2  LEU  98          HD21      LEU  98  -0.008 -10.246 -14.049
  863   2HD2  LEU  98          HD22      LEU  98   0.176  -9.342 -12.547
  864   3HD2  LEU  98          HD23      LEU  98  -0.111 -11.081 -12.499
  865    H    ASP  99           HN       ASP  99   3.823  -8.313 -11.187
  866    HA   ASP  99           HA       ASP  99   4.576  -7.335 -13.777
  867   1HB   ASP  99          HB2       ASP  99   3.422  -6.097 -11.789
  868   2HB   ASP  99          HB1       ASP  99   5.068  -5.796 -11.232
  869    H    GLU 100           HN       GLU 100   6.466  -7.908 -10.799
  870    HA   GLU 100           HA       GLU 100   8.954  -6.866 -11.741
  871   1HB   GLU 100          HB2       GLU 100   8.303  -7.581  -9.349
  872   2HB   GLU 100          HB1       GLU 100   8.701  -9.221  -9.862
  873   1HG   GLU 100          HG2       GLU 100  10.771  -7.307 -10.630
  874   2HG   GLU 100          HG1       GLU 100  10.502  -7.328  -8.888
  875    H    LEU 101           HN       LEU 101   7.624 -10.184 -11.834
  876    HA   LEU 101           HA       LEU 101   9.908 -11.166 -13.388
  877   1HB   LEU 101          HB2       LEU 101   7.970 -12.352 -11.749
  878   2HB   LEU 101          HB1       LEU 101   7.565 -12.907 -13.372
  879    HG   LEU 101           HG       LEU 101   9.154 -14.458 -12.346
  880   1HD1  LEU 101          HD11      LEU 101  10.704 -14.576 -14.134
  881   2HD1  LEU 101          HD12      LEU 101  10.726 -12.825 -14.342
  882   3HD1  LEU 101          HD13      LEU 101   9.306 -13.752 -14.825
  883   1HD2  LEU 101          HD21      LEU 101  11.059 -12.103 -12.174
  884   2HD2  LEU 101          HD22      LEU 101  11.349 -13.747 -11.607
  885   3HD2  LEU 101          HD23      LEU 101  10.155 -12.734 -10.798
  886    H    LEU 102           HN       LEU 102   9.748  -9.744 -15.227
  887    HA   LEU 102           HA       LEU 102   8.112 -10.815 -17.381
  888   1HB   LEU 102          HB2       LEU 102   6.655  -9.113 -15.970
  889   2HB   LEU 102          HB1       LEU 102   7.586  -7.905 -16.856
  890    HG   LEU 102           HG       LEU 102   6.951  -9.442 -18.933
  891   1HD1  LEU 102          HD11      LEU 102   4.800 -10.500 -18.714
  892   2HD1  LEU 102          HD12      LEU 102   4.583  -9.854 -17.088
  893   3HD1  LEU 102          HD13      LEU 102   5.801 -11.093 -17.389
  894   1HD2  LEU 102          HD21      LEU 102   4.999  -7.531 -17.604
  895   2HD2  LEU 102          HD22      LEU 102   5.002  -7.977 -19.311
  896   3HD2  LEU 102          HD23      LEU 102   6.349  -7.059 -18.637
  Start of MODEL    7
    1   1H    MET   1          HT1       MET   1 -24.895 -12.605 -16.403
    2   2H    MET   1          HT2       MET   1 -24.245 -12.550 -17.971
    3   3H    MET   1          HT3       MET   1 -23.230 -12.372 -16.621
    4    HA   MET   1           HA       MET   1 -23.766 -14.654 -15.928
    5   1HB   MET   1          HB2       MET   1 -25.356 -14.502 -18.490
    6   2HB   MET   1          HB1       MET   1 -24.776 -16.047 -17.869
    7   1HG   MET   1          HG2       MET   1 -26.655 -16.077 -16.608
    8   2HG   MET   1          HG1       MET   1 -25.874 -14.839 -15.625
    9   1HE   MET   1          HE1       MET   1 -28.820 -14.348 -19.059
   10   2HE   MET   1          HE2       MET   1 -29.134 -15.507 -17.769
   11   3HE   MET   1          HE3       MET   1 -27.668 -15.650 -18.735
   12    H    ALA   2           HN       ALA   2 -21.737 -15.451 -16.087
   13    HA   ALA   2           HA       ALA   2 -19.648 -16.042 -16.958
   14   1HB   ALA   2          HB1       ALA   2 -19.651 -17.155 -19.077
   15   2HB   ALA   2          HB2       ALA   2 -21.068 -16.260 -19.624
   16   3HB   ALA   2          HB3       ALA   2 -21.230 -17.479 -18.361
   17    H    GLU   3           HN       GLU   3 -19.716 -13.415 -16.611
   18    HA   GLU   3           HA       GLU   3 -19.090 -12.023 -19.150
   19   1HB   GLU   3          HB2       GLU   3 -20.237 -11.223 -16.718
   20   2HB   GLU   3          HB1       GLU   3 -18.645 -10.466 -16.735
   21   1HG   GLU   3          HG2       GLU   3 -19.101  -9.547 -18.982
   22   2HG   GLU   3          HG1       GLU   3 -20.696 -10.299 -18.964
   23    H    GLN   4           HN       GLN   4 -17.088 -10.583 -19.119
   24    HA   GLN   4           HA       GLN   4 -14.767 -10.354 -19.024
   25   1HB   GLN   4          HB2       GLN   4 -15.472 -10.497 -16.459
   26   2HB   GLN   4          HB1       GLN   4 -14.601 -12.028 -16.546
   27   1HG   GLN   4          HG2       GLN   4 -12.766 -10.569 -17.759
   28   2HG   GLN   4          HG1       GLN   4 -13.568  -9.236 -16.928
   29   1HE2  GLN   4          HE21      GLN   4 -11.900 -12.353 -16.349
   30   2HE2  GLN   4          HE22      GLN   4 -11.494 -12.017 -14.736
   31    H    GLN   5           HN       GLN   5 -14.677 -11.764 -20.905
   32    HA   GLN   5           HA       GLN   5 -13.507 -14.450 -20.281
   33   1HB   GLN   5          HB2       GLN   5 -15.473 -13.616 -22.406
   34   2HB   GLN   5          HB1       GLN   5 -14.420 -15.007 -22.663
   35   1HG   GLN   5          HG2       GLN   5 -15.236 -16.006 -20.547
   36   2HG   GLN   5          HG1       GLN   5 -16.318 -14.630 -20.327
   37   1HE2  GLN   5          HE21      GLN   5 -15.613 -17.320 -22.611
   38   2HE2  GLN   5          HE22      GLN   5 -17.194 -17.414 -23.222
   39    H    GLN   6           HN       GLN   6 -13.589 -11.772 -22.654
   40    HA   GLN   6           HA       GLN   6 -11.326 -12.605 -24.188
   41   1HB   GLN   6          HB2       GLN   6 -13.134 -10.610 -24.446
   42   2HB   GLN   6          HB1       GLN   6 -11.772  -9.687 -23.814
   43   1HG   GLN   6          HG2       GLN   6 -10.892 -11.561 -25.852
   44   2HG   GLN   6          HG1       GLN   6 -12.157 -10.503 -26.476
   45   1HE2  GLN   6          HE21      GLN   6  -9.039 -10.575 -26.794
   46   2HE2  GLN   6          HE22      GLN   6  -8.588  -8.963 -26.511
   47    H    GLU   7           HN       GLU   7  -9.124 -11.805 -24.110
   48    HA   GLU   7           HA       GLU   7  -7.922 -11.809 -21.538
   49   1HB   GLU   7          HB2       GLU   7  -5.879 -10.943 -22.714
   50   2HB   GLU   7          HB1       GLU   7  -6.598 -12.347 -23.499
   51   1HG   GLU   7          HG2       GLU   7  -6.876 -11.180 -25.402
   52   2HG   GLU   7          HG1       GLU   7  -7.827  -9.967 -24.548
   53    H    GLN   8           HN       GLN   8  -7.745 -10.253 -20.011
   54    HA   GLN   8           HA       GLN   8  -7.866  -7.390 -20.813
   55   1HB   GLN   8          HB2       GLN   8  -9.742  -8.804 -18.921
   56   2HB   GLN   8          HB1       GLN   8  -9.416  -7.079 -18.753
   57   1HG   GLN   8          HG2       GLN   8  -9.910  -7.143 -21.394
   58   2HG   GLN   8          HG1       GLN   8 -10.883  -8.530 -20.904
   59   1HE2  GLN   8          HE21      GLN   8 -10.473  -5.018 -20.425
   60   2HE2  GLN   8          HE22      GLN   8 -12.009  -4.766 -19.749
   61    H    GLN   9           HN       GLN   9  -6.609  -6.069 -19.516
   62    HA   GLN   9           HA       GLN   9  -5.135  -7.408 -17.280
   63   1HB   GLN   9          HB2       GLN   9  -4.298  -5.782 -19.534
   64   2HB   GLN   9          HB1       GLN   9  -3.735  -5.119 -18.003
   65   1HG   GLN   9          HG2       GLN   9  -2.849  -7.361 -17.384
   66   2HG   GLN   9          HG1       GLN   9  -3.344  -7.966 -18.963
   67   1HE2  GLN   9          HE21      GLN   9  -0.815  -6.331 -17.266
   68   2HE2  GLN   9          HE22      GLN   9   0.129  -5.930 -18.618
   69    H    ILE  10           HN       ILE  10  -7.705  -5.818 -17.331
   70    HA   ILE  10           HA       ILE  10  -7.499  -3.259 -16.209
   71    HB   ILE  10           HB       ILE  10  -9.716  -3.520 -15.354
   72   1HG1  ILE  10          HG12      ILE  10  -9.224  -5.682 -14.120
   73   2HG1  ILE  10          HG11      ILE  10 -10.792  -5.627 -14.917
   74   1HG2  ILE  10          HG21      ILE  10  -9.593  -5.400 -17.718
   75   2HG2  ILE  10          HG22      ILE  10  -9.358  -3.660 -17.867
   76   3HG2  ILE  10          HG23      ILE  10 -10.893  -4.295 -17.277
   77   1HD1  ILE  10          HD11      ILE  10  -9.621  -6.782 -16.906
   78   2HD1  ILE  10          HD12      ILE  10  -9.924  -7.759 -15.471
   79   3HD1  ILE  10          HD13      ILE  10  -8.311  -7.119 -15.776
   80    H    ARG  11           HN       ARG  11  -6.756  -6.324 -14.693
   81    HA   ARG  11           HA       ARG  11  -6.902  -5.405 -11.947
   82   1HB   ARG  11          HB2       ARG  11  -5.324  -7.706 -13.146
   83   2HB   ARG  11          HB1       ARG  11  -5.679  -7.479 -11.433
   84   1HG   ARG  11          HG2       ARG  11  -8.165  -7.422 -12.166
   85   2HG   ARG  11          HG1       ARG  11  -7.589  -8.136 -13.672
   86   1HD   ARG  11          HD2       ARG  11  -7.118 -10.146 -12.694
   87   2HD   ARG  11          HD1       ARG  11  -6.570  -9.402 -11.193
   88    HE   ARG  11           HE       ARG  11  -8.789  -9.536 -10.364
   89   1HH1  ARG  11          HH11      ARG  11 -10.339  -8.324 -12.529
   90   2HH1  ARG  11          HH12      ARG  11 -11.220  -9.658 -13.194
   91   1HH2  ARG  11          HH21      ARG  11  -9.180 -12.070 -11.745
   92   2HH2  ARG  11          HH22      ARG  11 -10.562 -11.785 -12.749
   93    H    VAL  12           HN       VAL  12  -4.127  -6.467 -11.308
   94    HA   VAL  12           HA       VAL  12  -2.760  -3.974 -11.164
   95    HB   VAL  12           HB       VAL  12  -0.698  -5.430 -10.713
   96   1HG1  VAL  12          HG11      VAL  12  -1.704  -4.692  -8.776
   97   2HG1  VAL  12          HG12      VAL  12  -1.948  -6.429  -8.600
   98   3HG1  VAL  12          HG13      VAL  12  -3.263  -5.409  -9.183
   99   1HG2  VAL  12          HG21      VAL  12  -1.858  -7.370 -12.054
  100   2HG2  VAL  12          HG22      VAL  12  -2.658  -7.701 -10.517
  101   3HG2  VAL  12          HG23      VAL  12  -0.898  -7.755 -10.626
  102    H    ARG  13           HN       ARG  13  -0.305  -3.999 -12.037
  103    HA   ARG  13           HA       ARG  13   0.040  -4.990 -14.754
  104   1HB   ARG  13          HB2       ARG  13  -1.409  -2.591 -14.486
  105   2HB   ARG  13          HB1       ARG  13   0.214  -2.101 -14.972
  106   1HG   ARG  13          HG2       ARG  13  -1.126  -4.390 -16.386
  107   2HG   ARG  13          HG1       ARG  13  -1.553  -2.733 -16.813
  108   1HD   ARG  13          HD2       ARG  13   1.219  -2.659 -16.707
  109   2HD   ARG  13          HD1       ARG  13   0.886  -4.239 -17.417
  110    HE   ARG  13           HE       ARG  13   0.162  -1.621 -18.606
  111   1HH1  ARG  13          HH11      ARG  13   1.804  -3.764 -19.980
  112   2HH1  ARG  13          HH12      ARG  13   0.643  -4.450 -21.066
  113   1HH2  ARG  13          HH21      ARG  13  -2.094  -3.060 -19.437
  114   2HH2  ARG  13          HH22      ARG  13  -1.571  -4.050 -20.758
  115    H    ILE  14           HN       ILE  14   1.072  -2.452 -12.442
  116    HA   ILE  14           HA       ILE  14   3.700  -2.065 -13.370
  117    HB   ILE  14           HB       ILE  14   4.243  -1.518 -10.935
  118   1HG1  ILE  14          HG12      ILE  14   1.321  -1.639 -10.350
  119   2HG1  ILE  14          HG11      ILE  14   2.197  -3.169 -10.306
  120   1HG2  ILE  14          HG21      ILE  14   1.733  -0.226 -12.036
  121   2HG2  ILE  14          HG22      ILE  14   3.353   0.104 -12.650
  122   3HG2  ILE  14          HG23      ILE  14   2.939   0.514 -10.985
  123   1HD1  ILE  14          HD11      ILE  14   2.948  -2.629  -8.256
  124   2HD1  ILE  14          HD12      ILE  14   2.193  -1.039  -8.362
  125   3HD1  ILE  14          HD13      ILE  14   3.831  -1.280  -8.970
  126    HA   PRO  15           HA       PRO  15   5.477  -6.055 -12.574
  127   1HB   PRO  15          HB2       PRO  15   7.999  -5.391 -13.444
  128   2HB   PRO  15          HB1       PRO  15   6.652  -5.763 -14.533
  129   1HG   PRO  15          HG2       PRO  15   7.865  -3.118 -13.887
  130   2HG   PRO  15          HG1       PRO  15   7.010  -3.632 -15.350
  131   1HD   PRO  15          HD2       PRO  15   5.927  -2.054 -13.265
  132   2HD   PRO  15          HD1       PRO  15   5.008  -2.848 -14.561
  133    H    ARG  16           HN       ARG  16   7.094  -6.968 -11.118
  134    HA   ARG  16           HA       ARG  16   7.612  -5.289  -8.765
  135   1HB   ARG  16          HB2       ARG  16   6.897  -7.737  -8.684
  136   2HB   ARG  16          HB1       ARG  16   8.525  -8.141  -9.227
  137   1HG   ARG  16          HG2       ARG  16   9.432  -6.857  -7.267
  138   2HG   ARG  16          HG1       ARG  16   7.775  -6.654  -6.694
  139   1HD   ARG  16          HD2       ARG  16   8.443  -8.571  -5.538
  140   2HD   ARG  16          HD1       ARG  16   7.654  -9.264  -6.954
  141    HE   ARG  16           HE       ARG  16  10.587  -9.165  -6.487
  142   1HH1  ARG  16          HH11      ARG  16   8.840 -11.652  -6.967
  143   2HH1  ARG  16          HH12      ARG  16   9.278 -12.043  -8.596
  144   1HH2  ARG  16          HH21      ARG  16  10.743  -8.956  -9.225
  145   2HH2  ARG  16          HH22      ARG  16  10.357 -10.513  -9.877
  146    H    LYS  17           HN       LYS  17   9.057  -3.805  -9.999
  147    HA   LYS  17           HA       LYS  17  11.839  -4.900 -10.197
  148   1HB   LYS  17          HB2       LYS  17  10.352  -3.889 -12.283
  149   2HB   LYS  17          HB1       LYS  17  11.257  -2.470 -11.756
  150   1HG   LYS  17          HG2       LYS  17  13.358  -3.622 -12.017
  151   2HG   LYS  17          HG1       LYS  17  12.540  -5.159 -12.298
  152   1HD   LYS  17          HD2       LYS  17  12.931  -4.561 -14.490
  153   2HD   LYS  17          HD1       LYS  17  11.382  -3.751 -14.256
  154   1HE   LYS  17          HE2       LYS  17  13.762  -2.192 -13.426
  155   2HE   LYS  17          HE1       LYS  17  13.618  -2.486 -15.157
  156   1HZ   LYS  17          HZ1       LYS  17  11.302  -1.659 -15.001
  157   2HZ   LYS  17          HZ2       LYS  17  12.469  -0.481 -14.632
  158   3HZ   LYS  17          HZ3       LYS  17  11.593  -1.232 -13.386
  159    H    GLU  18           HN       GLU  18  10.088  -3.226  -8.114
  160    HA   GLU  18           HA       GLU  18  10.457  -1.488  -6.602
  161   1HB   GLU  18          HB2       GLU  18  13.340  -2.159  -7.279
  162   2HB   GLU  18          HB1       GLU  18  12.805  -1.236  -5.878
  163   1HG   GLU  18          HG2       GLU  18  12.798  -3.262  -4.837
  164   2HG   GLU  18          HG1       GLU  18  11.240  -3.458  -5.640
  165    H    GLU  19           HN       GLU  19   9.540  -0.200  -8.543
  166    HA   GLU  19           HA       GLU  19  11.349   1.444 -10.093
  167   1HB   GLU  19          HB2       GLU  19   8.374   1.527  -9.565
  168   2HB   GLU  19          HB1       GLU  19   9.178   2.773 -10.522
  169   1HG   GLU  19          HG2       GLU  19   8.743   1.345 -12.254
  170   2HG   GLU  19          HG1       GLU  19  10.207   0.543 -11.686
  171    H    ASN  20           HN       ASN  20   8.974   2.457  -7.592
  172    HA   ASN  20           HA       ASN  20  10.895   4.003  -6.098
  173   1HB   ASN  20          HB2       ASN  20  10.654   5.369  -8.239
  174   2HB   ASN  20          HB1       ASN  20   8.982   5.660  -7.761
  175   1HD2  ASN  20          HD21      ASN  20  12.371   6.234  -6.774
  176   2HD2  ASN  20          HD22      ASN  20  12.015   7.510  -5.714
  177    H    GLU  21           HN       GLU  21   7.454   3.911  -7.081
  178    HA   GLU  21           HA       GLU  21   6.520   4.827  -4.490
  179   1HB   GLU  21          HB2       GLU  21   5.332   4.070  -7.068
  180   2HB   GLU  21          HB1       GLU  21   4.346   3.612  -5.678
  181   1HG   GLU  21          HG2       GLU  21   5.489   6.384  -6.147
  182   2HG   GLU  21          HG1       GLU  21   3.827   5.912  -6.497
  183    H    ILE  22           HN       ILE  22   5.465   3.621  -2.880
  184    HA   ILE  22           HA       ILE  22   6.050   0.686  -2.892
  185    HB   ILE  22           HB       ILE  22   6.317   2.862  -0.918
  186   1HG1  ILE  22          HG12      ILE  22   7.885   1.139   0.083
  187   2HG1  ILE  22          HG11      ILE  22   7.447   0.075  -1.252
  188   1HG2  ILE  22          HG21      ILE  22   5.043   0.244  -0.115
  189   2HG2  ILE  22          HG22      ILE  22   4.348   1.852   0.058
  190   3HG2  ILE  22          HG23      ILE  22   5.754   1.395   1.017
  191   1HD1  ILE  22          HD11      ILE  22   9.270   1.102  -2.216
  192   2HD1  ILE  22          HD12      ILE  22   9.067   2.577  -1.272
  193   3HD1  ILE  22          HD13      ILE  22   8.037   2.277  -2.670
  194    H    LEU  23           HN       LEU  23   4.281  -0.696  -1.863
  195    HA   LEU  23           HA       LEU  23   1.612   0.768  -1.886
  196   1HB   LEU  23          HB2       LEU  23   1.577  -2.053  -2.805
  197   2HB   LEU  23          HB1       LEU  23   0.632  -0.681  -3.365
  198    HG   LEU  23           HG       LEU  23   3.581  -0.830  -3.964
  199   1HD1  LEU  23          HD11      LEU  23   2.614  -2.970  -4.714
  200   2HD1  LEU  23          HD12      LEU  23   3.040  -1.952  -6.087
  201   3HD1  LEU  23          HD13      LEU  23   1.356  -2.096  -5.587
  202   1HD2  LEU  23          HD21      LEU  23   1.774   0.185  -6.007
  203   2HD2  LEU  23          HD22      LEU  23   3.130   0.992  -5.219
  204   3HD2  LEU  23          HD23      LEU  23   1.532   1.019  -4.472
  205    H    GLY  24           HN       GLY  24   0.436   0.373   0.095
  206   1HA   GLY  24          HA2       GLY  24   1.120  -2.213   1.418
  207   2HA   GLY  24          HA1       GLY  24   1.376  -0.731   2.314
  208    H    ILE  25           HN       ILE  25  -0.192  -2.791   3.224
  209    HA   ILE  25           HA       ILE  25  -3.009  -1.872   2.937
  210    HB   ILE  25           HB       ILE  25  -2.558  -4.321   2.759
  211   1HG1  ILE  25          HG12      ILE  25  -4.639  -3.179   3.951
  212   2HG1  ILE  25          HG11      ILE  25  -4.449  -4.928   3.948
  213   1HG2  ILE  25          HG21      ILE  25  -1.923  -5.521   4.892
  214   2HG2  ILE  25          HG22      ILE  25  -1.482  -3.953   5.563
  215   3HG2  ILE  25          HG23      ILE  25  -0.626  -4.580   4.155
  216   1HD1  ILE  25          HD11      ILE  25  -4.988  -3.754   6.205
  217   2HD1  ILE  25          HD12      ILE  25  -3.294  -3.270   6.186
  218   3HD1  ILE  25          HD13      ILE  25  -3.721  -4.979   6.187
  219    H    ILE  26           HN       ILE  26  -3.958  -0.753   4.626
  220    HA   ILE  26           HA       ILE  26  -2.159  -0.122   6.907
  221    HB   ILE  26           HB       ILE  26  -3.133   1.690   5.355
  222   1HG1  ILE  26          HG12      ILE  26  -3.589   3.212   7.323
  223   2HG1  ILE  26          HG11      ILE  26  -3.472   1.798   8.366
  224   1HG2  ILE  26          HG21      ILE  26  -5.378   2.355   5.670
  225   2HG2  ILE  26          HG22      ILE  26  -5.551   1.378   7.129
  226   3HG2  ILE  26          HG23      ILE  26  -5.463   0.597   5.550
  227   1HD1  ILE  26          HD11      ILE  26  -1.303   2.884   6.551
  228   2HD1  ILE  26          HD12      ILE  26  -1.180   1.381   7.464
  229   3HD1  ILE  26          HD13      ILE  26  -1.311   2.916   8.312
  230    H    GLU  27           HN       GLU  27  -2.889   0.040   8.969
  231    HA   GLU  27           HA       GLU  27  -5.496  -1.144   9.723
  232   1HB   GLU  27          HB2       GLU  27  -4.239  -2.466  11.536
  233   2HB   GLU  27          HB1       GLU  27  -4.117  -3.087   9.892
  234   1HG   GLU  27          HG2       GLU  27  -2.035  -1.125  10.423
  235   2HG   GLU  27          HG1       GLU  27  -1.983  -2.439  11.596
  236    H    GLN  28           HN       GLN  28  -6.292  -0.236  11.649
  237    HA   GLN  28           HA       GLN  28  -4.525   1.736  13.041
  238   1HB   GLN  28          HB2       GLN  28  -6.340   2.655  11.364
  239   2HB   GLN  28          HB1       GLN  28  -7.459   2.284  12.675
  240   1HG   GLN  28          HG2       GLN  28  -6.095   3.657  14.220
  241   2HG   GLN  28          HG1       GLN  28  -5.002   4.051  12.893
  242   1HE2  GLN  28          HE21      GLN  28  -8.381   4.464  14.014
  243   2HE2  GLN  28          HE22      GLN  28  -8.703   5.820  13.046
  244    H    MET  29           HN       MET  29  -4.249   0.744  15.000
  245    HA   MET  29           HA       MET  29  -6.547  -0.626  16.289
  246   1HB   MET  29          HB2       MET  29  -3.577  -0.638  16.668
  247   2HB   MET  29          HB1       MET  29  -4.594  -1.035  18.052
  248   1HG   MET  29          HG2       MET  29  -4.207  -3.123  17.011
  249   2HG   MET  29          HG1       MET  29  -5.813  -2.657  16.451
  250   1HE   MET  29          HE1       MET  29  -5.721  -2.558  12.863
  251   2HE   MET  29          HE2       MET  29  -6.521  -2.079  14.357
  252   3HE   MET  29          HE3       MET  29  -6.109  -3.770  14.091
  253    H    LEU  30           HN       LEU  30  -4.167   1.952  17.032
  254    HA   LEU  30           HA       LEU  30  -5.729   2.756  19.405
  255   1HB   LEU  30          HB2       LEU  30  -3.118   3.667  18.189
  256   2HB   LEU  30          HB1       LEU  30  -3.902   4.589  19.472
  257    HG   LEU  30           HG       LEU  30  -3.674   1.667  19.940
  258   1HD1  LEU  30          HD11      LEU  30  -1.485   2.122  18.935
  259   2HD1  LEU  30          HD12      LEU  30  -1.309   1.887  20.674
  260   3HD1  LEU  30          HD13      LEU  30  -1.267   3.514  19.995
  261   1HD2  LEU  30          HD21      LEU  30  -2.988   4.066  21.667
  262   2HD2  LEU  30          HD22      LEU  30  -3.283   2.414  22.212
  263   3HD2  LEU  30          HD23      LEU  30  -4.606   3.375  21.551
  264    H    GLY  31           HN       GLY  31  -4.630   4.338  16.368
  265   1HA   GLY  31          HA2       GLY  31  -5.887   5.798  14.980
  266   2HA   GLY  31          HA1       GLY  31  -7.211   5.726  16.142
  267    H    ALA  32           HN       ALA  32  -4.012   7.159  15.574
  268    HA   ALA  32           HA       ALA  32  -4.850   9.479  17.264
  269   1HB   ALA  32          HB1       ALA  32  -2.552   9.670  18.101
  270   2HB   ALA  32          HB2       ALA  32  -2.065   8.277  17.136
  271   3HB   ALA  32          HB3       ALA  32  -3.191   8.069  18.478
  272    H    SER  33           HN       SER  33  -5.352   9.597  14.622
  273    HA   SER  33           HA       SER  33  -5.014  10.967  12.756
  274   1HB   SER  33          HB2       SER  33  -3.605  12.277  14.876
  275   2HB   SER  33          HB1       SER  33  -2.630  12.390  13.413
  276    HG   SER  33           HG       SER  33  -4.147  13.563  12.484
  277    H    ARG  34           HN       ARG  34  -3.057   8.507  13.636
  278    HA   ARG  34           HA       ARG  34  -1.545   8.635  11.079
  279   1HB   ARG  34          HB2       ARG  34   0.495   7.779  12.221
  280   2HB   ARG  34          HB1       ARG  34   0.046   9.388  12.786
  281   1HG   ARG  34          HG2       ARG  34  -1.345   7.904  14.561
  282   2HG   ARG  34          HG1       ARG  34  -0.024   6.784  14.225
  283   1HD   ARG  34          HD2       ARG  34   1.116   9.380  14.513
  284   2HD   ARG  34          HD1       ARG  34   0.014   9.135  15.866
  285    HE   ARG  34           HE       ARG  34   1.349   7.238  16.559
  286   1HH1  ARG  34          HH11      ARG  34   3.542   9.181  16.253
  287   2HH1  ARG  34          HH12      ARG  34   4.656   8.359  15.212
  288   1HH2  ARG  34          HH21      ARG  34   2.325   6.021  14.125
  289   2HH2  ARG  34          HH22      ARG  34   3.966   6.565  14.004
  290    H    VAL  35           HN       VAL  35  -0.791   6.465  10.403
  291    HA   VAL  35           HA       VAL  35  -2.173   4.195  11.742
  292    HB   VAL  35           HB       VAL  35  -2.733   3.287   9.448
  293   1HG1  VAL  35          HG11      VAL  35  -4.771   4.744   9.263
  294   2HG1  VAL  35          HG12      VAL  35  -4.073   5.764  10.522
  295   3HG1  VAL  35          HG13      VAL  35  -4.476   4.083  10.869
  296   1HG2  VAL  35          HG21      VAL  35  -1.261   4.826   8.209
  297   2HG2  VAL  35          HG22      VAL  35  -2.286   6.177   8.695
  298   3HG2  VAL  35          HG23      VAL  35  -2.928   4.914   7.644
  299    H    ARG  36           HN       ARG  36  -1.441   2.100  10.782
  300    HA   ARG  36           HA       ARG  36   1.495   2.277  10.134
  301   1HB   ARG  36          HB2       ARG  36   1.127  -0.241  11.280
  302   2HB   ARG  36          HB1       ARG  36   1.872   1.156  12.047
  303   1HG   ARG  36          HG2       ARG  36  -0.325   1.863  12.915
  304   2HG   ARG  36          HG1       ARG  36  -1.084   0.473  12.137
  305   1HD   ARG  36          HD2       ARG  36   0.707  -0.901  13.489
  306   2HD   ARG  36          HD1       ARG  36   0.769   0.543  14.500
  307    HE   ARG  36           HE       ARG  36  -1.762  -0.975  14.001
  308   1HH1  ARG  36          HH21      ARG  36  -2.072   1.692  15.270
  309   2HH1  ARG  36          HH22      ARG  36  -2.006   1.318  16.960
  310   1HH2  ARG  36          HH11      ARG  36  -0.612  -1.829  16.483
  311   2HH2  ARG  36          HH12      ARG  36  -1.178  -0.679  17.648
  312    H    VAL  37           HN       VAL  37   2.009   1.445   8.172
  313    HA   VAL  37           HA       VAL  37   0.257  -0.651   7.010
  314    HB   VAL  37           HB       VAL  37   1.253   1.873   5.996
  315   1HG1  VAL  37          HG11      VAL  37   1.608  -0.560   4.260
  316   2HG1  VAL  37          HG12      VAL  37   2.894   0.505   4.830
  317   3HG1  VAL  37          HG13      VAL  37   1.688   1.108   3.694
  318   1HG2  VAL  37          HG21      VAL  37  -0.774   1.928   5.077
  319   2HG2  VAL  37          HG22      VAL  37  -1.077   0.481   6.027
  320   3HG2  VAL  37          HG23      VAL  37  -0.569   0.336   4.352
  321    H    ARG  38           HN       ARG  38   1.146  -2.224   5.876
  322    HA   ARG  38           HA       ARG  38   4.131  -2.637   6.024
  323   1HB   ARG  38          HB2       ARG  38   3.476  -5.101   5.548
  324   2HB   ARG  38          HB1       ARG  38   3.194  -4.503   7.176
  325   1HG   ARG  38          HG2       ARG  38   0.810  -3.948   6.397
  326   2HG   ARG  38          HG1       ARG  38   1.168  -4.920   4.971
  327   1HD   ARG  38          HD2       ARG  38   0.240  -6.525   6.375
  328   2HD   ARG  38          HD1       ARG  38   1.951  -6.698   6.762
  329    HE   ARG  38           HE       ARG  38   0.778  -4.740   8.498
  330   1HH1  ARG  38          HH11      ARG  38  -1.276  -6.972   8.522
  331   2HH1  ARG  38          HH12      ARG  38  -0.704  -7.953   9.829
  332   1HH2  ARG  38          HH21      ARG  38   2.453  -6.500   9.886
  333   2HH2  ARG  38          HH22      ARG  38   1.415  -7.685  10.605
  334    H    CYS  39           HN       CYS  39   5.090  -2.960   3.921
  335    HA   CYS  39           HA       CYS  39   3.114  -2.970   1.686
  336   1HB   CYS  39          HB2       CYS  39   3.895  -0.994   0.757
  337   2HB   CYS  39          HB1       CYS  39   3.956  -0.652   2.482
  338    HG   CYS  39           HG       CYS  39   6.444  -1.313   0.723
  339    H    LEU  40           HN       LEU  40   3.913  -3.215  -0.392
  340    HA   LEU  40           HA       LEU  40   6.047  -5.185  -0.714
  341   1HB   LEU  40          HB2       LEU  40   3.858  -5.575  -1.753
  342   2HB   LEU  40          HB1       LEU  40   3.925  -4.004  -2.534
  343    HG   LEU  40           HG       LEU  40   5.994  -4.806  -3.743
  344   1HD1  LEU  40          HD11      LEU  40   5.245  -7.612  -3.370
  345   2HD1  LEU  40          HD12      LEU  40   5.855  -6.865  -1.895
  346   3HD1  LEU  40          HD13      LEU  40   6.844  -6.868  -3.354
  347   1HD2  LEU  40          HD21      LEU  40   4.720  -5.843  -5.440
  348   2HD2  LEU  40          HD22      LEU  40   3.557  -4.833  -4.581
  349   3HD2  LEU  40          HD23      LEU  40   3.609  -6.569  -4.279
  350    H    ASP  41           HN       ASP  41   7.422  -4.745  -2.685
  351    HA   ASP  41           HA       ASP  41   8.971  -3.434  -3.873
  352   1HB   ASP  41          HB2       ASP  41   7.557  -1.044  -2.606
  353   2HB   ASP  41          HB1       ASP  41   8.864  -0.951  -3.780
  354    H    GLY  42           HN       GLY  42   8.758  -4.569  -1.135
  355   1HA   GLY  42          HA2       GLY  42  10.077  -4.903   0.730
  356   2HA   GLY  42          HA1       GLY  42  11.355  -4.111  -0.175
  357    H    LYS  43           HN       LYS  43   8.316  -3.011   1.542
  358    HA   LYS  43           HA       LYS  43  10.139  -1.257   3.094
  359   1HB   LYS  43          HB2       LYS  43   8.508  -0.306   0.940
  360   2HB   LYS  43          HB1       LYS  43   7.997   0.439   2.448
  361   1HG   LYS  43          HG2       LYS  43   9.742   1.855   2.144
  362   2HG   LYS  43          HG1       LYS  43  10.754   0.503   2.648
  363   1HD   LYS  43          HD2       LYS  43  10.425  -0.134   0.043
  364   2HD   LYS  43          HD1       LYS  43  10.299   1.622  -0.067
  365   1HE   LYS  43          HE2       LYS  43  12.516   1.866   0.235
  366   2HE   LYS  43          HE1       LYS  43  12.473   0.881   1.697
  367   1HZ   LYS  43          HZ1       LYS  43  13.882  -0.026  -0.116
  368   2HZ   LYS  43          HZ2       LYS  43  12.480  -0.247  -1.050
  369   3HZ   LYS  43          HZ3       LYS  43  12.672  -1.092   0.412
  370    H    THR  44           HN       THR  44   9.245  -0.293   4.934
  371    HA   THR  44           HA       THR  44   6.572  -1.167   5.870
  372    HB   THR  44           HB       THR  44   8.573  -1.339   8.008
  373    HG1  THR  44           HG1      THR  44   9.875  -2.324   6.531
  374   1HG2  THR  44          HG21      THR  44   7.165  -3.015   8.774
  375   2HG2  THR  44          HG22      THR  44   6.711  -3.514   7.145
  376   3HG2  THR  44          HG23      THR  44   6.054  -2.026   7.827
  377    H    ARG  45           HN       ARG  45   5.593   0.705   6.551
  378    HA   ARG  45           HA       ARG  45   7.334   2.741   7.862
  379   1HB   ARG  45          HB2       ARG  45   5.937   4.421   6.300
  380   2HB   ARG  45          HB1       ARG  45   7.500   3.768   5.848
  381   1HG   ARG  45          HG2       ARG  45   5.920   3.536   3.988
  382   2HG   ARG  45          HG1       ARG  45   6.386   1.951   4.592
  383   1HD   ARG  45          HD2       ARG  45   3.900   2.288   4.116
  384   2HD   ARG  45          HD1       ARG  45   4.299   1.654   5.708
  385    HE   ARG  45           HE       ARG  45   4.158   4.448   5.999
  386   1HH1  ARG  45          HH21      ARG  45   1.976   3.659   3.884
  387   2HH1  ARG  45          HH22      ARG  45   0.591   3.591   4.919
  388   1HH2  ARG  45          HH11      ARG  45   2.458   3.470   7.836
  389   2HH2  ARG  45          HH12      ARG  45   0.864   3.503   7.162
  390    H    LEU  46           HN       LEU  46   6.245   4.563   8.753
  391    HA   LEU  46           HA       LEU  46   3.510   3.913   9.804
  392   1HB   LEU  46          HB2       LEU  46   4.046   5.981  11.312
  393   2HB   LEU  46          HB1       LEU  46   4.877   4.473  11.681
  394    HG   LEU  46           HG       LEU  46   6.241   6.256   9.733
  395   1HD1  LEU  46          HD11      LEU  46   7.141   7.692  11.535
  396   2HD1  LEU  46          HD12      LEU  46   6.052   6.921  12.688
  397   3HD1  LEU  46          HD13      LEU  46   5.396   7.893  11.371
  398   1HD2  LEU  46          HD21      LEU  46   8.200   5.413  10.853
  399   2HD2  LEU  46          HD22      LEU  46   7.096   4.049  10.680
  400   3HD2  LEU  46          HD23      LEU  46   7.247   4.868  12.233
  401    H    GLY  47           HN       GLY  47   1.867   5.044   8.752
  402   1HA   GLY  47          HA2       GLY  47   2.757   7.152   6.858
  403   2HA   GLY  47          HA1       GLY  47   1.300   6.190   6.688
  404    H    ARG  48           HN       ARG  48   1.411   8.933   6.383
  405    HA   ARG  48           HA       ARG  48  -0.279   9.850   8.649
  406   1HB   ARG  48          HB2       ARG  48   0.505  12.163   8.167
  407   2HB   ARG  48          HB1       ARG  48   1.801  11.110   8.719
  408   1HG   ARG  48          HG2       ARG  48   2.687  10.862   6.519
  409   2HG   ARG  48          HG1       ARG  48   1.235  11.531   5.777
  410   1HD   ARG  48          HD2       ARG  48   3.197  13.051   7.522
  411   2HD   ARG  48          HD1       ARG  48   3.046  13.194   5.771
  412    HE   ARG  48           HE       ARG  48   1.362  14.509   7.709
  413   1HH1  ARG  48          HH11      ARG  48   1.881  15.344   4.826
  414   2HH1  ARG  48          HH12      ARG  48   0.306  15.154   4.130
  415   1HH2  ARG  48          HH21      ARG  48  -0.905  13.217   6.749
  416   2HH2  ARG  48          HH22      ARG  48  -1.276  13.944   5.223
  417    H    ILE  49           HN       ILE  49  -2.172  10.921   8.069
  418    HA   ILE  49           HA       ILE  49  -2.733  11.129   5.151
  419    HB   ILE  49           HB       ILE  49  -3.956   9.403   7.147
  420   1HG1  ILE  49          HG12      ILE  49  -4.637   9.650   4.215
  421   2HG1  ILE  49          HG11      ILE  49  -3.114   8.948   4.757
  422   1HG2  ILE  49          HG21      ILE  49  -5.831  11.197   5.584
  423   2HG2  ILE  49          HG22      ILE  49  -5.601  11.238   7.331
  424   3HG2  ILE  49          HG23      ILE  49  -6.302   9.812   6.568
  425   1HD1  ILE  49          HD11      ILE  49  -4.651   7.123   4.483
  426   2HD1  ILE  49          HD12      ILE  49  -5.912   7.971   5.378
  427   3HD1  ILE  49          HD13      ILE  49  -4.478   7.383   6.219
  428    HA   PRO  50           HA       PRO  50  -4.146  15.162   6.177
  429   1HB   PRO  50          HB2       PRO  50  -5.793  15.582   4.009
  430   2HB   PRO  50          HB1       PRO  50  -4.024  15.654   3.934
  431   1HG   PRO  50          HG2       PRO  50  -5.860  13.507   2.968
  432   2HG   PRO  50          HG1       PRO  50  -4.256  13.966   2.371
  433   1HD   PRO  50          HD2       PRO  50  -4.806  11.750   4.018
  434   2HD   PRO  50          HD1       PRO  50  -3.201  12.461   3.745
  435    H    GLY  51           HN       GLY  51  -6.018  16.291   6.960
  436   1HA   GLY  51          HA2       GLY  51  -7.983  14.731   8.301
  437   2HA   GLY  51          HA1       GLY  51  -8.079  16.473   8.057
  438    H    ARG  52           HN       ARG  52  -7.949  16.081   5.057
  439    HA   ARG  52           HA       ARG  52 -10.698  16.169   4.440
  440   1HB   ARG  52          HB2       ARG  52  -8.438  15.240   2.639
  441   2HB   ARG  52          HB1       ARG  52 -10.026  15.782   2.098
  442   1HG   ARG  52          HG2       ARG  52  -9.535  17.973   3.336
  443   2HG   ARG  52          HG1       ARG  52  -7.866  17.413   3.445
  444   1HD   ARG  52          HD2       ARG  52  -9.417  17.671   0.853
  445   2HD   ARG  52          HD1       ARG  52  -8.274  18.871   1.453
  446    HE   ARG  52           HE       ARG  52  -7.131  16.186   1.244
  447   1HH1  ARG  52          HH11      ARG  52  -8.351  17.338  -1.418
  448   2HH1  ARG  52          HH12      ARG  52  -6.907  17.960  -2.146
  449   1HH2  ARG  52          HH21      ARG  52  -5.034  17.772   0.775
  450   2HH2  ARG  52          HH22      ARG  52  -5.026  18.207  -0.903
  451    H    LEU  53           HN       LEU  53  -8.485  13.369   4.410
  452    HA   LEU  53           HA       LEU  53 -10.381  11.479   3.368
  453   1HB   LEU  53          HB2       LEU  53  -8.080  10.884   5.253
  454   2HB   LEU  53          HB1       LEU  53  -8.845   9.766   4.129
  455    HG   LEU  53           HG       LEU  53  -7.042  12.108   3.518
  456   1HD1  LEU  53          HD11      LEU  53  -5.610  10.520   2.704
  457   2HD1  LEU  53          HD12      LEU  53  -6.917   9.504   2.094
  458   3HD1  LEU  53          HD13      LEU  53  -6.504   9.475   3.808
  459   1HD2  LEU  53          HD21      LEU  53  -9.297  11.060   1.909
  460   2HD2  LEU  53          HD22      LEU  53  -7.765  11.174   1.048
  461   3HD2  LEU  53          HD23      LEU  53  -8.463  12.609   1.799
  462    H    LYS  54           HN       LYS  54  -9.491  12.379   6.708
  463    HA   LYS  54           HA       LYS  54 -11.247  10.514   8.009
  464   1HB   LYS  54          HB2       LYS  54 -10.010  13.133   8.885
  465   2HB   LYS  54          HB1       LYS  54 -11.042  12.179   9.951
  466   1HG   LYS  54          HG2       LYS  54  -9.301  10.851  10.455
  467   2HG   LYS  54          HG1       LYS  54  -9.145  10.407   8.756
  468   1HD   LYS  54          HD2       LYS  54  -7.740  12.375   8.345
  469   2HD   LYS  54          HD1       LYS  54  -7.933  12.882  10.023
  470   1HE   LYS  54          HE2       LYS  54  -6.972  10.562  10.634
  471   2HE   LYS  54          HE1       LYS  54  -6.457  10.477   8.951
  472   1HZ   LYS  54          HZ1       LYS  54  -5.306  12.611   9.277
  473   2HZ   LYS  54          HZ2       LYS  54  -4.698  11.384  10.281
  474   3HZ   LYS  54          HZ3       LYS  54  -5.726  12.576  10.920
  475    H    ASN  55           HN       ASN  55 -11.710  13.811   6.779
  476    HA   ASN  55           HA       ASN  55 -14.259  14.339   7.948
  477   1HB   ASN  55          HB2       ASN  55 -12.969  15.298   5.381
  478   2HB   ASN  55          HB1       ASN  55 -14.541  15.879   5.927
  479   1HD2  ASN  55          HD21      ASN  55 -14.294  16.335   8.599
  480   2HD2  ASN  55          HD22      ASN  55 -13.009  17.390   8.941
  481    H    ARG  56           HN       ARG  56 -13.363  12.700   4.909
  482    HA   ARG  56           HA       ARG  56 -16.043  12.335   3.935
  483   1HB   ARG  56          HB2       ARG  56 -13.351  11.361   3.266
  484   2HB   ARG  56          HB1       ARG  56 -14.612  10.163   2.971
  485   1HG   ARG  56          HG2       ARG  56 -15.741  12.500   1.998
  486   2HG   ARG  56          HG1       ARG  56 -14.044  12.659   1.544
  487   1HD   ARG  56          HD2       ARG  56 -14.299  11.139  -0.095
  488   2HD   ARG  56          HD1       ARG  56 -14.910   9.953   1.059
  489    HE   ARG  56           HE       ARG  56 -16.659  11.967  -0.303
  490   1HH1  ARG  56          HH21      ARG  56 -17.896  10.618   2.025
  491   2HH1  ARG  56          HH22      ARG  56 -18.648   9.230   1.313
  492   1HH2  ARG  56          HH11      ARG  56 -16.817   9.425  -1.636
  493   2HH2  ARG  56          HH12      ARG  56 -18.035   8.552  -0.766
  494    H    ILE  57           HN       ILE  57 -13.871   9.847   5.340
  495    HA   ILE  57           HA       ILE  57 -15.851   8.904   7.220
  496    HB   ILE  57           HB       ILE  57 -16.854   8.041   5.115
  497   1HG1  ILE  57          HG12      ILE  57 -15.767   5.616   6.489
  498   2HG1  ILE  57          HG11      ILE  57 -16.690   6.771   7.451
  499   1HG2  ILE  57          HG21      ILE  57 -14.325   6.385   4.901
  500   2HG2  ILE  57          HG22      ILE  57 -14.685   7.784   3.890
  501   3HG2  ILE  57          HG23      ILE  57 -15.705   6.349   3.803
  502   1HD1  ILE  57          HD11      ILE  57 -17.611   5.325   4.954
  503   2HD1  ILE  57          HD12      ILE  57 -18.507   6.648   5.700
  504   3HD1  ILE  57          HD13      ILE  57 -18.250   5.146   6.588
  505    H    TRP  58           HN       TRP  58 -14.982   7.254   8.593
  506    HA   TRP  58           HA       TRP  58 -12.055   6.756   8.196
  507   1HB   TRP  58          HB2       TRP  58 -13.192   8.209  10.224
  508   2HB   TRP  58          HB1       TRP  58 -13.121   6.607  10.949
  509    HD1  TRP  58           HD1      TRP  58 -10.360   6.030   9.039
  510    HE1  TRP  58           HE1      TRP  58  -8.142   6.883  10.031
  511    HE3  TRP  58           HE3      TRP  58 -12.151   9.396  12.436
  512    HZ2  TRP  58           HZ2      TRP  58  -7.243   8.746  12.007
  513    HZ3  TRP  58           HZ3      TRP  58 -10.593  10.693  13.859
  514    HH2  TRP  58           HH2      TRP  58  -8.143  10.373  13.649
  515    H    VAL  59           HN       VAL  59 -11.410   4.645   8.248
  516    HA   VAL  59           HA       VAL  59 -13.474   2.580   8.848
  517    HB   VAL  59           HB       VAL  59 -12.173   1.057   7.530
  518   1HG1  VAL  59          HG11      VAL  59 -12.272   2.082   5.414
  519   2HG1  VAL  59          HG12      VAL  59 -11.774   3.652   6.049
  520   3HG1  VAL  59          HG13      VAL  59 -13.399   3.041   6.374
  521   1HG2  VAL  59          HG21      VAL  59  -9.996   3.130   7.850
  522   2HG2  VAL  59          HG22      VAL  59  -9.937   1.938   6.552
  523   3HG2  VAL  59          HG23      VAL  59  -9.939   1.408   8.234
  524    H    ARG  60           HN       ARG  60 -12.802   0.682  10.139
  525    HA   ARG  60           HA       ARG  60 -11.248   1.480  12.477
  526   1HB   ARG  60          HB2       ARG  60 -13.302  -0.267  12.131
  527   2HB   ARG  60          HB1       ARG  60 -11.939  -1.385  12.119
  528   1HG   ARG  60          HG2       ARG  60 -12.488  -1.232  14.404
  529   2HG   ARG  60          HG1       ARG  60 -11.147  -0.099  14.235
  530   1HD   ARG  60          HD2       ARG  60 -12.866   1.729  13.881
  531   2HD   ARG  60          HD1       ARG  60 -14.102   0.557  14.338
  532    HE   ARG  60           HE       ARG  60 -11.952   1.550  16.157
  533   1HH1  ARG  60          HH11      ARG  60 -14.676   2.448  16.748
  534   2HH1  ARG  60          HH12      ARG  60 -15.257   1.264  17.871
  535   1HH2  ARG  60          HH21      ARG  60 -12.805  -1.071  17.085
  536   2HH2  ARG  60          HH22      ARG  60 -14.194  -0.733  18.061
  537    H    GLU  61           HN       GLU  61 -10.872  -1.209  10.119
  538    HA   GLU  61           HA       GLU  61  -8.028  -0.759   9.843
  539   1HB   GLU  61          HB2       GLU  61  -7.309  -2.917  10.876
  540   2HB   GLU  61          HB1       GLU  61  -7.931  -1.768  12.057
  541   1HG   GLU  61          HG2       GLU  61  -9.389  -3.348  12.732
  542   2HG   GLU  61          HG1       GLU  61 -10.177  -3.222  11.160
  543    H    GLY  62           HN       GLY  62  -7.116  -2.107   8.195
  544   1HA   GLY  62          HA2       GLY  62  -7.169  -3.863   6.555
  545   2HA   GLY  62          HA1       GLY  62  -8.870  -4.135   6.934
  546    H    ASP  63           HN       ASP  63  -6.781  -1.529   5.623
  547    HA   ASP  63           HA       ASP  63  -8.895  -1.033   3.550
  548   1HB   ASP  63          HB2       ASP  63  -8.705   0.712   5.454
  549   2HB   ASP  63          HB1       ASP  63  -7.172   1.157   4.706
  550    H    VAL  64           HN       VAL  64  -7.972  -0.041   1.491
  551    HA   VAL  64           HA       VAL  64  -5.157  -1.006   1.146
  552    HB   VAL  64           HB       VAL  64  -6.342  -2.063  -0.561
  553   1HG1  VAL  64          HG11      VAL  64  -8.468  -0.743  -0.062
  554   2HG1  VAL  64          HG12      VAL  64  -8.208  -1.208  -1.741
  555   3HG1  VAL  64          HG13      VAL  64  -7.872   0.443  -1.223
  556   1HG2  VAL  64          HG21      VAL  64  -5.886   0.452  -2.119
  557   2HG2  VAL  64          HG22      VAL  64  -5.436  -1.206  -2.512
  558   3HG2  VAL  64          HG23      VAL  64  -4.502  -0.297  -1.327
  559    H    VAL  65           HN       VAL  65  -3.560   0.455   0.885
  560    HA   VAL  65           HA       VAL  65  -4.296   3.188  -0.016
  561    HB   VAL  65           HB       VAL  65  -3.041   4.223   1.804
  562   1HG1  VAL  65          HG11      VAL  65  -4.729   4.065   3.333
  563   2HG1  VAL  65          HG12      VAL  65  -4.643   2.305   3.399
  564   3HG1  VAL  65          HG13      VAL  65  -5.501   3.096   2.079
  565   1HG2  VAL  65          HG21      VAL  65  -1.338   2.506   2.155
  566   2HG2  VAL  65          HG22      VAL  65  -2.561   1.371   2.726
  567   3HG2  VAL  65          HG23      VAL  65  -2.178   2.806   3.676
  568    H    ILE  66           HN       ILE  66  -2.596   4.287  -1.031
  569    HA   ILE  66           HA       ILE  66  -0.279   2.513  -1.789
  570    HB   ILE  66           HB       ILE  66  -1.639   3.619  -3.630
  571   1HG1  ILE  66          HG12      ILE  66   0.931   4.987  -3.963
  572   2HG1  ILE  66          HG11      ILE  66   1.113   3.329  -3.391
  573   1HG2  ILE  66          HG21      ILE  66  -1.557   5.993  -3.965
  574   2HG2  ILE  66          HG22      ILE  66  -0.384   6.202  -2.665
  575   3HG2  ILE  66          HG23      ILE  66  -2.044   5.743  -2.290
  576   1HD1  ILE  66          HD11      ILE  66  -0.649   4.066  -5.739
  577   2HD1  ILE  66          HD12      ILE  66  -0.115   2.456  -5.255
  578   3HD1  ILE  66          HD13      ILE  66   1.044   3.606  -5.921
  579    H    VAL  67           HN       VAL  67   1.861   3.276  -1.167
  580    HA   VAL  67           HA       VAL  67   1.770   5.669   0.619
  581    HB   VAL  67           HB       VAL  67   2.504   4.422   2.316
  582   1HG1  VAL  67          HG11      VAL  67   2.510   2.131   0.335
  583   2HG1  VAL  67          HG12      VAL  67   1.156   2.634   1.346
  584   3HG1  VAL  67          HG13      VAL  67   2.603   1.952   2.087
  585   1HG2  VAL  67          HG21      VAL  67   4.800   4.797   1.713
  586   2HG2  VAL  67          HG22      VAL  67   4.727   3.582   0.440
  587   3HG2  VAL  67          HG23      VAL  67   4.655   3.090   2.132
  588    H    LYS  68           HN       LYS  68   3.479   7.001   0.810
  589    HA   LYS  68           HA       LYS  68   5.444   6.996  -1.392
  590   1HB   LYS  68          HB2       LYS  68   3.825   9.032  -0.348
  591   2HB   LYS  68          HB1       LYS  68   5.462   9.389   0.203
  592   1HG   LYS  68          HG2       LYS  68   5.706   8.589  -2.496
  593   2HG   LYS  68          HG1       LYS  68   4.335   9.694  -2.439
  594   1HD   LYS  68          HD2       LYS  68   5.625  11.486  -1.781
  595   2HD   LYS  68          HD1       LYS  68   6.780  10.472  -0.915
  596   1HE   LYS  68          HE2       LYS  68   7.886   9.829  -2.913
  597   2HE   LYS  68          HE1       LYS  68   6.556  10.389  -3.925
  598   1HZ   LYS  68          HZ1       LYS  68   8.317  12.126  -2.279
  599   2HZ   LYS  68          HZ2       LYS  68   7.047  12.657  -3.275
  600   3HZ   LYS  68          HZ3       LYS  68   8.421  11.930  -3.961
  601    HA   PRO  69           HA       PRO  69   8.323   5.937   1.743
  602   1HB   PRO  69          HB2       PRO  69  10.589   6.103   0.231
  603   2HB   PRO  69          HB1       PRO  69   9.412   4.788   0.082
  604   1HG   PRO  69          HG2       PRO  69   9.939   7.032  -1.790
  605   2HG   PRO  69          HG1       PRO  69   9.153   5.477  -2.104
  606   1HD   PRO  69          HD2       PRO  69   7.875   8.024  -1.686
  607   2HD   PRO  69          HD1       PRO  69   7.094   6.446  -1.932
  608    H    TRP  70           HN       TRP  70   9.449   6.935   3.271
  609    HA   TRP  70           HA       TRP  70  10.423   9.730   2.879
  610   1HB   TRP  70          HB2       TRP  70   9.416   8.319   5.342
  611   2HB   TRP  70          HB1       TRP  70  10.290   9.834   5.414
  612    HD1  TRP  70           HD1      TRP  70   7.783   8.759   2.825
  613    HE1  TRP  70           HE1      TRP  70   5.888  10.337   2.929
  614    HE3  TRP  70           HE3      TRP  70   9.177  11.562   6.824
  615    HZ2  TRP  70           HZ2      TRP  70   4.967  12.538   4.461
  616    HZ3  TRP  70           HZ3      TRP  70   7.745  13.431   7.598
  617    HH2  TRP  70           HH2      TRP  70   5.616  13.933   6.409
  618    H    GLU  71           HN       GLU  71  12.848   9.549   2.895
  619    HA   GLU  71           HA       GLU  71  14.982   8.645   3.409
  620   1HB   GLU  71          HB2       GLU  71  13.606   9.222   5.806
  621   2HB   GLU  71          HB1       GLU  71  14.343   7.642   6.061
  622   1HG   GLU  71          HG2       GLU  71  16.110   9.010   6.672
  623   2HG   GLU  71          HG1       GLU  71  16.453   8.825   4.953
  624    H    VAL  72           HN       VAL  72  15.687   6.337   5.054
  625    HA   VAL  72           HA       VAL  72  14.003   4.098   4.151
  626    HB   VAL  72           HB       VAL  72  16.802   4.460   3.032
  627   1HG1  VAL  72          HG11      VAL  72  14.938   2.089   3.138
  628   2HG1  VAL  72          HG12      VAL  72  16.662   2.152   3.505
  629   3HG1  VAL  72          HG13      VAL  72  16.111   2.260   1.833
  630   1HG2  VAL  72          HG21      VAL  72  15.531   4.170   0.852
  631   2HG2  VAL  72          HG22      VAL  72  15.206   5.678   1.706
  632   3HG2  VAL  72          HG23      VAL  72  14.044   4.352   1.781
  633    H    GLN  73           HN       GLN  73  17.500   3.973   4.740
  634    HA   GLN  73           HA       GLN  73  17.806   1.803   6.260
  635   1HB   GLN  73          HB2       GLN  73  19.614   2.979   7.592
  636   2HB   GLN  73          HB1       GLN  73  19.733   3.121   5.841
  637   1HG   GLN  73          HG2       GLN  73  18.772   5.351   5.902
  638   2HG   GLN  73          HG1       GLN  73  18.456   5.208   7.630
  639   1HE2  GLN  73          HE21      GLN  73  21.259   4.935   5.354
  640   2HE2  GLN  73          HE22      GLN  73  22.366   5.679   6.405
  641    H    GLY  74           HN       GLY  74  17.321   0.929   8.182
  642   1HA   GLY  74          HA2       GLY  74  16.722   0.844  10.490
  643   2HA   GLY  74          HA1       GLY  74  16.425   2.581  10.456
  644    H    ASP  75           HN       ASP  75  14.563   3.048   8.705
  645    HA   ASP  75           HA       ASP  75  12.402   1.267   8.302
  646   1HB   ASP  75          HB2       ASP  75  10.824   2.119  10.026
  647   2HB   ASP  75          HB1       ASP  75  12.163   1.245  10.759
  648    H    GLN  76           HN       GLN  76  10.348   2.709   7.633
  649    HA   GLN  76           HA       GLN  76  11.426   5.424   6.961
  650   1HB   GLN  76          HB2       GLN  76  10.512   5.257   4.699
  651   2HB   GLN  76          HB1       GLN  76  11.680   3.975   5.009
  652   1HG   GLN  76          HG2       GLN  76  10.135   2.384   4.627
  653   2HG   GLN  76          HG1       GLN  76   9.026   3.115   5.784
  654   1HE2  GLN  76          HE21      GLN  76   8.067   2.004   3.324
  655   2HE2  GLN  76          HE22      GLN  76   7.487   3.266   2.349
  656    H    LYS  77           HN       LYS  77   9.894   7.018   6.357
  657    HA   LYS  77           HA       LYS  77   7.266   6.746   7.779
  658   1HB   LYS  77          HB2       LYS  77   9.043   9.070   7.080
  659   2HB   LYS  77          HB1       LYS  77   7.314   9.336   7.303
  660   1HG   LYS  77          HG2       LYS  77   7.699   9.441   9.521
  661   2HG   LYS  77          HG1       LYS  77   8.087   7.721   9.468
  662   1HD   LYS  77          HD2       LYS  77  10.118   8.408  10.248
  663   2HD   LYS  77          HD1       LYS  77  10.424   8.787   8.553
  664   1HE   LYS  77          HE2       LYS  77   9.290  11.077   9.127
  665   2HE   LYS  77          HE1       LYS  77   9.664  10.644  10.794
  666   1HZ   LYS  77          HZ1       LYS  77  11.455  11.919   9.846
  667   2HZ   LYS  77          HZ2       LYS  77  11.603  10.829   8.553
  668   3HZ   LYS  77          HZ3       LYS  77  11.985  10.334  10.133
  669    H    CYS  78           HN       CYS  78   5.343   7.653   6.530
  670    HA   CYS  78           HA       CYS  78   5.907   7.828   3.629
  671   1HB   CYS  78          HB2       CYS  78   5.024   5.848   3.061
  672   2HB   CYS  78          HB1       CYS  78   5.071   5.436   4.764
  673    HG   CYS  78           HG       CYS  78   2.557   6.406   3.233
  674    H    ASP  79           HN       ASP  79   4.084   8.544   2.334
  675    HA   ASP  79           HA       ASP  79   1.989   9.866   4.080
  676   1HB   ASP  79          HB2       ASP  79   1.687  11.564   2.168
  677   2HB   ASP  79          HB1       ASP  79   3.108  11.767   3.183
  678    H    ILE  80           HN       ILE  80   0.094   8.780   3.738
  679    HA   ILE  80           HA       ILE  80  -0.106   7.258   1.169
  680    HB   ILE  80           HB       ILE  80  -1.811   5.881   2.602
  681   1HG1  ILE  80          HG12      ILE  80  -0.003   6.844   4.819
  682   2HG1  ILE  80          HG11      ILE  80  -1.546   7.639   4.503
  683   1HG2  ILE  80          HG21      ILE  80   0.974   5.733   2.054
  684   2HG2  ILE  80          HG22      ILE  80  -0.152   4.407   2.347
  685   3HG2  ILE  80          HG23      ILE  80   0.712   5.149   3.692
  686   1HD1  ILE  80          HD11      ILE  80  -2.306   6.039   5.966
  687   2HD1  ILE  80          HD12      ILE  80  -1.000   4.918   5.582
  688   3HD1  ILE  80          HD13      ILE  80  -2.378   5.076   4.491
  689    H    ILE  81           HN       ILE  81  -2.098   6.698   0.318
  690    HA   ILE  81           HA       ILE  81  -4.300   8.670   0.740
  691    HB   ILE  81           HB       ILE  81  -2.898   7.745  -1.680
  692   1HG1  ILE  81          HG12      ILE  81  -4.978   9.787  -1.951
  693   2HG1  ILE  81          HG11      ILE  81  -3.874  10.115  -0.616
  694   1HG2  ILE  81          HG21      ILE  81  -4.735   6.282  -2.071
  695   2HG2  ILE  81          HG22      ILE  81  -5.061   7.722  -3.034
  696   3HG2  ILE  81          HG23      ILE  81  -5.902   7.476  -1.503
  697   1HD1  ILE  81          HD11      ILE  81  -1.952   9.936  -2.092
  698   2HD1  ILE  81          HD12      ILE  81  -3.097  11.077  -2.798
  699   3HD1  ILE  81          HD13      ILE  81  -2.982   9.436  -3.433
  700    H    TRP  82           HN       TRP  82  -6.045   7.640   1.633
  701    HA   TRP  82           HA       TRP  82  -6.093   4.675   1.640
  702   1HB   TRP  82          HB2       TRP  82  -6.649   4.987   3.796
  703   2HB   TRP  82          HB1       TRP  82  -6.691   6.725   3.549
  704    HD1  TRP  82           HD1      TRP  82  -8.855   3.831   4.328
  705    HE1  TRP  82           HE1      TRP  82 -11.338   4.515   4.308
  706    HE3  TRP  82           HE3      TRP  82  -8.491   8.442   2.156
  707    HZ2  TRP  82           HZ2      TRP  82 -12.955   6.721   3.489
  708    HZ3  TRP  82           HZ3      TRP  82 -10.520   9.810   1.774
  709    HH2  TRP  82           HH2      TRP  82 -12.750   8.958   2.437
  710    H    ARG  83           HN       ARG  83  -7.903   3.454   1.040
  711    HA   ARG  83           HA       ARG  83 -10.440   4.419   0.248
  712   1HB   ARG  83          HB2       ARG  83  -8.575   5.299  -1.578
  713   2HB   ARG  83          HB1       ARG  83  -9.122   3.795  -2.316
  714   1HG   ARG  83          HG2       ARG  83 -10.903   4.955  -3.078
  715   2HG   ARG  83          HG1       ARG  83 -11.478   4.986  -1.411
  716   1HD   ARG  83          HD2       ARG  83 -10.008   7.070  -1.108
  717   2HD   ARG  83          HD1       ARG  83  -9.872   7.095  -2.866
  718    HE   ARG  83           HE       ARG  83 -12.323   7.418  -2.969
  719   1HH1  ARG  83          HH21      ARG  83 -11.309   9.775  -1.433
  720   2HH1  ARG  83          HH22      ARG  83 -12.344   9.786  -0.045
  721   1HH2  ARG  83          HH11      ARG  83 -13.450   6.525  -0.509
  722   2HH2  ARG  83          HH12      ARG  83 -13.559   7.945   0.478
  723    H    TYR  84           HN       TYR  84 -11.568   2.806  -1.263
  724    HA   TYR  84           HA       TYR  84 -12.380   0.631  -1.490
  725   1HB   TYR  84          HB2       TYR  84  -9.461   0.233  -2.154
  726   2HB   TYR  84          HB1       TYR  84 -10.740  -0.911  -2.542
  727    HD1  TYR  84           HD1      TYR  84  -9.113   2.210  -3.445
  728    HD2  TYR  84           HD2      TYR  84 -12.590  -0.225  -4.103
  729    HE1  TYR  84           HE1      TYR  84  -9.617   3.489  -5.507
  730    HE2  TYR  84           HE2      TYR  84 -13.095   1.056  -6.167
  731    HH   TYR  84           HH       TYR  84 -11.175   2.674  -7.840
  732    H    THR  85           HN       THR  85 -11.646  -1.850  -1.005
  733    HA   THR  85           HA       THR  85 -10.144  -2.517   1.287
  734    HB   THR  85           HB       THR  85 -11.663  -1.059   2.556
  735    HG1  THR  85           HG1      THR  85 -11.263  -2.625   3.901
  736   1HG2  THR  85          HG21      THR  85 -13.691  -2.466   0.931
  737   2HG2  THR  85          HG22      THR  85 -13.720  -0.840   1.610
  738   3HG2  THR  85          HG23      THR  85 -14.127  -2.225   2.623
  739    H    LYS  86           HN       LYS  86 -10.486  -3.824  -1.082
  740    HA   LYS  86           HA       LYS  86 -11.728  -6.354  -0.213
  741   1HB   LYS  86          HB2       LYS  86 -13.411  -4.785  -1.526
  742   2HB   LYS  86          HB1       LYS  86 -12.542  -5.398  -2.932
  743   1HG   LYS  86          HG2       LYS  86 -13.102  -7.660  -2.418
  744   2HG   LYS  86          HG1       LYS  86 -13.656  -7.230  -0.800
  745   1HD   LYS  86          HD2       LYS  86 -15.724  -6.760  -1.557
  746   2HD   LYS  86          HD1       LYS  86 -15.080  -5.693  -2.805
  747   1HE   LYS  86          HE2       LYS  86 -14.420  -8.201  -3.763
  748   2HE   LYS  86          HE1       LYS  86 -15.993  -8.477  -3.016
  749   1HZ   LYS  86          HZ1       LYS  86 -15.362  -6.367  -5.011
  750   2HZ   LYS  86          HZ2       LYS  86 -16.876  -6.608  -4.277
  751   3HZ   LYS  86          HZ3       LYS  86 -16.231  -7.791  -5.314
  752    H    THR  87           HN       THR  87 -10.652  -5.030  -3.392
  753    HA   THR  87           HA       THR  87  -8.437  -7.025  -3.347
  754    HB   THR  87           HB       THR  87 -10.286  -6.578  -5.712
  755    HG1  THR  87           HG1      THR  87 -11.417  -7.773  -4.286
  756   1HG2  THR  87          HG21      THR  87  -8.067  -8.586  -5.230
  757   2HG2  THR  87          HG22      THR  87  -7.963  -7.187  -6.299
  758   3HG2  THR  87          HG23      THR  87  -9.084  -8.497  -6.667
  759    H    GLN  88           HN       GLN  88  -6.666  -5.767  -3.429
  760    HA   GLN  88           HA       GLN  88  -5.832  -4.328  -5.698
  761   1HB   GLN  88          HB2       GLN  88  -7.658  -2.799  -4.083
  762   2HB   GLN  88          HB1       GLN  88  -6.053  -2.084  -3.939
  763   1HG   GLN  88          HG2       GLN  88  -6.057  -2.484  -6.586
  764   2HG   GLN  88          HG1       GLN  88  -7.799  -2.350  -6.344
  765   1HE2  GLN  88          HE21      GLN  88  -8.646  -0.283  -5.545
  766   2HE2  GLN  88          HE22      GLN  88  -7.696   1.124  -5.572
  767    H    VAL  89           HN       VAL  89  -5.581  -3.186  -2.321
  768    HA   VAL  89           HA       VAL  89  -2.706  -3.337  -2.372
  769    HB   VAL  89           HB       VAL  89  -4.692  -2.336  -0.565
  770   1HG1  VAL  89          HG11      VAL  89  -3.733  -2.928   1.579
  771   2HG1  VAL  89          HG12      VAL  89  -2.498  -3.915   0.796
  772   3HG1  VAL  89          HG13      VAL  89  -4.190  -4.412   0.745
  773   1HG2  VAL  89          HG21      VAL  89  -1.765  -1.983  -0.124
  774   2HG2  VAL  89          HG22      VAL  89  -3.045  -0.776  -0.169
  775   3HG2  VAL  89          HG23      VAL  89  -2.429  -1.457  -1.669
  776    H    GLU  90           HN       GLU  90  -5.278  -5.528  -1.344
  777    HA   GLU  90           HA       GLU  90  -3.777  -7.427   0.113
  778   1HB   GLU  90          HB2       GLU  90  -6.030  -7.885  -1.876
  779   2HB   GLU  90          HB1       GLU  90  -5.424  -9.107  -0.757
  780   1HG   GLU  90          HG2       GLU  90  -5.879  -6.899   0.877
  781   2HG   GLU  90          HG1       GLU  90  -7.233  -6.865  -0.252
  782    H    TRP  91           HN       TRP  91  -4.068  -6.895  -3.377
  783    HA   TRP  91           HA       TRP  91  -2.549  -9.179  -4.229
  784   1HB   TRP  91          HB2       TRP  91  -4.057  -7.693  -5.659
  785   2HB   TRP  91          HB1       TRP  91  -2.735  -6.530  -5.673
  786    HD1  TRP  91           HD1      TRP  91  -0.289  -7.613  -6.558
  787    HE1  TRP  91           HE1      TRP  91   0.090  -9.211  -8.544
  788    HE3  TRP  91           HE3      TRP  91  -5.012  -9.479  -7.100
  789    HZ2  TRP  91           HZ2      TRP  91  -1.413 -11.039 -10.153
  790    HZ3  TRP  91           HZ3      TRP  91  -5.509 -11.144  -8.866
  791    HH2  TRP  91           HH2      TRP  91  -3.718 -11.926 -10.391
  792    H    LEU  92           HN       LEU  92  -1.573  -5.712  -3.920
  793    HA   LEU  92           HA       LEU  92   1.198  -6.255  -4.442
  794   1HB   LEU  92          HB2       LEU  92   1.598  -3.993  -3.273
  795   2HB   LEU  92          HB1       LEU  92   0.616  -3.996  -4.729
  796    HG   LEU  92           HG       LEU  92  -1.296  -4.352  -2.784
  797   1HD1  LEU  92          HD11      LEU  92  -0.545  -3.675  -0.767
  798   2HD1  LEU  92          HD12      LEU  92  -0.151  -2.103  -1.460
  799   3HD1  LEU  92          HD13      LEU  92   1.056  -3.388  -1.447
  800   1HD2  LEU  92          HD21      LEU  92  -0.333  -2.208  -4.518
  801   2HD2  LEU  92          HD22      LEU  92  -1.061  -1.570  -3.045
  802   3HD2  LEU  92          HD23      LEU  92  -1.990  -2.637  -4.096
  803    H    LYS  93           HN       LYS  93  -0.424  -5.741  -1.284
  804    HA   LYS  93           HA       LYS  93   1.867  -6.155   0.335
  805   1HB   LYS  93          HB2       LYS  93   0.391  -6.236   2.154
  806   2HB   LYS  93          HB1       LYS  93  -0.517  -5.312   0.963
  807   1HG   LYS  93          HG2       LYS  93  -1.657  -7.430   0.263
  808   2HG   LYS  93          HG1       LYS  93  -0.831  -8.266   1.577
  809   1HD   LYS  93          HD2       LYS  93  -1.845  -6.514   3.139
  810   2HD   LYS  93          HD1       LYS  93  -2.871  -6.046   1.782
  811   1HE   LYS  93          HE2       LYS  93  -4.227  -7.815   2.112
  812   2HE   LYS  93          HE1       LYS  93  -2.859  -8.928   2.096
  813   1HZ   LYS  93          HZ1       LYS  93  -4.069  -8.936   4.214
  814   2HZ   LYS  93          HZ2       LYS  93  -3.688  -7.296   4.436
  815   3HZ   LYS  93          HZ3       LYS  93  -2.451  -8.461   4.403
  816    H    ARG  94           HN       ARG  94  -0.519  -8.538  -0.884
  817    HA   ARG  94           HA       ARG  94   0.544 -10.820   0.459
  818   1HB   ARG  94          HB2       ARG  94  -1.643 -10.680  -0.844
  819   2HB   ARG  94          HB1       ARG  94  -0.676 -10.857  -2.308
  820   1HG   ARG  94          HG2       ARG  94  -0.557 -13.082  -1.995
  821   2HG   ARG  94          HG1       ARG  94   0.140 -12.845  -0.393
  822   1HD   ARG  94          HD2       ARG  94  -1.958 -14.124  -0.239
  823   2HD   ARG  94          HD1       ARG  94  -2.129 -12.554   0.548
  824    HE   ARG  94           HE       ARG  94  -3.200 -11.839  -1.712
  825   1HH1  ARG  94          HH21      ARG  94  -4.937 -13.420   0.250
  826   2HH1  ARG  94          HH22      ARG  94  -5.664 -14.579  -0.814
  827   1HH2  ARG  94          HH11      ARG  94  -3.400 -14.025  -3.392
  828   2HH2  ARG  94          HH12      ARG  94  -4.791 -14.921  -2.882
  829    H    LYS  95           HN       LYS  95   1.378  -9.275  -2.615
  830    HA   LYS  95           HA       LYS  95   3.241 -11.203  -3.560
  831   1HB   LYS  95          HB2       LYS  95   2.783  -8.283  -4.019
  832   2HB   LYS  95          HB1       LYS  95   4.308  -8.978  -4.569
  833   1HG   LYS  95          HG2       LYS  95   2.704 -10.859  -5.546
  834   2HG   LYS  95          HG1       LYS  95   1.518  -9.556  -5.489
  835   1HD   LYS  95          HD2       LYS  95   2.419  -9.211  -7.601
  836   2HD   LYS  95          HD1       LYS  95   3.463  -8.169  -6.633
  837   1HE   LYS  95          HE2       LYS  95   5.084  -9.366  -7.762
  838   2HE   LYS  95          HE1       LYS  95   4.859 -10.433  -6.377
  839   1HZ   LYS  95          HZ1       LYS  95   4.782 -11.667  -8.444
  840   2HZ   LYS  95          HZ2       LYS  95   3.508 -10.696  -9.011
  841   3HZ   LYS  95          HZ3       LYS  95   3.271 -11.718  -7.675
  842    H    GLY  96           HN       GLY  96   3.556  -8.591  -1.169
  843   1HA   GLY  96          HA2       GLY  96   6.428  -8.669  -0.968
  844   2HA   GLY  96          HA1       GLY  96   5.331  -8.045   0.263
  845    H    TYR  97           HN       TYR  97   3.832 -10.373   0.787
  846    HA   TYR  97           HA       TYR  97   5.567 -11.725   2.642
  847   1HB   TYR  97          HB2       TYR  97   2.980 -12.957   1.733
  848   2HB   TYR  97          HB1       TYR  97   3.696 -12.938   3.341
  849    HD1  TYR  97           HD1      TYR  97   0.852 -12.009   2.150
  850    HD2  TYR  97           HD2      TYR  97   4.386  -9.988   3.515
  851    HE1  TYR  97           HE1      TYR  97  -0.501 -10.009   2.695
  852    HE2  TYR  97           HE2      TYR  97   3.036  -7.988   4.059
  853    HH   TYR  97           HH       TYR  97   1.003  -7.009   3.850
  854    H    LEU  98           HN       LEU  98   3.986 -13.004  -0.330
  855    HA   LEU  98           HA       LEU  98   5.289 -15.529  -0.269
  856   1HB   LEU  98          HB2       LEU  98   4.643 -15.766  -2.608
  857   2HB   LEU  98          HB1       LEU  98   3.329 -15.020  -1.704
  858    HG   LEU  98           HG       LEU  98   4.585 -12.781  -2.482
  859   1HD1  LEU  98          HD11      LEU  98   4.921 -13.960  -5.087
  860   2HD1  LEU  98          HD12      LEU  98   5.934 -14.824  -3.930
  861   3HD1  LEU  98          HD13      LEU  98   6.103 -13.079  -4.120
  862   1HD2  LEU  98          HD21      LEU  98   3.047 -12.885  -4.544
  863   2HD2  LEU  98          HD22      LEU  98   2.280 -13.113  -2.973
  864   3HD2  LEU  98          HD23      LEU  98   2.619 -14.507  -3.999
  865    H    ASP  99           HN       ASP  99   6.380 -12.421  -1.565
  866    HA   ASP  99           HA       ASP  99   8.622 -13.416  -3.050
  867   1HB   ASP  99          HB2       ASP  99   7.659 -10.804  -2.102
  868   2HB   ASP  99          HB1       ASP  99   9.416 -10.917  -2.174
  869    H    GLU 100           HN       GLU 100   8.442 -12.079   0.279
  870    HA   GLU 100           HA       GLU 100  11.199 -12.594   0.905
  871   1HB   GLU 100          HB2       GLU 100   8.742 -11.901   2.449
  872   2HB   GLU 100          HB1       GLU 100  10.090 -12.597   3.349
  873   1HG   GLU 100          HG2       GLU 100  10.766 -10.407   3.434
  874   2HG   GLU 100          HG1       GLU 100  11.449 -10.805   1.858
  875    H    LEU 101           HN       LEU 101   8.254 -14.380   1.941
  876    HA   LEU 101           HA       LEU 101   9.876 -16.884   1.942
  877   1HB   LEU 101          HB2       LEU 101   8.845 -15.514   4.267
  878   2HB   LEU 101          HB1       LEU 101   8.034 -17.069   4.099
  879    HG   LEU 101           HG       LEU 101  10.046 -17.342   5.452
  880   1HD1  LEU 101          HD11      LEU 101  10.323 -18.479   2.654
  881   2HD1  LEU 101          HD12      LEU 101   9.503 -19.226   4.025
  882   3HD1  LEU 101          HD13      LEU 101  11.255 -19.029   4.045
  883   1HD2  LEU 101          HD21      LEU 101  11.840 -16.655   3.165
  884   2HD2  LEU 101          HD22      LEU 101  12.128 -16.519   4.899
  885   3HD2  LEU 101          HD23      LEU 101  11.132 -15.320   4.075
  886    H    LEU 102           HN       LEU 102   8.015 -18.714   2.663
  887    HA   LEU 102           HA       LEU 102   6.051 -19.837   2.053
  888   1HB   LEU 102          HB2       LEU 102   5.260 -17.130   2.042
  889   2HB   LEU 102          HB1       LEU 102   4.701 -17.791   0.505
  890    HG   LEU 102           HG       LEU 102   4.000 -19.822   2.146
  891   1HD1  LEU 102          HD11      LEU 102   4.837 -18.596   4.143
  892   2HD1  LEU 102          HD12      LEU 102   3.102 -18.905   4.233
  893   3HD1  LEU 102          HD13      LEU 102   3.690 -17.299   3.804
  894   1HD2  LEU 102          HD21      LEU 102   1.723 -18.812   2.147
  895   2HD2  LEU 102          HD22      LEU 102   2.507 -18.669   0.574
  896   3HD2  LEU 102          HD23      LEU 102   2.426 -17.273   1.649
  Start of MODEL    8
    1   1H    MET   1          HT1       MET   1 -10.198  -1.311 -17.972
    2   2H    MET   1          HT2       MET   1 -11.668  -0.501 -17.712
    3   3H    MET   1          HT3       MET   1 -10.383   0.296 -18.486
    4    HA   MET   1           HA       MET   1 -11.891  -2.033 -19.549
    5   1HB   MET   1          HB2       MET   1 -12.898   0.397 -19.489
    6   2HB   MET   1          HB1       MET   1 -11.752   0.702 -20.795
    7   1HG   MET   1          HG2       MET   1 -13.416  -1.767 -20.986
    8   2HG   MET   1          HG1       MET   1 -14.221  -0.225 -21.272
    9   1HE   MET   1          HE1       MET   1 -14.492  -2.072 -23.134
   10   2HE   MET   1          HE2       MET   1 -13.024  -2.929 -23.597
   11   3HE   MET   1          HE3       MET   1 -13.744  -1.766 -24.707
   12    H    ALA   2           HN       ALA   2 -10.383  -3.295 -20.545
   13    HA   ALA   2           HA       ALA   2  -8.627  -2.055 -22.567
   14   1HB   ALA   2          HB1       ALA   2  -6.759  -3.662 -21.506
   15   2HB   ALA   2          HB2       ALA   2  -7.657  -3.300 -20.033
   16   3HB   ALA   2          HB3       ALA   2  -6.954  -1.990 -20.982
   17    H    GLU   3           HN       GLU   3  -9.620  -3.216 -24.207
   18    HA   GLU   3           HA       GLU   3 -10.203  -6.068 -23.957
   19   1HB   GLU   3          HB2       GLU   3 -11.143  -4.043 -25.579
   20   2HB   GLU   3          HB1       GLU   3 -10.096  -4.941 -26.678
   21   1HG   GLU   3          HG2       GLU   3 -12.001  -6.200 -26.941
   22   2HG   GLU   3          HG1       GLU   3 -11.353  -7.019 -25.521
   23    H    GLN   4           HN       GLN   4  -8.662  -7.613 -24.155
   24    HA   GLN   4           HA       GLN   4  -6.554  -7.315 -26.212
   25   1HB   GLN   4          HB2       GLN   4  -4.839  -8.092 -24.439
   26   2HB   GLN   4          HB1       GLN   4  -5.335  -6.402 -24.399
   27   1HG   GLN   4          HG2       GLN   4  -6.405  -6.629 -22.398
   28   2HG   GLN   4          HG1       GLN   4  -7.030  -8.228 -22.803
   29   1HE2  GLN   4          HE21      GLN   4  -5.547 -10.097 -22.481
   30   2HE2  GLN   4          HE22      GLN   4  -4.231  -9.965 -21.419
   31    H    GLN   5           HN       GLN   5  -7.667  -9.043 -27.240
   32    HA   GLN   5           HA       GLN   5  -8.405 -11.249 -27.596
   33   1HB   GLN   5          HB2       GLN   5  -6.544 -12.855 -27.469
   34   2HB   GLN   5          HB1       GLN   5  -6.005 -11.318 -28.140
   35   1HG   GLN   5          HG2       GLN   5  -4.869 -10.714 -26.163
   36   2HG   GLN   5          HG1       GLN   5  -5.756 -11.884 -25.187
   37   1HE2  GLN   5          HE21      GLN   5  -5.060 -14.125 -25.244
   38   2HE2  GLN   5          HE22      GLN   5  -3.597 -14.588 -25.970
   39    H    GLN   6           HN       GLN   6  -9.488 -10.360 -25.156
   40    HA   GLN   6           HA       GLN   6 -10.048 -12.889 -23.864
   41   1HB   GLN   6          HB2       GLN   6  -7.846 -11.343 -22.834
   42   2HB   GLN   6          HB1       GLN   6  -9.150 -11.351 -21.647
   43   1HG   GLN   6          HG2       GLN   6  -9.251 -13.787 -21.710
   44   2HG   GLN   6          HG1       GLN   6  -8.041 -13.832 -22.993
   45   1HE2  GLN   6          HE21      GLN   6  -5.861 -12.708 -22.359
   46   2HE2  GLN   6          HE22      GLN   6  -5.331 -12.932 -20.761
   47    H    GLU   7           HN       GLU   7  -9.912  -9.588 -22.491
   48    HA   GLU   7           HA       GLU   7 -12.647  -8.906 -23.014
   49   1HB   GLU   7          HB2       GLU   7 -12.590 -10.901 -21.189
   50   2HB   GLU   7          HB1       GLU   7 -12.390  -9.521 -20.110
   51   1HG   GLU   7          HG2       GLU   7 -14.409  -8.766 -21.927
   52   2HG   GLU   7          HG1       GLU   7 -14.776 -10.432 -21.478
   53    H    GLN   8           HN       GLN   8 -13.335  -7.045 -21.439
   54    HA   GLN   8           HA       GLN   8 -11.002  -5.257 -21.143
   55   1HB   GLN   8          HB2       GLN   8 -12.673  -3.489 -20.793
   56   2HB   GLN   8          HB1       GLN   8 -13.049  -4.412 -22.246
   57   1HG   GLN   8          HG2       GLN   8 -14.959  -5.296 -21.351
   58   2HG   GLN   8          HG1       GLN   8 -14.264  -5.428 -19.737
   59   1HE2  GLN   8          HE21      GLN   8 -16.063  -3.311 -21.904
   60   2HE2  GLN   8          HE22      GLN   8 -16.367  -2.093 -20.761
   61    H    GLN   9           HN       GLN   9 -12.054  -7.582 -19.203
   62    HA   GLN   9           HA       GLN   9 -12.110  -5.987 -16.693
   63   1HB   GLN   9          HB2       GLN   9 -13.281  -8.482 -17.592
   64   2HB   GLN   9          HB1       GLN   9 -12.402  -8.694 -16.081
   65   1HG   GLN   9          HG2       GLN   9 -13.646  -6.909 -15.028
   66   2HG   GLN   9          HG1       GLN   9 -14.420  -6.491 -16.557
   67   1HE2  GLN   9          HE21      GLN   9 -16.172  -7.853 -17.312
   68   2HE2  GLN   9          HE22      GLN   9 -16.852  -9.067 -16.340
   69    H    ILE  10           HN       ILE  10  -9.735  -6.742 -18.446
   70    HA   ILE  10           HA       ILE  10  -8.042  -8.634 -17.226
   71    HB   ILE  10           HB       ILE  10  -7.570  -7.465 -19.385
   72   1HG1  ILE  10          HG12      ILE  10  -5.075  -7.025 -18.830
   73   2HG1  ILE  10          HG11      ILE  10  -5.498  -7.503 -17.187
   74   1HG2  ILE  10          HG21      ILE  10  -6.587  -5.167 -17.679
   75   2HG2  ILE  10          HG22      ILE  10  -8.180  -5.174 -18.436
   76   3HG2  ILE  10          HG23      ILE  10  -6.728  -5.231 -19.436
   77   1HD1  ILE  10          HD11      ILE  10  -4.656  -9.335 -18.844
   78   2HD1  ILE  10          HD12      ILE  10  -6.281  -9.238 -19.520
   79   3HD1  ILE  10          HD13      ILE  10  -6.055  -9.691 -17.831
   80    H    ARG  11           HN       ARG  11  -6.603  -8.560 -15.495
   81    HA   ARG  11           HA       ARG  11  -7.214  -6.735 -13.333
   82   1HB   ARG  11          HB2       ARG  11  -5.103  -8.860 -13.740
   83   2HB   ARG  11          HB1       ARG  11  -5.158  -7.872 -12.280
   84   1HG   ARG  11          HG2       ARG  11  -7.074  -8.869 -11.510
   85   2HG   ARG  11          HG1       ARG  11  -7.726  -9.106 -13.132
   86   1HD   ARG  11          HD2       ARG  11  -6.154 -10.955 -13.515
   87   2HD   ARG  11          HD1       ARG  11  -5.454 -10.705 -11.915
   88    HE   ARG  11           HE       ARG  11  -7.468 -11.604 -10.934
   89   1HH1  ARG  11          HH21      ARG  11  -7.092 -13.747 -12.902
   90   2HH1  ARG  11          HH22      ARG  11  -8.610 -13.801 -13.733
   91   1HH2  ARG  11          HH11      ARG  11  -9.621 -10.661 -12.638
   92   2HH2  ARG  11          HH12      ARG  11 -10.046 -12.049 -13.583
   93    H    VAL  12           HN       VAL  12  -5.139  -5.734 -12.151
   94    HA   VAL  12           HA       VAL  12  -4.211  -3.582 -13.808
   95    HB   VAL  12           HB       VAL  12  -4.461  -3.632 -11.248
   96   1HG1  VAL  12          HG11      VAL  12  -2.994  -5.723 -11.071
   97   2HG1  VAL  12          HG12      VAL  12  -2.630  -4.420  -9.940
   98   3HG1  VAL  12          HG13      VAL  12  -1.619  -4.659 -11.365
   99   1HG2  VAL  12          HG21      VAL  12  -3.318  -1.843 -12.714
  100   2HG2  VAL  12          HG22      VAL  12  -1.797  -2.564 -12.189
  101   3HG2  VAL  12          HG23      VAL  12  -2.897  -1.865 -11.002
  102    H    ARG  13           HN       ARG  13  -1.942  -3.098 -14.330
  103    HA   ARG  13           HA       ARG  13  -0.072  -5.381 -14.431
  104   1HB   ARG  13          HB2       ARG  13  -1.715  -4.832 -16.632
  105   2HB   ARG  13          HB1       ARG  13  -0.174  -4.078 -17.041
  106   1HG   ARG  13          HG2       ARG  13   0.501  -6.558 -15.897
  107   2HG   ARG  13          HG1       ARG  13  -0.864  -6.894 -16.962
  108   1HD   ARG  13          HD2       ARG  13   0.366  -5.522 -18.737
  109   2HD   ARG  13          HD1       ARG  13   1.774  -5.600 -17.678
  110    HE   ARG  13           HE       ARG  13   1.873  -7.993 -18.054
  111   1HH1  ARG  13          HH11      ARG  13   1.741  -7.197 -20.869
  112   2HH1  ARG  13          HH12      ARG  13   0.401  -8.105 -21.484
  113   1HH2  ARG  13          HH21      ARG  13  -0.903  -8.813 -18.341
  114   2HH2  ARG  13          HH22      ARG  13  -1.100  -9.023 -20.050
  115    H    ILE  14           HN       ILE  14   1.209  -4.070 -13.032
  116    HA   ILE  14           HA       ILE  14   2.712  -1.952 -14.455
  117    HB   ILE  14           HB       ILE  14   0.985  -0.713 -13.273
  118   1HG1  ILE  14          HG12      ILE  14   3.669  -0.220 -13.109
  119   2HG1  ILE  14          HG11      ILE  14   2.427   0.887 -12.533
  120   1HG2  ILE  14          HG21      ILE  14   0.682  -0.870 -10.854
  121   2HG2  ILE  14          HG22      ILE  14   1.951  -2.089 -10.749
  122   3HG2  ILE  14          HG23      ILE  14   0.446  -2.454 -11.590
  123   1HD1  ILE  14          HD11      ILE  14   2.652   0.094 -10.273
  124   2HD1  ILE  14          HD12      ILE  14   4.283   0.394 -10.872
  125   3HD1  ILE  14          HD13      ILE  14   3.666  -1.255 -10.783
  126    HA   PRO  15           HA       PRO  15   5.801  -4.424 -12.370
  127   1HB   PRO  15          HB2       PRO  15   7.892  -3.436 -13.857
  128   2HB   PRO  15          HB1       PRO  15   6.797  -4.707 -14.430
  129   1HG   PRO  15          HG2       PRO  15   6.920  -1.838 -15.227
  130   2HG   PRO  15          HG1       PRO  15   6.322  -3.232 -16.140
  131   1HD   PRO  15          HD2       PRO  15   4.729  -1.315 -14.784
  132   2HD   PRO  15          HD1       PRO  15   4.170  -2.864 -15.449
  133    H    ARG  16           HN       ARG  16   8.171  -3.704 -11.561
  134    HA   ARG  16           HA       ARG  16   9.454  -2.373 -10.133
  135   1HB   ARG  16          HB2       ARG  16   7.782  -0.039 -11.110
  136   2HB   ARG  16          HB1       ARG  16   9.385   0.029 -10.381
  137   1HG   ARG  16          HG2       ARG  16   9.102  -1.676 -12.807
  138   2HG   ARG  16          HG1       ARG  16   9.005   0.067 -13.051
  139   1HD   ARG  16          HD2       ARG  16  11.154   0.367 -11.895
  140   2HD   ARG  16          HD1       ARG  16  11.250  -1.370 -11.604
  141    HE   ARG  16           HE       ARG  16  11.618  -0.031 -14.222
  142   1HH1  ARG  16          HH21      ARG  16  10.089  -2.528 -14.687
  143   2HH1  ARG  16          HH22      ARG  16  11.337  -3.718 -14.846
  144   1HH2  ARG  16          HH11      ARG  16  13.791  -1.722 -13.407
  145   2HH2  ARG  16          HH12      ARG  16  13.440  -3.260 -14.119
  146    H    LYS  17           HN       LYS  17   8.783  -3.148  -8.154
  147    HA   LYS  17           HA       LYS  17   6.962  -1.431  -6.604
  148   1HB   LYS  17          HB2       LYS  17   5.399  -3.038  -7.624
  149   2HB   LYS  17          HB1       LYS  17   6.371  -4.379  -7.023
  150   1HG   LYS  17          HG2       LYS  17   5.696  -4.075  -4.835
  151   2HG   LYS  17          HG1       LYS  17   5.444  -2.342  -5.043
  152   1HD   LYS  17          HD2       LYS  17   3.629  -3.680  -6.786
  153   2HD   LYS  17          HD1       LYS  17   3.506  -4.448  -5.202
  154   1HE   LYS  17          HE2       LYS  17   3.459  -1.444  -5.566
  155   2HE   LYS  17          HE1       LYS  17   1.995  -2.425  -5.564
  156   1HZ   LYS  17          HZ1       LYS  17   3.982  -2.197  -3.369
  157   2HZ   LYS  17          HZ2       LYS  17   2.678  -3.286  -3.372
  158   3HZ   LYS  17          HZ3       LYS  17   2.391  -1.612  -3.365
  159    H    GLU  18           HN       GLU  18   8.569  -4.638  -6.499
  160    HA   GLU  18           HA       GLU  18   9.125  -4.617  -3.705
  161   1HB   GLU  18          HB2       GLU  18   9.504  -6.389  -5.801
  162   2HB   GLU  18          HB1       GLU  18  11.151  -5.978  -5.324
  163   1HG   GLU  18          HG2       GLU  18  10.812  -7.627  -3.775
  164   2HG   GLU  18          HG1       GLU  18  10.037  -6.321  -2.877
  165    H    GLU  19           HN       GLU  19  10.579  -2.769  -6.232
  166    HA   GLU  19           HA       GLU  19  13.101  -2.392  -4.731
  167   1HB   GLU  19          HB2       GLU  19  12.147  -1.417  -7.434
  168   2HB   GLU  19          HB1       GLU  19  13.693  -0.949  -6.725
  169   1HG   GLU  19          HG2       GLU  19  14.460  -2.805  -7.815
  170   2HG   GLU  19          HG1       GLU  19  13.817  -3.647  -6.405
  171    H    ASN  20           HN       ASN  20  10.045  -0.720  -5.238
  172    HA   ASN  20           HA       ASN  20  11.037   1.436  -3.458
  173   1HB   ASN  20          HB2       ASN  20  11.426   2.227  -5.782
  174   2HB   ASN  20          HB1       ASN  20   9.708   2.018  -6.121
  175   1HD2  ASN  20          HD21      ASN  20   8.246   3.633  -5.345
  176   2HD2  ASN  20          HD22      ASN  20   8.758   5.020  -4.511
  177    H    GLU  21           HN       GLU  21   8.115   0.760  -5.453
  178    HA   GLU  21           HA       GLU  21   6.264   1.885  -3.626
  179   1HB   GLU  21          HB2       GLU  21   6.132   0.583  -6.113
  180   2HB   GLU  21          HB1       GLU  21   5.110  -0.373  -5.039
  181   1HG   GLU  21          HG2       GLU  21   4.906   2.637  -5.099
  182   2HG   GLU  21          HG1       GLU  21   4.031   1.646  -6.265
  183    H    ILE  22           HN       ILE  22   5.769   1.257  -1.590
  184    HA   ILE  22           HA       ILE  22   6.140  -1.620  -0.852
  185    HB   ILE  22           HB       ILE  22   6.609   0.945   0.487
  186   1HG1  ILE  22          HG12      ILE  22   7.709  -1.050   2.027
  187   2HG1  ILE  22          HG11      ILE  22   7.616  -1.823   0.446
  188   1HG2  ILE  22          HG21      ILE  22   5.941   0.081   2.748
  189   2HG2  ILE  22          HG22      ILE  22   5.041  -1.196   1.930
  190   3HG2  ILE  22          HG23      ILE  22   4.584   0.490   1.701
  191   1HD1  ILE  22          HD11      ILE  22   8.761   0.950   0.825
  192   2HD1  ILE  22          HD12      ILE  22   8.915  -0.103  -0.582
  193   3HD1  ILE  22          HD13      ILE  22   9.754  -0.504   0.916
  194    H    LEU  23           HN       LEU  23   4.331  -2.667   0.428
  195    HA   LEU  23           HA       LEU  23   1.726  -1.183  -0.067
  196   1HB   LEU  23          HB2       LEU  23   0.628  -3.352  -0.482
  197   2HB   LEU  23          HB1       LEU  23   1.941  -3.091  -1.622
  198    HG   LEU  23           HG       LEU  23   3.190  -4.379   0.508
  199   1HD1  LEU  23          HD11      LEU  23   1.485  -6.484   0.393
  200   2HD1  LEU  23          HD12      LEU  23   0.328  -5.156   0.310
  201   3HD1  LEU  23          HD13      LEU  23   1.434  -5.278   1.678
  202   1HD2  LEU  23          HD21      LEU  23   1.990  -5.825  -1.857
  203   2HD2  LEU  23          HD22      LEU  23   3.529  -6.132  -1.057
  204   3HD2  LEU  23          HD23      LEU  23   3.325  -4.691  -2.051
  205    H    GLY  24           HN       GLY  24   0.718  -0.683   1.921
  206   1HA   GLY  24          HA2       GLY  24   1.095  -2.758   4.046
  207   2HA   GLY  24          HA1       GLY  24   1.501  -1.089   4.401
  208    H    ILE  25           HN       ILE  25  -0.283  -2.580   5.874
  209    HA   ILE  25           HA       ILE  25  -2.981  -1.497   5.200
  210    HB   ILE  25           HB       ILE  25  -3.571  -2.894   7.352
  211   1HG1  ILE  25          HG12      ILE  25  -0.976  -3.286   7.674
  212   2HG1  ILE  25          HG11      ILE  25  -2.115  -4.579   8.039
  213   1HG2  ILE  25          HG21      ILE  25  -4.383  -3.451   5.132
  214   2HG2  ILE  25          HG22      ILE  25  -3.857  -4.926   5.942
  215   3HG2  ILE  25          HG23      ILE  25  -2.835  -4.181   4.714
  216   1HD1  ILE  25          HD11      ILE  25  -1.055  -4.392   5.246
  217   2HD1  ILE  25          HD12      ILE  25  -1.526  -5.815   6.174
  218   3HD1  ILE  25          HD13      ILE  25   0.012  -5.018   6.502
  219    H    ILE  26           HN       ILE  26  -3.699   0.230   6.332
  220    HA   ILE  26           HA       ILE  26  -1.915   1.362   8.408
  221    HB   ILE  26           HB       ILE  26  -2.904   2.526   6.234
  222   1HG1  ILE  26          HG12      ILE  26  -2.978   4.452   8.413
  223   2HG1  ILE  26          HG11      ILE  26  -1.612   3.346   8.555
  224   1HG2  ILE  26          HG21      ILE  26  -5.271   2.171   7.089
  225   2HG2  ILE  26          HG22      ILE  26  -4.869   3.827   6.638
  226   3HG2  ILE  26          HG23      ILE  26  -4.905   3.360   8.338
  227   1HD1  ILE  26          HD11      ILE  26  -2.315   5.124   6.210
  228   2HD1  ILE  26          HD12      ILE  26  -1.145   3.811   6.089
  229   3HD1  ILE  26          HD13      ILE  26  -0.848   5.157   7.187
  230    H    GLU  27           HN       GLU  27  -2.715   2.269  10.296
  231    HA   GLU  27           HA       GLU  27  -5.421   1.461  11.236
  232   1HB   GLU  27          HB2       GLU  27  -2.788   0.834  12.609
  233   2HB   GLU  27          HB1       GLU  27  -4.346   0.771  13.433
  234   1HG   GLU  27          HG2       GLU  27  -4.289  -0.682  10.869
  235   2HG   GLU  27          HG1       GLU  27  -3.199  -1.338  12.088
  236    H    GLN  28           HN       GLN  28  -6.368   3.169  12.264
  237    HA   GLN  28           HA       GLN  28  -4.595   5.375  13.238
  238   1HB   GLN  28          HB2       GLN  28  -6.001   5.943  11.236
  239   2HB   GLN  28          HB1       GLN  28  -7.438   5.625  12.208
  240   1HG   GLN  28          HG2       GLN  28  -6.146   7.318  13.873
  241   2HG   GLN  28          HG1       GLN  28  -5.539   7.912  12.328
  242   1HE2  GLN  28          HE21      GLN  28  -7.062   8.925  10.865
  243   2HE2  GLN  28          HE22      GLN  28  -8.649   9.302  11.337
  244    H    MET  29           HN       MET  29  -4.535   4.330  15.354
  245    HA   MET  29           HA       MET  29  -6.951   3.772  16.847
  246   1HB   MET  29          HB2       MET  29  -4.061   3.715  17.337
  247   2HB   MET  29          HB1       MET  29  -4.975   4.268  18.740
  248   1HG   MET  29          HG2       MET  29  -5.813   1.813  17.197
  249   2HG   MET  29          HG1       MET  29  -4.614   1.718  18.485
  250   1HE   MET  29          HE1       MET  29  -9.061   1.847  18.733
  251   2HE   MET  29          HE2       MET  29  -7.981   0.601  18.115
  252   3HE   MET  29          HE3       MET  29  -8.057   2.168  17.313
  253    H    LEU  30           HN       LEU  30  -4.748   6.557  16.647
  254    HA   LEU  30           HA       LEU  30  -6.720   8.152  18.237
  255   1HB   LEU  30          HB2       LEU  30  -3.726   8.448  17.886
  256   2HB   LEU  30          HB1       LEU  30  -4.735   9.723  18.569
  257    HG   LEU  30           HG       LEU  30  -4.900   6.934  19.682
  258   1HD1  LEU  30          HD11      LEU  30  -3.138   7.544  21.311
  259   2HD1  LEU  30          HD12      LEU  30  -2.852   9.045  20.431
  260   3HD1  LEU  30          HD13      LEU  30  -2.503   7.493  19.667
  261   1HD2  LEU  30          HD21      LEU  30  -5.462   9.750  20.612
  262   2HD2  LEU  30          HD22      LEU  30  -5.267   8.437  21.775
  263   3HD2  LEU  30          HD23      LEU  30  -6.554   8.365  20.571
  264    H    GLY  31           HN       GLY  31  -7.833   9.633  17.055
  265   1HA   GLY  31          HA2       GLY  31  -7.115  10.143  14.263
  266   2HA   GLY  31          HA1       GLY  31  -8.514  10.805  15.112
  267    H    ALA  32           HN       ALA  32  -5.095  11.264  14.427
  268    HA   ALA  32           HA       ALA  32  -5.319  14.045  15.517
  269   1HB   ALA  32          HB1       ALA  32  -2.955  12.150  15.535
  270   2HB   ALA  32          HB2       ALA  32  -3.778  12.852  16.927
  271   3HB   ALA  32          HB3       ALA  32  -2.809  13.876  15.867
  272    H    SER  33           HN       SER  33  -2.951  12.324  13.441
  273    HA   SER  33           HA       SER  33  -3.712  13.870  11.080
  274   1HB   SER  33          HB2       SER  33  -1.580  14.814  12.856
  275   2HB   SER  33          HB1       SER  33  -1.025  14.567  11.203
  276    HG   SER  33           HG       SER  33  -2.974  16.305  12.218
  277    H    ARG  34           HN       ARG  34  -0.914  12.129  12.511
  278    HA   ARG  34           HA       ARG  34  -0.592  10.668   9.935
  279   1HB   ARG  34          HB2       ARG  34   1.222  11.130  12.300
  280   2HB   ARG  34          HB1       ARG  34   1.568   9.872  11.116
  281   1HG   ARG  34          HG2       ARG  34   2.652  11.552  10.020
  282   2HG   ARG  34          HG1       ARG  34   1.031  11.977   9.470
  283   1HD   ARG  34          HD2       ARG  34   0.824  13.727  11.002
  284   2HD   ARG  34          HD1       ARG  34   2.024  13.043  12.098
  285    HE   ARG  34           HE       ARG  34   3.746  14.029  10.776
  286   1HH1  ARG  34          HH11      ARG  34   1.628  16.210  10.492
  287   2HH1  ARG  34          HH12      ARG  34   1.677  16.505   8.786
  288   1HH2  ARG  34          HH21      ARG  34   3.387  13.567   8.059
  289   2HH2  ARG  34          HH22      ARG  34   2.675  15.005   7.405
  290    H    VAL  35           HN       VAL  35  -0.185   8.324  10.057
  291    HA   VAL  35           HA       VAL  35  -1.512   7.015  12.390
  292    HB   VAL  35           HB       VAL  35  -2.429   5.330  10.746
  293   1HG1  VAL  35          HG11      VAL  35  -3.413   8.171  10.445
  294   2HG1  VAL  35          HG12      VAL  35  -3.756   7.132  11.828
  295   3HG1  VAL  35          HG13      VAL  35  -4.355   6.698  10.227
  296   1HG2  VAL  35          HG21      VAL  35  -1.020   5.835   8.860
  297   2HG2  VAL  35          HG22      VAL  35  -1.579   7.507   8.835
  298   3HG2  VAL  35          HG23      VAL  35  -2.688   6.201   8.422
  299    H    ARG  36           HN       ARG  36  -1.142   4.657  12.376
  300    HA   ARG  36           HA       ARG  36   1.751   4.104  11.774
  301   1HB   ARG  36          HB2       ARG  36   1.235   2.133  13.469
  302   2HB   ARG  36          HB1       ARG  36   1.579   3.755  14.066
  303   1HG   ARG  36          HG2       ARG  36  -0.702   4.204  14.505
  304   2HG   ARG  36          HG1       ARG  36  -1.249   2.881  13.474
  305   1HD   ARG  36          HD2       ARG  36  -0.161   1.276  15.080
  306   2HD   ARG  36          HD1       ARG  36   0.156   2.644  16.147
  307    HE   ARG  36           HE       ARG  36  -2.635   2.565  15.440
  308   1HH1  ARG  36          HH21      ARG  36  -1.629   3.086  18.203
  309   2HH1  ARG  36          HH22      ARG  36  -2.099   1.648  19.046
  310   1HH2  ARG  36          HH11      ARG  36  -2.641  -0.191  16.148
  311   2HH2  ARG  36          HH12      ARG  36  -2.674  -0.212  17.879
  312    H    VAL  37           HN       VAL  37   2.237   2.473  10.305
  313    HA   VAL  37           HA       VAL  37   0.102   0.508   9.701
  314    HB   VAL  37           HB       VAL  37  -0.373   1.520   7.749
  315   1HG1  VAL  37          HG11      VAL  37   0.461   3.649   8.646
  316   2HG1  VAL  37          HG12      VAL  37   0.855   3.506   6.933
  317   3HG1  VAL  37          HG13      VAL  37   2.099   3.228   8.149
  318   1HG2  VAL  37          HG21      VAL  37   2.531   1.080   7.027
  319   2HG2  VAL  37          HG22      VAL  37   1.178   1.252   5.908
  320   3HG2  VAL  37          HG23      VAL  37   1.286  -0.166   6.949
  321    H    ARG  38           HN       ARG  38   0.804  -1.467   9.015
  322    HA   ARG  38           HA       ARG  38   3.780  -1.962   9.061
  323   1HB   ARG  38          HB2       ARG  38   3.008  -4.419   9.393
  324   2HB   ARG  38          HB1       ARG  38   2.860  -3.337  10.770
  325   1HG   ARG  38          HG2       ARG  38   0.457  -2.939  10.106
  326   2HG   ARG  38          HG1       ARG  38   0.647  -4.196   8.883
  327   1HD   ARG  38          HD2       ARG  38   1.509  -4.908  11.635
  328   2HD   ARG  38          HD1       ARG  38  -0.225  -4.702  11.395
  329    HE   ARG  38           HE       ARG  38   1.464  -6.683   9.927
  330   1HH1  ARG  38          HH21      ARG  38  -0.674  -7.286  12.085
  331   2HH1  ARG  38          HH22      ARG  38  -1.978  -7.837  11.088
  332   1HH2  ARG  38          HH11      ARG  38  -0.600  -6.603   8.146
  333   2HH2  ARG  38          HH12      ARG  38  -1.936  -7.448   8.853
  334    H    CYS  39           HN       CYS  39   4.629  -3.000   7.147
  335    HA   CYS  39           HA       CYS  39   2.573  -3.631   5.082
  336   1HB   CYS  39          HB2       CYS  39   3.295  -2.031   3.612
  337   2HB   CYS  39          HB1       CYS  39   3.662  -1.212   5.124
  338    HG   CYS  39           HG       CYS  39   6.138  -2.477   4.739
  339    H    LEU  40           HN       LEU  40   3.352  -4.651   3.190
  340    HA   LEU  40           HA       LEU  40   5.536  -6.555   3.668
  341   1HB   LEU  40          HB2       LEU  40   3.049  -6.619   2.206
  342   2HB   LEU  40          HB1       LEU  40   4.380  -6.972   1.118
  343    HG   LEU  40           HG       LEU  40   3.892  -9.091   1.938
  344   1HD1  LEU  40          HD11      LEU  40   5.735  -8.194   4.156
  345   2HD1  LEU  40          HD12      LEU  40   6.286  -8.378   2.491
  346   3HD1  LEU  40          HD13      LEU  40   5.661  -9.770   3.369
  347   1HD2  LEU  40          HD21      LEU  40   3.186  -9.546   4.248
  348   2HD2  LEU  40          HD22      LEU  40   2.158  -8.316   3.517
  349   3HD2  LEU  40          HD23      LEU  40   3.416  -7.848   4.661
  350    H    ASP  41           HN       ASP  41   6.667  -6.996   1.434
  351    HA   ASP  41           HA       ASP  41   8.196  -6.233  -0.175
  352   1HB   ASP  41          HB2       ASP  41   6.685  -3.630   0.246
  353   2HB   ASP  41          HB1       ASP  41   8.235  -3.639  -0.578
  354    H    GLY  42           HN       GLY  42   8.093  -6.433   2.801
  355   1HA   GLY  42          HA2       GLY  42   9.535  -6.301   4.594
  356   2HA   GLY  42          HA1       GLY  42  10.772  -5.825   3.447
  357    H    LYS  43           HN       LYS  43   7.818  -4.114   4.861
  358    HA   LYS  43           HA       LYS  43   9.792  -2.142   5.871
  359   1HB   LYS  43          HB2       LYS  43   8.734  -1.627   3.459
  360   2HB   LYS  43          HB1       LYS  43   7.516  -0.872   4.480
  361   1HG   LYS  43          HG2       LYS  43   9.126   0.827   4.082
  362   2HG   LYS  43          HG1       LYS  43   9.464   0.248   5.710
  363   1HD   LYS  43          HD2       LYS  43  11.006  -1.451   4.224
  364   2HD   LYS  43          HD1       LYS  43  11.090   0.016   3.253
  365   1HE   LYS  43          HE2       LYS  43  12.910  -0.020   4.905
  366   2HE   LYS  43          HE1       LYS  43  11.790   1.292   5.254
  367   1HZ   LYS  43          HZ1       LYS  43  11.431  -1.343   6.526
  368   2HZ   LYS  43          HZ2       LYS  43  10.911   0.185   7.058
  369   3HZ   LYS  43          HZ3       LYS  43  12.552  -0.238   7.155
  370    H    THR  44           HN       THR  44   9.053  -0.690   7.395
  371    HA   THR  44           HA       THR  44   6.314  -1.021   8.508
  372    HB   THR  44           HB       THR  44   8.387  -0.586  10.562
  373    HG1  THR  44           HG1      THR  44   9.491  -2.167   9.464
  374   1HG2  THR  44          HG21      THR  44   6.932  -2.012  11.853
  375   2HG2  THR  44          HG22      THR  44   6.103  -2.555  10.394
  376   3HG2  THR  44          HG23      THR  44   5.933  -0.886  10.935
  377    H    ARG  45           HN       ARG  45   5.480   1.005   8.395
  378    HA   ARG  45           HA       ARG  45   7.293   3.295   8.971
  379   1HB   ARG  45          HB2       ARG  45   5.553   3.629   6.591
  380   2HB   ARG  45          HB1       ARG  45   7.176   4.226   6.878
  381   1HG   ARG  45          HG2       ARG  45   7.471   2.628   5.168
  382   2HG   ARG  45          HG1       ARG  45   7.918   1.751   6.627
  383   1HD   ARG  45          HD2       ARG  45   6.478   0.223   5.618
  384   2HD   ARG  45          HD1       ARG  45   5.354   1.098   6.651
  385    HE   ARG  45           HE       ARG  45   5.695   1.794   3.770
  386   1HH1  ARG  45          HH21      ARG  45   3.962   3.211   5.981
  387   2HH1  ARG  45          HH22      ARG  45   2.392   2.683   5.490
  388   1HH2  ARG  45          HH11      ARG  45   3.586   0.180   3.412
  389   2HH2  ARG  45          HH12      ARG  45   2.177   0.950   4.053
  390    H    LEU  46           HN       LEU  46   6.217   5.342   9.197
  391    HA   LEU  46           HA       LEU  46   3.394   5.097  10.158
  392   1HB   LEU  46          HB2       LEU  46   5.716   6.801  10.888
  393   2HB   LEU  46          HB1       LEU  46   4.184   7.664  10.753
  394    HG   LEU  46           HG       LEU  46   3.132   6.132  12.336
  395   1HD1  LEU  46          HD11      LEU  46   5.802   4.719  12.174
  396   2HD1  LEU  46          HD12      LEU  46   4.196   4.046  11.896
  397   3HD1  LEU  46          HD13      LEU  46   4.700   4.479  13.529
  398   1HD2  LEU  46          HD21      LEU  46   4.524   8.105  13.127
  399   2HD2  LEU  46          HD22      LEU  46   5.825   6.958  13.446
  400   3HD2  LEU  46          HD23      LEU  46   4.298   6.824  14.318
  401    H    GLY  47           HN       GLY  47   1.886   5.828   8.660
  402   1HA   GLY  47          HA2       GLY  47   2.950   7.223   6.282
  403   2HA   GLY  47          HA1       GLY  47   1.388   6.432   6.391
  404    H    ARG  48           HN       ARG  48   2.198   9.117   5.465
  405    HA   ARG  48           HA       ARG  48   0.630  10.822   7.326
  406   1HB   ARG  48          HB2       ARG  48   1.601  12.738   6.002
  407   2HB   ARG  48          HB1       ARG  48   2.785  11.798   6.903
  408   1HG   ARG  48          HG2       ARG  48   3.897  11.341   5.000
  409   2HG   ARG  48          HG1       ARG  48   2.452  10.599   4.316
  410   1HD   ARG  48          HD2       ARG  48   3.249  12.469   2.907
  411   2HD   ARG  48          HD1       ARG  48   1.651  12.804   3.573
  412    HE   ARG  48           HE       ARG  48   3.289  13.976   5.425
  413   1HH1  ARG  48          HH21      ARG  48   1.991  14.855   2.505
  414   2HH1  ARG  48          HH22      ARG  48   3.138  16.102   2.146
  415   1HH2  ARG  48          HH11      ARG  48   5.282  15.255   4.743
  416   2HH2  ARG  48          HH12      ARG  48   5.003  16.328   3.413
  417    H    ILE  49           HN       ILE  49  -1.229  11.819   6.595
  418    HA   ILE  49           HA       ILE  49  -2.008  11.383   3.747
  419    HB   ILE  49           HB       ILE  49  -3.057   9.975   5.964
  420   1HG1  ILE  49          HG12      ILE  49  -4.545  10.218   3.366
  421   2HG1  ILE  49          HG11      ILE  49  -2.919   9.536   3.375
  422   1HG2  ILE  49          HG21      ILE  49  -5.207  11.775   4.831
  423   2HG2  ILE  49          HG22      ILE  49  -4.411  12.099   6.371
  424   3HG2  ILE  49          HG23      ILE  49  -5.348  10.621   6.156
  425   1HD1  ILE  49          HD11      ILE  49  -4.315   7.654   3.668
  426   2HD1  ILE  49          HD12      ILE  49  -5.392   8.515   4.768
  427   3HD1  ILE  49          HD13      ILE  49  -3.781   8.035   5.305
  428    HA   PRO  50           HA       PRO  50  -3.337  15.587   4.007
  429   1HB   PRO  50          HB2       PRO  50  -5.326  15.592   2.105
  430   2HB   PRO  50          HB1       PRO  50  -3.597  15.564   1.722
  431   1HG   PRO  50          HG2       PRO  50  -5.591  13.349   1.572
  432   2HG   PRO  50          HG1       PRO  50  -4.099  13.581   0.645
  433   1HD   PRO  50          HD2       PRO  50  -4.421  11.827   2.832
  434   2HD   PRO  50          HD1       PRO  50  -2.870  12.339   2.133
  435    H    GLY  51           HN       GLY  51  -6.054  13.250   3.915
  436   1HA   GLY  51          HA2       GLY  51  -7.317  13.465   6.231
  437   2HA   GLY  51          HA1       GLY  51  -7.675  15.075   5.615
  438    H    ARG  52           HN       ARG  52  -7.535  12.164   3.578
  439    HA   ARG  52           HA       ARG  52 -10.106  12.707   2.408
  440   1HB   ARG  52          HB2       ARG  52  -8.150  11.374   1.393
  441   2HB   ARG  52          HB1       ARG  52  -8.720  10.020   2.367
  442   1HG   ARG  52          HG2       ARG  52  -9.802   9.751   0.267
  443   2HG   ARG  52          HG1       ARG  52 -11.031  10.451   1.321
  444   1HD   ARG  52          HD2       ARG  52 -10.319  12.731   0.443
  445   2HD   ARG  52          HD1       ARG  52  -9.363  11.875  -0.766
  446    HE   ARG  52           HE       ARG  52 -12.337  11.619  -0.543
  447   1HH1  ARG  52          HH11      ARG  52 -10.976   9.537  -2.186
  448   2HH1  ARG  52          HH12      ARG  52 -11.008  10.232  -3.772
  449   1HH2  ARG  52          HH21      ARG  52 -11.694  13.445  -2.640
  450   2HH2  ARG  52          HH22      ARG  52 -11.415  12.450  -4.030
  451    H    LEU  53           HN       LEU  53  -9.014  10.353   4.862
  452    HA   LEU  53           HA       LEU  53 -11.494   8.991   5.210
  453   1HB   LEU  53          HB2       LEU  53  -9.161   9.481   7.072
  454   2HB   LEU  53          HB1       LEU  53 -10.557   8.515   7.549
  455    HG   LEU  53           HG       LEU  53  -9.931   7.485   5.060
  456   1HD1  LEU  53          HD11      LEU  53  -7.837   8.449   4.719
  457   2HD1  LEU  53          HD12      LEU  53  -7.390   6.962   5.556
  458   3HD1  LEU  53          HD13      LEU  53  -7.460   8.485   6.442
  459   1HD2  LEU  53          HD21      LEU  53  -9.019   6.597   7.815
  460   2HD2  LEU  53          HD22      LEU  53  -9.013   5.569   6.383
  461   3HD2  LEU  53          HD23      LEU  53 -10.539   6.173   7.029
  462    H    LYS  54           HN       LYS  54 -10.137  11.764   7.036
  463    HA   LYS  54           HA       LYS  54 -12.336  12.142   8.793
  464   1HB   LYS  54          HB2       LYS  54  -9.917  13.504   8.162
  465   2HB   LYS  54          HB1       LYS  54 -11.218  14.691   8.087
  466   1HG   LYS  54          HG2       LYS  54 -11.633  14.571  10.325
  467   2HG   LYS  54          HG1       LYS  54 -11.365  12.829  10.381
  468   1HD   LYS  54          HD2       LYS  54  -8.989  14.556   9.856
  469   2HD   LYS  54          HD1       LYS  54  -9.645  14.563  11.492
  470   1HE   LYS  54          HE2       LYS  54  -9.288  11.909  10.169
  471   2HE   LYS  54          HE1       LYS  54  -7.835  12.750  10.711
  472   1HZ   LYS  54          HZ1       LYS  54  -8.842  12.962  12.911
  473   2HZ   LYS  54          HZ2       LYS  54  -8.695  11.334  12.449
  474   3HZ   LYS  54          HZ3       LYS  54 -10.207  12.106  12.381
  475    H    ASN  55           HN       ASN  55 -12.008  12.956   5.398
  476    HA   ASN  55           HA       ASN  55 -14.511  14.573   5.525
  477   1HB   ASN  55          HB2       ASN  55 -12.100  14.611   3.842
  478   2HB   ASN  55          HB1       ASN  55 -13.606  14.754   2.935
  479   1HD2  ASN  55          HD21      ASN  55 -15.109  16.553   3.609
  480   2HD2  ASN  55          HD22      ASN  55 -14.462  17.932   4.358
  481    H    ARG  56           HN       ARG  56 -13.787  11.388   5.122
  482    HA   ARG  56           HA       ARG  56 -16.020  11.029   3.167
  483   1HB   ARG  56          HB2       ARG  56 -13.298   9.797   3.196
  484   2HB   ARG  56          HB1       ARG  56 -14.652   8.785   2.691
  485   1HG   ARG  56          HG2       ARG  56 -15.265  10.931   1.241
  486   2HG   ARG  56          HG1       ARG  56 -13.537  11.242   1.396
  487   1HD   ARG  56          HD2       ARG  56 -13.866   9.943  -0.614
  488   2HD   ARG  56          HD1       ARG  56 -13.121   8.889   0.586
  489    HE   ARG  56           HE       ARG  56 -15.984   8.658   0.731
  490   1HH1  ARG  56          HH21      ARG  56 -15.667   8.461  -2.208
  491   2HH1  ARG  56          HH22      ARG  56 -15.316   6.781  -2.444
  492   1HH2  ARG  56          HH11      ARG  56 -14.479   6.214   0.880
  493   2HH2  ARG  56          HH12      ARG  56 -14.641   5.506  -0.693
  494    H    ILE  57           HN       ILE  57 -14.083   8.811   5.240
  495    HA   ILE  57           HA       ILE  57 -16.655   8.008   6.544
  496    HB   ILE  57           HB       ILE  57 -15.862   6.328   4.865
  497   1HG1  ILE  57          HG12      ILE  57 -15.598   5.227   7.666
  498   2HG1  ILE  57          HG11      ILE  57 -17.143   5.801   7.037
  499   1HG2  ILE  57          HG21      ILE  57 -13.414   6.762   5.254
  500   2HG2  ILE  57          HG22      ILE  57 -13.844   5.052   5.301
  501   3HG2  ILE  57          HG23      ILE  57 -13.564   5.931   6.803
  502   1HD1  ILE  57          HD11      ILE  57 -15.510   3.849   5.435
  503   2HD1  ILE  57          HD12      ILE  57 -17.251   4.127   5.404
  504   3HD1  ILE  57          HD13      ILE  57 -16.520   3.271   6.761
  505    H    TRP  58           HN       TRP  58 -16.511   7.358   8.721
  506    HA   TRP  58           HA       TRP  58 -13.986   8.186  10.093
  507   1HB   TRP  58          HB2       TRP  58 -16.733   8.868  10.554
  508   2HB   TRP  58          HB1       TRP  58 -16.150   7.958  11.947
  509    HD1  TRP  58           HD1      TRP  58 -13.842   8.887  13.102
  510    HE1  TRP  58           HE1      TRP  58 -12.999  11.311  13.350
  511    HE3  TRP  58           HE3      TRP  58 -16.693  11.183   9.540
  512    HZ2  TRP  58           HZ2      TRP  58 -13.472  13.883  12.192
  513    HZ3  TRP  58           HZ3      TRP  58 -16.477  13.617   9.135
  514    HH2  TRP  58           HH2      TRP  58 -14.871  14.969  10.454
  515    H    VAL  59           HN       VAL  59 -13.394   5.867   9.369
  516    HA   VAL  59           HA       VAL  59 -14.611   3.695  10.919
  517    HB   VAL  59           HB       VAL  59 -12.830   3.960   8.627
  518   1HG1  VAL  59          HG11      VAL  59 -11.504   1.899   9.061
  519   2HG1  VAL  59          HG12      VAL  59 -12.082   1.905  10.727
  520   3HG1  VAL  59          HG13      VAL  59 -11.063   3.221  10.143
  521   1HG2  VAL  59          HG21      VAL  59 -14.417   1.637   9.758
  522   2HG2  VAL  59          HG22      VAL  59 -13.758   1.732   8.125
  523   3HG2  VAL  59          HG23      VAL  59 -15.030   2.845   8.629
  524    H    ARG  60           HN       ARG  60 -13.627   2.620  12.672
  525    HA   ARG  60           HA       ARG  60 -12.024   4.181  14.448
  526   1HB   ARG  60          HB2       ARG  60 -12.688   1.232  14.347
  527   2HB   ARG  60          HB1       ARG  60 -11.679   1.917  15.621
  528   1HG   ARG  60          HG2       ARG  60 -13.940   3.614  15.381
  529   2HG   ARG  60          HG1       ARG  60 -14.549   1.960  15.386
  530   1HD   ARG  60          HD2       ARG  60 -12.571   3.034  17.417
  531   2HD   ARG  60          HD1       ARG  60 -14.312   2.957  17.685
  532    HE   ARG  60           HE       ARG  60 -12.574   0.554  17.285
  533   1HH1  ARG  60          HH21      ARG  60 -13.583   1.287  20.028
  534   2HH1  ARG  60          HH22      ARG  60 -14.991   0.289  20.169
  535   1HH2  ARG  60          HH11      ARG  60 -15.187  -0.376  16.764
  536   2HH2  ARG  60          HH12      ARG  60 -15.902  -0.655  18.318
  537    H    GLU  61           HN       GLU  61 -11.063   1.140  12.794
  538    HA   GLU  61           HA       GLU  61  -8.573   2.209  11.819
  539   1HB   GLU  61          HB2       GLU  61  -7.111   0.734  13.326
  540   2HB   GLU  61          HB1       GLU  61  -7.766   2.194  14.063
  541   1HG   GLU  61          HG2       GLU  61  -8.908   0.994  15.593
  542   2HG   GLU  61          HG1       GLU  61  -9.627  -0.020  14.344
  543    H    GLY  62           HN       GLY  62  -8.250   1.002  10.019
  544   1HA   GLY  62          HA2       GLY  62  -7.677  -1.596   9.639
  545   2HA   GLY  62          HA1       GLY  62  -9.423  -1.711   9.858
  546    H    ASP  63           HN       ASP  63  -6.971   0.015   7.908
  547    HA   ASP  63           HA       ASP  63  -8.806  -0.234   5.560
  548   1HB   ASP  63          HB2       ASP  63  -7.223   2.261   6.230
  549   2HB   ASP  63          HB1       ASP  63  -8.295   2.042   4.851
  550    H    VAL  64           HN       VAL  64  -7.563  -0.083   3.444
  551    HA   VAL  64           HA       VAL  64  -4.734  -0.988   3.893
  552    HB   VAL  64           HB       VAL  64  -6.310  -1.439   1.367
  553   1HG1  VAL  64          HG11      VAL  64  -4.028  -1.871   1.006
  554   2HG1  VAL  64          HG12      VAL  64  -4.687  -3.462   1.385
  555   3HG1  VAL  64          HG13      VAL  64  -3.813  -2.553   2.617
  556   1HG2  VAL  64          HG21      VAL  64  -7.676  -2.495   3.017
  557   2HG2  VAL  64          HG22      VAL  64  -6.268  -3.079   3.905
  558   3HG2  VAL  64          HG23      VAL  64  -6.678  -3.781   2.339
  559    H    VAL  65           HN       VAL  65  -3.083   0.123   2.836
  560    HA   VAL  65           HA       VAL  65  -3.897   2.291   0.963
  561    HB   VAL  65           HB       VAL  65  -2.428   3.890   2.153
  562   1HG1  VAL  65          HG11      VAL  65  -4.104   4.529   3.557
  563   2HG1  VAL  65          HG12      VAL  65  -4.165   2.961   4.362
  564   3HG1  VAL  65          HG13      VAL  65  -4.976   3.189   2.814
  565   1HG2  VAL  65          HG21      VAL  65  -1.506   3.347   4.333
  566   2HG2  VAL  65          HG22      VAL  65  -0.954   2.129   3.186
  567   3HG2  VAL  65          HG23      VAL  65  -2.265   1.757   4.306
  568    H    ILE  66           HN       ILE  66  -2.268   3.058  -0.414
  569    HA   ILE  66           HA       ILE  66   0.062   1.194  -0.773
  570    HB   ILE  66           HB       ILE  66   0.274   2.357  -3.024
  571   1HG1  ILE  66          HG12      ILE  66  -2.519   3.388  -2.518
  572   2HG1  ILE  66          HG11      ILE  66  -1.109   4.374  -2.134
  573   1HG2  ILE  66          HG21      ILE  66  -0.903   0.179  -2.728
  574   2HG2  ILE  66          HG22      ILE  66  -1.580   1.137  -4.043
  575   3HG2  ILE  66          HG23      ILE  66  -2.414   1.057  -2.492
  576   1HD1  ILE  66          HD11      ILE  66  -0.322   3.901  -4.532
  577   2HD1  ILE  66          HD12      ILE  66  -1.698   4.988  -4.353
  578   3HD1  ILE  66          HD13      ILE  66  -1.957   3.311  -4.831
  579    H    VAL  67           HN       VAL  67   2.220   2.114  -0.520
  580    HA   VAL  67           HA       VAL  67   2.184   5.043   0.081
  581    HB   VAL  67           HB       VAL  67   2.940   4.822   2.227
  582   1HG1  VAL  67          HG11      VAL  67   1.854   2.009   1.964
  583   2HG1  VAL  67          HG12      VAL  67   0.809   3.429   1.920
  584   3HG1  VAL  67          HG13      VAL  67   1.764   3.083   3.360
  585   1HG2  VAL  67          HG21      VAL  67   4.391   3.030   3.018
  586   2HG2  VAL  67          HG22      VAL  67   5.035   3.649   1.504
  587   3HG2  VAL  67          HG23      VAL  67   4.148   2.126   1.526
  588    H    LYS  68           HN       LYS  68   4.182   6.109   0.184
  589    HA   LYS  68           HA       LYS  68   6.270   4.943  -1.524
  590   1HB   LYS  68          HB2       LYS  68   5.120   7.534  -1.385
  591   2HB   LYS  68          HB1       LYS  68   6.827   7.664  -0.982
  592   1HG   LYS  68          HG2       LYS  68   7.207   6.177  -3.075
  593   2HG   LYS  68          HG1       LYS  68   5.557   6.625  -3.510
  594   1HD   LYS  68          HD2       LYS  68   6.287   8.606  -4.284
  595   2HD   LYS  68          HD1       LYS  68   6.931   8.996  -2.688
  596   1HE   LYS  68          HE2       LYS  68   9.000   7.731  -3.240
  597   2HE   LYS  68          HE1       LYS  68   8.360   7.425  -4.854
  598   1HZ   LYS  68          HZ1       LYS  68   8.265   9.805  -5.235
  599   2HZ   LYS  68          HZ2       LYS  68   9.846   9.334  -4.827
  600   3HZ   LYS  68          HZ3       LYS  68   8.862  10.107  -3.677
  601    HA   PRO  69           HA       PRO  69   8.852   4.668   2.018
  602   1HB   PRO  69          HB2       PRO  69  11.277   4.475   0.780
  603   2HB   PRO  69          HB1       PRO  69  10.066   3.181   0.744
  604   1HG   PRO  69          HG2       PRO  69  10.902   5.016  -1.437
  605   2HG   PRO  69          HG1       PRO  69  10.117   3.433  -1.548
  606   1HD   PRO  69          HD2       PRO  69   8.870   6.014  -1.799
  607   2HD   PRO  69          HD1       PRO  69   8.073   4.426  -1.815
  608    H    TRP  70           HN       TRP  70   9.990   5.909   3.395
  609    HA   TRP  70           HA       TRP  70  11.043   8.554   2.483
  610   1HB   TRP  70          HB2       TRP  70   9.762   7.759   5.092
  611   2HB   TRP  70          HB1       TRP  70  10.688   9.236   4.907
  612    HD1  TRP  70           HD1      TRP  70   8.433   7.710   2.317
  613    HE1  TRP  70           HE1      TRP  70   6.588   9.290   1.918
  614    HE3  TRP  70           HE3      TRP  70   9.447  11.193   5.876
  615    HZ2  TRP  70           HZ2      TRP  70   5.560  11.736   2.902
  616    HZ3  TRP  70           HZ3      TRP  70   7.978  13.181   6.125
  617    HH2  TRP  70           HH2      TRP  70   6.021  13.457   4.628
  618    H    GLU  71           HN       GLU  71  13.422   8.374   2.751
  619    HA   GLU  71           HA       GLU  71  15.488   7.577   3.590
  620   1HB   GLU  71          HB2       GLU  71  13.971   7.761   6.213
  621   2HB   GLU  71          HB1       GLU  71  15.719   7.800   6.010
  622   1HG   GLU  71          HG2       GLU  71  15.480   9.866   4.630
  623   2HG   GLU  71          HG1       GLU  71  13.749   9.854   4.967
  624    H    VAL  72           HN       VAL  72  15.949   5.853   5.921
  625    HA   VAL  72           HA       VAL  72  14.317   3.442   5.512
  626    HB   VAL  72           HB       VAL  72  17.233   3.519   4.665
  627   1HG1  VAL  72          HG11      VAL  72  17.105   1.455   5.764
  628   2HG1  VAL  72          HG12      VAL  72  16.637   1.023   4.119
  629   3HG1  VAL  72          HG13      VAL  72  15.402   1.234   5.359
  630   1HG2  VAL  72          HG21      VAL  72  14.618   2.989   3.236
  631   2HG2  VAL  72          HG22      VAL  72  16.169   2.485   2.568
  632   3HG2  VAL  72          HG23      VAL  72  15.843   4.195   2.845
  633    H    GLN  73           HN       GLN  73  17.708   3.591   6.570
  634    HA   GLN  73           HA       GLN  73  17.583   2.017   8.809
  635   1HB   GLN  73          HB2       GLN  73  19.212   4.542   8.474
  636   2HB   GLN  73          HB1       GLN  73  19.498   3.337   9.728
  637   1HG   GLN  73          HG2       GLN  73  19.372   1.764   7.484
  638   2HG   GLN  73          HG1       GLN  73  20.121   3.228   6.846
  639   1HE2  GLN  73          HE21      GLN  73  22.259   3.801   7.632
  640   2HE2  GLN  73          HE22      GLN  73  23.180   2.738   8.582
  641    H    GLY  74           HN       GLY  74  17.101   2.190  10.969
  642   1HA   GLY  74          HA2       GLY  74  16.404   3.251  12.992
  643   2HA   GLY  74          HA1       GLY  74  16.128   4.742  12.090
  644    H    ASP  75           HN       ASP  75  14.398   4.127  10.160
  645    HA   ASP  75           HA       ASP  75  12.259   2.359  10.612
  646   1HB   ASP  75          HB2       ASP  75  10.575   3.914  11.588
  647   2HB   ASP  75          HB1       ASP  75  11.855   3.532  12.730
  648    H    GLN  76           HN       GLN  76  10.360   2.967   9.130
  649    HA   GLN  76           HA       GLN  76  11.387   4.942   7.119
  650   1HB   GLN  76          HB2       GLN  76  11.189   2.601   6.332
  651   2HB   GLN  76          HB1       GLN  76   9.466   2.638   6.699
  652   1HG   GLN  76          HG2       GLN  76   8.979   3.829   4.832
  653   2HG   GLN  76          HG1       GLN  76  10.350   4.911   5.060
  654   1HE2  GLN  76          HE21      GLN  76   9.165   2.518   3.012
  655   2HE2  GLN  76          HE22      GLN  76  10.630   2.034   2.304
  656    H    LYS  77           HN       LYS  77   9.976   6.404   6.159
  657    HA   LYS  77           HA       LYS  77   7.336   6.807   7.549
  658   1HB   LYS  77          HB2       LYS  77   9.298   8.800   6.408
  659   2HB   LYS  77          HB1       LYS  77   7.608   9.214   6.668
  660   1HG   LYS  77          HG2       LYS  77   9.412   8.103   8.835
  661   2HG   LYS  77          HG1       LYS  77   9.142   9.827   8.582
  662   1HD   LYS  77          HD2       LYS  77   6.697   9.463   8.877
  663   2HD   LYS  77          HD1       LYS  77   7.013   7.762   9.219
  664   1HE   LYS  77          HE2       LYS  77   8.377   9.946  10.789
  665   2HE   LYS  77          HE1       LYS  77   6.774   9.366  11.238
  666   1HZ   LYS  77          HZ1       LYS  77   8.360   8.108  12.448
  667   2HZ   LYS  77          HZ2       LYS  77   9.277   7.783  11.055
  668   3HZ   LYS  77          HZ3       LYS  77   7.739   7.084  11.246
  669    H    CYS  78           HN       CYS  78   5.545   7.393   6.016
  670    HA   CYS  78           HA       CYS  78   6.317   6.895   3.188
  671   1HB   CYS  78          HB2       CYS  78   4.788   5.110   2.879
  672   2HB   CYS  78          HB1       CYS  78   5.666   4.727   4.356
  673    HG   CYS  78           HG       CYS  78   2.822   6.034   4.442
  674    H    ASP  79           HN       ASP  79   4.705   7.488   1.592
  675    HA   ASP  79           HA       ASP  79   2.667   9.365   2.877
  676   1HB   ASP  79          HB2       ASP  79   2.435  10.316   0.469
  677   2HB   ASP  79          HB1       ASP  79   3.860  10.775   1.392
  678    H    ILE  80           HN       ILE  80   0.657   8.450   2.911
  679    HA   ILE  80           HA       ILE  80   0.280   6.116   1.107
  680    HB   ILE  80           HB       ILE  80  -1.503   5.393   2.634
  681   1HG1  ILE  80          HG12      ILE  80  -1.690   7.974   3.427
  682   2HG1  ILE  80          HG11      ILE  80  -2.267   6.622   4.394
  683   1HG2  ILE  80          HG21      ILE  80   1.320   5.582   3.174
  684   2HG2  ILE  80          HG22      ILE  80   0.205   4.245   3.449
  685   3HG2  ILE  80          HG23      ILE  80   0.397   5.493   4.674
  686   1HD1  ILE  80          HD11      ILE  80  -0.401   6.683   5.818
  687   2HD1  ILE  80          HD12      ILE  80  -0.745   8.388   5.531
  688   3HD1  ILE  80          HD13      ILE  80   0.569   7.596   4.663
  689    H    ILE  81           HN       ILE  81  -1.714   5.496   0.418
  690    HA   ILE  81           HA       ILE  81  -3.655   7.662  -0.257
  691    HB   ILE  81           HB       ILE  81  -2.205   5.777  -1.990
  692   1HG1  ILE  81          HG12      ILE  81  -3.592   7.375  -3.657
  693   2HG1  ILE  81          HG11      ILE  81  -3.734   8.325  -2.178
  694   1HG2  ILE  81          HG21      ILE  81  -4.159   4.388  -1.899
  695   2HG2  ILE  81          HG22      ILE  81  -4.245   5.284  -3.414
  696   3HG2  ILE  81          HG23      ILE  81  -5.231   5.781  -2.039
  697   1HD1  ILE  81          HD11      ILE  81  -1.492   8.141  -3.922
  698   2HD1  ILE  81          HD12      ILE  81  -1.033   7.381  -2.397
  699   3HD1  ILE  81          HD13      ILE  81  -1.617   9.045  -2.413
  700    H    TRP  82           HN       TRP  82  -5.585   7.167   0.755
  701    HA   TRP  82           HA       TRP  82  -5.818   4.488   1.981
  702   1HB   TRP  82          HB2       TRP  82  -6.239   6.058   3.621
  703   2HB   TRP  82          HB1       TRP  82  -6.999   7.185   2.500
  704    HD1  TRP  82           HD1      TRP  82  -7.731   3.834   4.268
  705    HE1  TRP  82           HE1      TRP  82 -10.286   3.613   4.541
  706    HE3  TRP  82           HE3      TRP  82  -9.245   8.009   1.760
  707    HZ2  TRP  82           HZ2      TRP  82 -12.659   5.025   3.791
  708    HZ3  TRP  82           HZ3      TRP  82 -11.652   8.550   1.553
  709    HH2  TRP  82           HH2      TRP  82 -13.361   7.066   2.564
  710    H    ARG  83           HN       ARG  83  -7.344   3.033   1.557
  711    HA   ARG  83           HA       ARG  83  -9.879   3.395   0.380
  712   1HB   ARG  83          HB2       ARG  83  -7.827   3.719  -1.536
  713   2HB   ARG  83          HB1       ARG  83  -8.483   2.106  -1.814
  714   1HG   ARG  83          HG2       ARG  83 -10.472   2.910  -2.554
  715   2HG   ARG  83          HG1       ARG  83 -10.536   4.155  -1.307
  716   1HD   ARG  83          HD2       ARG  83  -8.436   4.996  -2.903
  717   2HD   ARG  83          HD1       ARG  83  -9.578   4.338  -4.073
  718    HE   ARG  83           HE       ARG  83  -9.997   6.717  -2.406
  719   1HH1  ARG  83          HH11      ARG  83 -10.734   6.502  -5.316
  720   2HH1  ARG  83          HH12      ARG  83 -12.458   6.361  -5.240
  721   1HH2  ARG  83          HH21      ARG  83 -12.508   5.545  -1.863
  722   2HH2  ARG  83          HH22      ARG  83 -13.465   5.817  -3.281
  723    H    TYR  84           HN       TYR  84 -10.222   1.055  -1.045
  724    HA   TYR  84           HA       TYR  84 -10.531  -1.240  -0.772
  725   1HB   TYR  84          HB2       TYR  84  -7.945  -1.367   0.759
  726   2HB   TYR  84          HB1       TYR  84  -8.615  -2.534  -0.375
  727    HD1  TYR  84           HD1      TYR  84  -9.148  -1.325  -2.809
  728    HD2  TYR  84           HD2      TYR  84  -6.075  -0.225  -0.016
  729    HE1  TYR  84           HE1      TYR  84  -7.853  -0.276  -4.644
  730    HE2  TYR  84           HE2      TYR  84  -4.781   0.824  -1.851
  731    HH   TYR  84           HH       TYR  84  -4.999   0.240  -4.820
  732    H    THR  85           HN       THR  85 -12.307  -1.026   0.674
  733    HA   THR  85           HA       THR  85 -11.910  -0.788   3.548
  734    HB   THR  85           HB       THR  85 -14.003  -0.063   2.342
  735    HG1  THR  85           HG1      THR  85 -14.493  -0.236   4.384
  736   1HG2  THR  85          HG21      THR  85 -15.602  -1.673   1.595
  737   2HG2  THR  85          HG22      THR  85 -14.691  -3.008   2.301
  738   3HG2  THR  85          HG23      THR  85 -14.060  -2.159   0.890
  739    H    LYS  86           HN       LYS  86 -12.162  -3.447   1.259
  740    HA   LYS  86           HA       LYS  86 -12.189  -5.415   3.496
  741   1HB   LYS  86          HB2       LYS  86 -12.800  -7.070   1.816
  742   2HB   LYS  86          HB1       LYS  86 -13.857  -5.670   1.642
  743   1HG   LYS  86          HG2       LYS  86 -12.154  -4.831  -0.110
  744   2HG   LYS  86          HG1       LYS  86 -11.519  -6.476  -0.094
  745   1HD   LYS  86          HD2       LYS  86 -13.172  -7.131  -1.469
  746   2HD   LYS  86          HD1       LYS  86 -14.367  -6.638  -0.269
  747   1HE   LYS  86          HE2       LYS  86 -14.468  -4.410  -1.157
  748   2HE   LYS  86          HE1       LYS  86 -13.059  -4.689  -2.181
  749   1HZ   LYS  86          HZ1       LYS  86 -14.316  -6.334  -3.416
  750   2HZ   LYS  86          HZ2       LYS  86 -15.124  -4.839  -3.432
  751   3HZ   LYS  86          HZ3       LYS  86 -15.668  -6.090  -2.420
  752    H    THR  87           HN       THR  87 -10.909  -7.537   2.043
  753    HA   THR  87           HA       THR  87  -8.166  -7.046   2.662
  754    HB   THR  87           HB       THR  87  -7.762  -9.180   1.342
  755    HG1  THR  87           HG1      THR  87  -9.290  -9.425  -0.100
  756   1HG2  THR  87          HG21      THR  87  -8.143  -9.421   3.673
  757   2HG2  THR  87          HG22      THR  87  -9.250 -10.560   2.909
  758   3HG2  THR  87          HG23      THR  87  -9.852  -9.017   3.515
  759    H    GLN  88           HN       GLN  88  -6.365  -6.697   1.301
  760    HA   GLN  88           HA       GLN  88  -6.676  -6.308  -1.576
  761   1HB   GLN  88          HB2       GLN  88  -7.454  -4.143  -0.164
  762   2HB   GLN  88          HB1       GLN  88  -5.721  -3.823  -0.247
  763   1HG   GLN  88          HG2       GLN  88  -6.638  -2.804  -2.196
  764   2HG   GLN  88          HG1       GLN  88  -5.904  -4.305  -2.757
  765   1HE2  GLN  88          HE21      GLN  88  -7.255  -5.677  -3.947
  766   2HE2  GLN  88          HE22      GLN  88  -8.949  -5.576  -3.978
  767    H    VAL  89           HN       VAL  89  -4.650  -5.742   1.308
  768    HA   VAL  89           HA       VAL  89  -2.138  -5.432   0.072
  769    HB   VAL  89           HB       VAL  89  -3.038  -6.537   2.719
  770   1HG1  VAL  89          HG11      VAL  89  -0.362  -6.356   3.104
  771   2HG1  VAL  89          HG12      VAL  89  -0.386  -6.947   1.445
  772   3HG1  VAL  89          HG13      VAL  89  -1.178  -7.870   2.720
  773   1HG2  VAL  89          HG21      VAL  89  -1.292  -4.567   3.252
  774   2HG2  VAL  89          HG22      VAL  89  -2.983  -4.243   2.870
  775   3HG2  VAL  89          HG23      VAL  89  -1.750  -4.083   1.618
  776    H    GLU  90           HN       GLU  90  -3.990  -8.402   0.682
  777    HA   GLU  90           HA       GLU  90  -1.980 -10.329   0.141
  778   1HB   GLU  90          HB2       GLU  90  -4.517 -10.583   0.852
  779   2HB   GLU  90          HB1       GLU  90  -4.772 -10.739  -0.886
  780   1HG   GLU  90          HG2       GLU  90  -4.174 -12.903  -0.706
  781   2HG   GLU  90          HG1       GLU  90  -2.541 -12.357  -0.327
  782    H    TRP  91           HN       TRP  91  -4.153  -8.600  -2.112
  783    HA   TRP  91           HA       TRP  91  -3.196  -9.884  -4.498
  784   1HB   TRP  91          HB2       TRP  91  -5.153  -8.800  -5.002
  785   2HB   TRP  91          HB1       TRP  91  -4.868  -7.522  -3.828
  786    HD1  TRP  91           HD1      TRP  91  -3.501  -8.624  -7.285
  787    HE1  TRP  91           HE1      TRP  91  -2.895  -6.498  -8.612
  788    HE3  TRP  91           HE3      TRP  91  -4.540  -5.066  -3.774
  789    HZ2  TRP  91           HZ2      TRP  91  -2.858  -3.660  -8.233
  790    HZ3  TRP  91           HZ3      TRP  91  -4.212  -2.663  -4.281
  791    HH2  TRP  91           HH2      TRP  91  -3.373  -1.955  -6.504
  792    H    LEU  92           HN       LEU  92  -2.262  -6.828  -2.874
  793    HA   LEU  92           HA       LEU  92  -0.302  -5.967  -4.746
  794   1HB   LEU  92          HB2       LEU  92  -0.538  -5.602  -1.750
  795   2HB   LEU  92          HB1       LEU  92   0.764  -4.865  -2.685
  796    HG   LEU  92           HG       LEU  92  -1.890  -4.453  -3.869
  797   1HD1  LEU  92          HD11      LEU  92  -2.751  -4.264  -1.675
  798   2HD1  LEU  92          HD12      LEU  92  -2.347  -2.604  -2.113
  799   3HD1  LEU  92          HD13      LEU  92  -1.271  -3.526  -1.065
  800   1HD2  LEU  92          HD21      LEU  92   0.297  -2.545  -2.979
  801   2HD2  LEU  92          HD22      LEU  92  -1.025  -2.171  -4.083
  802   3HD2  LEU  92          HD23      LEU  92   0.224  -3.321  -4.560
  803    H    LYS  93           HN       LYS  93  -0.057  -8.203  -1.989
  804    HA   LYS  93           HA       LYS  93   2.748  -8.664  -2.038
  805   1HB   LYS  93          HB2       LYS  93   0.363  -9.996  -0.946
  806   2HB   LYS  93          HB1       LYS  93   1.666 -11.113  -1.347
  807   1HG   LYS  93          HG2       LYS  93   3.230  -9.882   0.032
  808   2HG   LYS  93          HG1       LYS  93   2.043  -8.609   0.317
  809   1HD   LYS  93          HD2       LYS  93   1.377 -11.449   1.042
  810   2HD   LYS  93          HD1       LYS  93   2.377 -10.483   2.128
  811   1HE   LYS  93          HE2       LYS  93   0.658  -9.047   2.659
  812   2HE   LYS  93          HE1       LYS  93  -0.107  -9.209   1.080
  813   1HZ   LYS  93          HZ1       LYS  93  -0.119 -11.234   3.253
  814   2HZ   LYS  93          HZ2       LYS  93  -0.797 -11.455   1.711
  815   3HZ   LYS  93          HZ3       LYS  93  -1.432 -10.281   2.762
  816    H    ARG  94           HN       ARG  94   0.108 -10.446  -3.676
  817    HA   ARG  94           HA       ARG  94   1.696 -12.322  -5.080
  818   1HB   ARG  94          HB2       ARG  94  -0.931 -11.994  -4.900
  819   2HB   ARG  94          HB1       ARG  94  -0.701 -11.124  -6.417
  820   1HG   ARG  94          HG2       ARG  94  -0.397 -13.043  -7.562
  821   2HG   ARG  94          HG1       ARG  94   0.799 -13.617  -6.400
  822   1HD   ARG  94          HD2       ARG  94  -0.922 -15.201  -6.192
  823   2HD   ARG  94          HD1       ARG  94  -1.261 -14.084  -4.870
  824    HE   ARG  94           HE       ARG  94  -2.941 -13.008  -6.463
  825   1HH1  ARG  94          HH21      ARG  94  -4.159 -15.460  -5.452
  826   2HH1  ARG  94          HH22      ARG  94  -4.558 -16.342  -6.889
  827   1HH2  ARG  94          HH11      ARG  94  -2.451 -14.480  -8.933
  828   2HH2  ARG  94          HH12      ARG  94  -3.588 -15.785  -8.865
  829    H    LYS  95           HN       LYS  95   0.887  -8.961  -5.847
  830    HA   LYS  95           HA       LYS  95   1.896  -8.905  -8.517
  831   1HB   LYS  95          HB2       LYS  95   0.524  -7.115  -7.226
  832   2HB   LYS  95          HB1       LYS  95   2.089  -6.559  -6.631
  833   1HG   LYS  95          HG2       LYS  95   1.950  -5.279  -8.547
  834   2HG   LYS  95          HG1       LYS  95   2.714  -6.716  -9.225
  835   1HD   LYS  95          HD2       LYS  95   0.380  -7.586  -9.728
  836   2HD   LYS  95          HD1       LYS  95  -0.223  -5.985  -9.298
  837   1HE   LYS  95          HE2       LYS  95   0.622  -5.007 -11.189
  838   2HE   LYS  95          HE1       LYS  95   2.041  -6.055 -11.221
  839   1HZ   LYS  95          HZ1       LYS  95   0.558  -7.880 -11.932
  840   2HZ   LYS  95          HZ2       LYS  95   0.633  -6.606 -13.051
  841   3HZ   LYS  95          HZ3       LYS  95  -0.721  -6.771 -12.041
  842    H    GLY  96           HN       GLY  96   3.515  -8.557  -5.360
  843   1HA   GLY  96          HA2       GLY  96   6.051  -7.674  -6.416
  844   2HA   GLY  96          HA1       GLY  96   5.797  -8.403  -4.831
  845    H    TYR  97           HN       TYR  97   4.675 -10.861  -5.708
  846    HA   TYR  97           HA       TYR  97   7.061 -12.378  -6.192
  847   1HB   TYR  97          HB2       TYR  97   4.283 -13.451  -6.662
  848   2HB   TYR  97          HB1       TYR  97   5.704 -14.307  -6.068
  849    HD1  TYR  97           HD1      TYR  97   6.605 -12.059  -4.126
  850    HD2  TYR  97           HD2      TYR  97   2.826 -13.984  -4.808
  851    HE1  TYR  97           HE1      TYR  97   5.918 -11.522  -1.811
  852    HE2  TYR  97           HE2      TYR  97   2.138 -13.449  -2.491
  853    HH   TYR  97           HH       TYR  97   3.983 -12.839  -0.123
  854    H    LEU  98           HN       LEU  98   4.237 -11.812  -8.364
  855    HA   LEU  98           HA       LEU  98   5.399 -13.148 -10.612
  856   1HB   LEU  98          HB2       LEU  98   3.728 -11.966 -11.979
  857   2HB   LEU  98          HB1       LEU  98   2.997 -12.604 -10.511
  858    HG   LEU  98           HG       LEU  98   3.698 -10.157  -9.613
  859   1HD1  LEU  98          HD11      LEU  98   3.960  -8.579 -11.223
  860   2HD1  LEU  98          HD12      LEU  98   2.668  -9.258 -12.215
  861   3HD1  LEU  98          HD13      LEU  98   4.296  -9.932 -12.304
  862   1HD2  LEU  98          HD21      LEU  98   1.233 -11.048 -11.120
  863   2HD2  LEU  98          HD22      LEU  98   1.322  -9.474 -10.331
  864   3HD2  LEU  98          HD23      LEU  98   1.466 -10.948  -9.374
  865    H    ASP  99           HN       ASP  99   5.690  -9.819  -9.453
  866    HA   ASP  99           HA       ASP  99   6.968  -8.705 -11.758
  867   1HB   ASP  99          HB2       ASP  99   6.402  -7.891  -9.050
  868   2HB   ASP  99          HB1       ASP  99   8.067  -7.473  -9.450
  869    H    GLU 100           HN       GLU 100   8.266 -10.440  -8.931
  870    HA   GLU 100           HA       GLU 100  11.040 -10.035  -9.467
  871   1HB   GLU 100          HB2       GLU 100   9.539 -12.252  -8.056
  872   2HB   GLU 100          HB1       GLU 100  11.300 -12.229  -8.165
  873   1HG   GLU 100          HG2       GLU 100  11.440 -10.163  -6.964
  874   2HG   GLU 100          HG1       GLU 100   9.702  -9.892  -7.095
  875    H    LEU 101           HN       LEU 101   8.949 -12.829 -10.329
  876    HA   LEU 101           HA       LEU 101  11.019 -13.706 -12.273
  877   1HB   LEU 101          HB2       LEU 101   8.848 -15.023 -10.764
  878   2HB   LEU 101          HB1       LEU 101   8.998 -15.564 -12.434
  879    HG   LEU 101           HG       LEU 101  10.397 -16.931 -10.924
  880   1HD1  LEU 101          HD11      LEU 101  12.259 -15.183 -12.530
  881   2HD1  LEU 101          HD12      LEU 101  11.090 -16.237 -13.325
  882   3HD1  LEU 101          HD13      LEU 101  12.330 -16.927 -12.277
  883   1HD2  LEU 101          HD21      LEU 101  10.773 -14.988  -9.303
  884   2HD2  LEU 101          HD22      LEU 101  12.011 -14.418 -10.422
  885   3HD2  LEU 101          HD23      LEU 101  12.185 -15.990  -9.642
  886    H    LEU 102           HN       LEU 102  10.771 -12.346 -14.039
  887    HA   LEU 102           HA       LEU 102   8.069 -12.305 -15.328
  888   1HB   LEU 102          HB2       LEU 102   9.516 -10.125 -14.480
  889   2HB   LEU 102          HB1       LEU 102   9.999 -10.242 -16.172
  890    HG   LEU 102           HG       LEU 102   7.429 -10.547 -16.606
  891   1HD1  LEU 102          HD11      LEU 102   6.694 -10.737 -14.313
  892   2HD1  LEU 102          HD12      LEU 102   6.110  -9.191 -14.929
  893   3HD1  LEU 102          HD13      LEU 102   7.520  -9.243 -13.870
  894   1HD2  LEU 102          HD21      LEU 102   7.199  -8.091 -16.799
  895   2HD2  LEU 102          HD22      LEU 102   8.783  -8.623 -17.365
  896   3HD2  LEU 102          HD23      LEU 102   8.619  -7.879 -15.774
  Start of MODEL    9
    1   1H    MET   1          HT1       MET   1 -15.224 -12.563 -18.180
    2   2H    MET   1          HT2       MET   1 -13.762 -13.293 -17.715
    3   3H    MET   1          HT3       MET   1 -13.799 -11.643 -18.121
    4    HA   MET   1           HA       MET   1 -15.273 -11.222 -16.213
    5   1HB   MET   1          HB2       MET   1 -14.844 -14.185 -15.921
    6   2HB   MET   1          HB1       MET   1 -15.114 -13.196 -14.485
    7   1HG   MET   1          HG2       MET   1 -17.301 -12.805 -15.006
    8   2HG   MET   1          HG1       MET   1 -16.972 -12.686 -16.735
    9   1HE   MET   1          HE1       MET   1 -19.419 -15.143 -14.852
   10   2HE   MET   1          HE2       MET   1 -18.240 -14.169 -13.978
   11   3HE   MET   1          HE3       MET   1 -18.083 -15.923 -13.995
   12    H    ALA   2           HN       ALA   2 -12.542 -13.538 -15.866
   13    HA   ALA   2           HA       ALA   2 -11.244 -11.809 -13.891
   14   1HB   ALA   2          HB1       ALA   2 -11.096 -14.304 -13.807
   15   2HB   ALA   2          HB2       ALA   2  -9.513 -13.527 -13.833
   16   3HB   ALA   2          HB3       ALA   2 -10.157 -14.267 -15.299
   17    H    GLU   3           HN       GLU   3  -9.312 -10.628 -14.210
   18    HA   GLU   3           HA       GLU   3  -8.484 -10.264 -17.065
   19   1HB   GLU   3          HB2       GLU   3  -9.804  -8.339 -16.052
   20   2HB   GLU   3          HB1       GLU   3  -8.451  -8.101 -14.945
   21   1HG   GLU   3          HG2       GLU   3  -7.127  -7.194 -16.559
   22   2HG   GLU   3          HG1       GLU   3  -7.673  -8.340 -17.783
   23    H    GLN   4           HN       GLN   4  -6.529 -11.259 -17.195
   24    HA   GLN   4           HA       GLN   4  -4.551 -10.791 -14.997
   25   1HB   GLN   4          HB2       GLN   4  -5.185 -13.180 -15.390
   26   2HB   GLN   4          HB1       GLN   4  -4.594 -13.033 -17.045
   27   1HG   GLN   4          HG2       GLN   4  -2.763 -13.959 -15.866
   28   2HG   GLN   4          HG1       GLN   4  -2.373 -12.242 -15.977
   29   1HE2  GLN   4          HE21      GLN   4  -3.320 -14.821 -13.754
   30   2HE2  GLN   4          HE22      GLN   4  -3.124 -13.913 -12.333
   31    H    GLN   5           HN       GLN   5  -4.631 -11.421 -18.532
   32    HA   GLN   5           HA       GLN   5  -2.349  -9.507 -18.822
   33   1HB   GLN   5          HB2       GLN   5  -3.143 -11.997 -20.309
   34   2HB   GLN   5          HB1       GLN   5  -2.222 -10.746 -21.146
   35   1HG   GLN   5          HG2       GLN   5  -0.535 -10.822 -19.295
   36   2HG   GLN   5          HG1       GLN   5  -1.419 -12.179 -18.597
   37   1HE2  GLN   5          HE21      GLN   5   0.356 -11.176 -21.555
   38   2HE2  GLN   5          HE22      GLN   5   0.749 -12.755 -22.038
   39    H    GLN   6           HN       GLN   6  -5.236 -10.685 -20.604
   40    HA   GLN   6           HA       GLN   6  -6.109  -7.949 -21.137
   41   1HB   GLN   6          HB2       GLN   6  -4.246  -8.807 -22.899
   42   2HB   GLN   6          HB1       GLN   6  -5.690  -9.481 -23.656
   43   1HG   GLN   6          HG2       GLN   6  -5.771  -7.388 -24.603
   44   2HG   GLN   6          HG1       GLN   6  -6.625  -7.020 -23.105
   45   1HE2  GLN   6          HE21      GLN   6  -3.477  -6.722 -24.749
   46   2HE2  GLN   6          HE22      GLN   6  -2.850  -5.550 -23.695
   47    H    GLU   7           HN       GLU   7  -8.227  -8.274 -20.612
   48    HA   GLU   7           HA       GLU   7  -9.594 -10.684 -21.740
   49   1HB   GLU   7          HB2       GLU   7  -9.580 -10.643 -19.280
   50   2HB   GLU   7          HB1       GLU   7 -10.301  -9.035 -19.288
   51   1HG   GLU   7          HG2       GLU   7 -12.153 -10.454 -18.957
   52   2HG   GLU   7          HG1       GLU   7 -12.201 -10.127 -20.688
   53    H    GLN   8           HN       GLN   8 -11.134  -7.766 -20.420
   54    HA   GLN   8           HA       GLN   8 -11.647  -6.410 -22.871
   55   1HB   GLN   8          HB2       GLN   8 -12.968  -8.704 -23.071
   56   2HB   GLN   8          HB1       GLN   8 -14.133  -7.872 -22.042
   57   1HG   GLN   8          HG2       GLN   8 -13.597  -5.929 -23.887
   58   2HG   GLN   8          HG1       GLN   8 -13.428  -7.382 -24.873
   59   1HE2  GLN   8          HE21      GLN   8 -15.350  -8.454 -25.503
   60   2HE2  GLN   8          HE22      GLN   8 -16.896  -8.019 -24.957
   61    H    GLN   9           HN       GLN   9 -13.339  -7.390 -19.867
   62    HA   GLN   9           HA       GLN   9 -14.610  -4.823 -19.484
   63   1HB   GLN   9          HB2       GLN   9 -14.760  -7.365 -18.297
   64   2HB   GLN   9          HB1       GLN   9 -14.203  -6.294 -17.013
   65   1HG   GLN   9          HG2       GLN   9 -16.076  -4.789 -17.385
   66   2HG   GLN   9          HG1       GLN   9 -16.598  -5.731 -18.783
   67   1HE2  GLN   9          HE21      GLN   9 -16.101  -6.016 -15.229
   68   2HE2  GLN   9          HE22      GLN   9 -17.275  -7.222 -15.012
   69    H    ILE  10           HN       ILE  10 -14.169  -3.491 -17.457
   70    HA   ILE  10           HA       ILE  10 -11.218  -3.141 -17.141
   71    HB   ILE  10           HB       ILE  10 -12.420  -1.226 -18.167
   72   1HG1  ILE  10          HG12      ILE  10 -11.855   0.252 -15.839
   73   2HG1  ILE  10          HG11      ILE  10 -10.789  -1.151 -15.766
   74   1HG2  ILE  10          HG21      ILE  10 -14.378  -0.444 -17.371
   75   2HG2  ILE  10          HG22      ILE  10 -13.736  -0.313 -15.733
   76   3HG2  ILE  10          HG23      ILE  10 -14.407  -1.843 -16.297
   77   1HD1  ILE  10          HD11      ILE  10 -10.057  -0.680 -18.099
   78   2HD1  ILE  10          HD12      ILE  10  -9.686   0.648 -16.999
   79   3HD1  ILE  10          HD13      ILE  10 -11.061   0.770 -18.096
   80    H    ARG  11           HN       ARG  11 -11.806  -5.075 -15.571
   81    HA   ARG  11           HA       ARG  11 -12.993  -4.330 -13.041
   82   1HB   ARG  11          HB2       ARG  11 -12.330  -6.557 -12.285
   83   2HB   ARG  11          HB1       ARG  11 -13.062  -6.649 -13.882
   84   1HG   ARG  11          HG2       ARG  11 -11.123  -7.299 -14.881
   85   2HG   ARG  11          HG1       ARG  11 -10.139  -6.223 -13.890
   86   1HD   ARG  11          HD2       ARG  11 -11.429  -8.594 -12.586
   87   2HD   ARG  11          HD1       ARG  11  -9.991  -8.849 -13.573
   88    HE   ARG  11           HE       ARG  11  -9.800  -6.733 -11.521
   89   1HH1  ARG  11          HH21      ARG  11  -7.457  -8.155 -12.817
   90   2HH1  ARG  11          HH22      ARG  11  -6.952  -9.219 -11.548
   91   1HH2  ARG  11          HH11      ARG  11  -9.903  -8.895  -9.741
   92   2HH2  ARG  11          HH12      ARG  11  -8.341  -9.639  -9.803
   93    H    VAL  12           HN       VAL  12  -9.999  -4.012 -14.378
   94    HA   VAL  12           HA       VAL  12  -8.902  -2.675 -12.040
   95    HB   VAL  12           HB       VAL  12  -8.514  -5.185 -11.653
   96   1HG1  VAL  12          HG11      VAL  12  -6.719  -6.238 -12.886
   97   2HG1  VAL  12          HG12      VAL  12  -6.396  -4.751 -13.776
   98   3HG1  VAL  12          HG13      VAL  12  -7.897  -5.636 -14.053
   99   1HG2  VAL  12          HG21      VAL  12  -6.719  -4.606 -10.376
  100   2HG2  VAL  12          HG22      VAL  12  -7.052  -2.977 -10.963
  101   3HG2  VAL  12          HG23      VAL  12  -5.825  -3.965 -11.755
  102    H    ARG  13           HN       ARG  13  -6.792  -1.669 -12.528
  103    HA   ARG  13           HA       ARG  13  -5.840  -1.744 -15.309
  104   1HB   ARG  13          HB2       ARG  13  -7.841  -0.057 -15.051
  105   2HB   ARG  13          HB1       ARG  13  -6.639   0.963 -14.261
  106   1HG   ARG  13          HG2       ARG  13  -5.343   0.001 -16.549
  107   2HG   ARG  13          HG1       ARG  13  -6.978   0.374 -17.093
  108   1HD   ARG  13          HD2       ARG  13  -5.551   2.349 -15.342
  109   2HD   ARG  13          HD1       ARG  13  -5.128   2.263 -17.052
  110    HE   ARG  13           HE       ARG  13  -7.825   2.975 -15.994
  111   1HH1  ARG  13          HH11      ARG  13  -6.245   5.051 -17.390
  112   2HH1  ARG  13          HH12      ARG  13  -6.834   4.958 -19.017
  113   1HH2  ARG  13          HH21      ARG  13  -8.284   1.829 -18.593
  114   2HH2  ARG  13          HH22      ARG  13  -7.992   3.129 -19.699
  115    H    ILE  14           HN       ILE  14  -5.662   0.629 -12.636
  116    HA   ILE  14           HA       ILE  14  -3.673   1.779 -11.938
  117    HB   ILE  14           HB       ILE  14  -2.526   0.204 -10.293
  118   1HG1  ILE  14          HG12      ILE  14  -4.719  -1.753 -10.637
  119   2HG1  ILE  14          HG11      ILE  14  -3.503  -1.782 -11.915
  120   1HG2  ILE  14          HG21      ILE  14  -4.406   1.632  -9.651
  121   2HG2  ILE  14          HG22      ILE  14  -4.551   0.061  -8.862
  122   3HG2  ILE  14          HG23      ILE  14  -5.549   0.438 -10.266
  123   1HD1  ILE  14          HD11      ILE  14  -2.614  -1.685  -9.051
  124   2HD1  ILE  14          HD12      ILE  14  -1.781  -2.352 -10.454
  125   3HD1  ILE  14          HD13      ILE  14  -3.141  -3.219  -9.741
  126    HA   PRO  15           HA       PRO  15  -0.654   0.261 -15.041
  127   1HB   PRO  15          HB2       PRO  15  -0.190   2.756 -16.111
  128   2HB   PRO  15          HB1       PRO  15  -1.472   1.670 -16.673
  129   1HG   PRO  15          HG2       PRO  15  -1.695   4.129 -14.999
  130   2HG   PRO  15          HG1       PRO  15  -2.888   3.402 -16.089
  131   1HD   PRO  15          HD2       PRO  15  -2.883   3.191 -13.270
  132   2HD   PRO  15          HD1       PRO  15  -3.843   2.197 -14.387
  133    H    ARG  16           HN       ARG  16   0.697  -0.116 -13.117
  134    HA   ARG  16           HA       ARG  16   2.158   2.171 -11.972
  135   1HB   ARG  16          HB2       ARG  16   1.340   0.080 -10.687
  136   2HB   ARG  16          HB1       ARG  16   2.718  -0.744 -11.415
  137   1HG   ARG  16          HG2       ARG  16   3.592   0.039  -9.377
  138   2HG   ARG  16          HG1       ARG  16   4.105   1.274 -10.527
  139   1HD   ARG  16          HD2       ARG  16   3.203   2.572  -8.804
  140   2HD   ARG  16          HD1       ARG  16   1.829   2.422  -9.898
  141    HE   ARG  16           HE       ARG  16   2.169   0.812  -7.399
  142   1HH1  ARG  16          HH11      ARG  16   0.188   3.124  -7.686
  143   2HH1  ARG  16          HH12      ARG  16  -1.285   2.265  -7.992
  144   1HH2  ARG  16          HH21      ARG  16   0.309  -0.724  -8.767
  145   2HH2  ARG  16          HH22      ARG  16  -1.215   0.081  -8.604
  146    H    LYS  17           HN       LYS  17   3.761   2.981 -13.221
  147    HA   LYS  17           HA       LYS  17   5.665   1.053 -14.498
  148   1HB   LYS  17          HB2       LYS  17   4.598   3.697 -15.523
  149   2HB   LYS  17          HB1       LYS  17   6.049   2.944 -16.185
  150   1HG   LYS  17          HG2       LYS  17   3.425   1.456 -15.975
  151   2HG   LYS  17          HG1       LYS  17   3.845   2.422 -17.389
  152   1HD   LYS  17          HD2       LYS  17   6.086   1.049 -17.318
  153   2HD   LYS  17          HD1       LYS  17   5.135  -0.092 -16.366
  154   1HE   LYS  17          HE2       LYS  17   3.377   0.222 -18.313
  155   2HE   LYS  17          HE1       LYS  17   4.795   0.730 -19.230
  156   1HZ   LYS  17          HZ1       LYS  17   4.445  -1.849 -17.801
  157   2HZ   LYS  17          HZ2       LYS  17   5.881  -1.355 -18.562
  158   3HZ   LYS  17          HZ3       LYS  17   4.477  -1.620 -19.480
  159    H    GLU  18           HN       GLU  18   5.863   2.123 -11.827
  160    HA   GLU  18           HA       GLU  18   8.209   3.963 -12.119
  161   1HB   GLU  18          HB2       GLU  18   6.208   3.697  -9.854
  162   2HB   GLU  18          HB1       GLU  18   7.675   4.672  -9.766
  163   1HG   GLU  18          HG2       GLU  18   6.241   6.309 -10.501
  164   2HG   GLU  18          HG1       GLU  18   6.681   5.638 -12.071
  165    H    GLU  19           HN       GLU  19  10.055   3.494 -10.838
  166    HA   GLU  19           HA       GLU  19  10.141   0.697  -9.790
  167   1HB   GLU  19          HB2       GLU  19  12.339   2.543 -10.774
  168   2HB   GLU  19          HB1       GLU  19  12.636   0.967 -10.039
  169   1HG   GLU  19          HG2       GLU  19  10.634   0.609 -12.038
  170   2HG   GLU  19          HG1       GLU  19  11.934   1.556 -12.758
  171    H    ASN  20           HN       ASN  20   8.951   2.611  -8.139
  172    HA   ASN  20           HA       ASN  20  10.641   2.445  -5.774
  173   1HB   ASN  20          HB2       ASN  20  11.116   4.674  -7.306
  174   2HB   ASN  20          HB1       ASN  20   9.858   5.262  -6.219
  175   1HD2  ASN  20          HD21      ASN  20  10.668   6.089  -4.287
  176   2HD2  ASN  20          HD22      ASN  20  12.122   5.610  -3.553
  177    H    GLU  21           HN       GLU  21   8.938   1.449  -4.712
  178    HA   GLU  21           HA       GLU  21   6.841   3.081  -3.610
  179   1HB   GLU  21          HB2       GLU  21   6.290   1.972  -6.185
  180   2HB   GLU  21          HB1       GLU  21   5.311   1.098  -5.006
  181   1HG   GLU  21          HG2       GLU  21   5.292   3.916  -4.383
  182   2HG   GLU  21          HG1       GLU  21   4.823   3.676  -6.066
  183    H    ILE  22           HN       ILE  22   5.893   2.032  -1.828
  184    HA   ILE  22           HA       ILE  22   6.660  -0.839  -1.437
  185    HB   ILE  22           HB       ILE  22   7.145   1.564   0.177
  186   1HG1  ILE  22          HG12      ILE  22   8.401  -0.803   1.171
  187   2HG1  ILE  22          HG11      ILE  22   8.414  -0.876  -0.590
  188   1HG2  ILE  22          HG21      ILE  22   6.120  -0.895   1.604
  189   2HG2  ILE  22          HG22      ILE  22   5.192   0.589   1.401
  190   3HG2  ILE  22          HG23      ILE  22   6.681   0.606   2.340
  191   1HD1  ILE  22          HD11      ILE  22  10.411   0.300   0.193
  192   2HD1  ILE  22          HD12      ILE  22   9.412   1.430   1.105
  193   3HD1  ILE  22          HD13      ILE  22   9.353   1.426  -0.657
  194    H    LEU  23           HN       LEU  23   5.049  -2.033   0.068
  195    HA   LEU  23           HA       LEU  23   2.352  -0.635  -0.072
  196   1HB   LEU  23          HB2       LEU  23   1.262  -2.411  -1.067
  197   2HB   LEU  23          HB1       LEU  23   2.823  -2.506  -1.857
  198    HG   LEU  23           HG       LEU  23   2.142  -4.729  -1.266
  199   1HD1  LEU  23          HD11      LEU  23   4.186  -5.332  -0.614
  200   2HD1  LEU  23          HD12      LEU  23   3.981  -4.584   0.965
  201   3HD1  LEU  23          HD13      LEU  23   4.540  -3.622  -0.400
  202   1HD2  LEU  23          HD21      LEU  23   0.932  -3.487   0.960
  203   2HD2  LEU  23          HD22      LEU  23   2.125  -4.610   1.617
  204   3HD2  LEU  23          HD23      LEU  23   0.873  -5.193   0.522
  205    H    GLY  24           HN       GLY  24   1.295  -0.587   1.932
  206   1HA   GLY  24          HA2       GLY  24   2.107  -2.712   3.861
  207   2HA   GLY  24          HA1       GLY  24   2.325  -1.032   4.321
  208    H    ILE  25           HN       ILE  25   0.798  -2.808   5.797
  209    HA   ILE  25           HA       ILE  25  -2.024  -2.029   5.255
  210    HB   ILE  25           HB       ILE  25  -1.483  -3.684   7.650
  211   1HG1  ILE  25          HG12      ILE  25  -1.388  -5.701   5.829
  212   2HG1  ILE  25          HG11      ILE  25  -0.433  -4.486   4.981
  213   1HG2  ILE  25          HG21      ILE  25  -3.715  -3.698   7.151
  214   2HG2  ILE  25          HG22      ILE  25  -3.249  -5.059   6.132
  215   3HG2  ILE  25          HG23      ILE  25  -3.439  -3.455   5.427
  216   1HD1  ILE  25          HD11      ILE  25   0.320  -4.557   7.771
  217   2HD1  ILE  25          HD12      ILE  25   1.321  -4.842   6.348
  218   3HD1  ILE  25          HD13      ILE  25   0.425  -6.174   7.076
  219    H    ILE  26           HN       ILE  26  -2.910  -0.424   6.476
  220    HA   ILE  26           HA       ILE  26  -1.187   0.847   8.522
  221    HB   ILE  26           HB       ILE  26  -2.567   1.894   6.433
  222   1HG1  ILE  26          HG12      ILE  26  -2.407   3.864   8.518
  223   2HG1  ILE  26          HG11      ILE  26  -1.000   2.800   8.582
  224   1HG2  ILE  26          HG21      ILE  26  -4.224   2.554   8.871
  225   2HG2  ILE  26          HG22      ILE  26  -4.734   1.418   7.621
  226   3HG2  ILE  26          HG23      ILE  26  -4.485   3.118   7.220
  227   1HD1  ILE  26          HD11      ILE  26  -0.698   4.768   7.043
  228   2HD1  ILE  26          HD12      ILE  26  -2.004   4.125   6.048
  229   3HD1  ILE  26          HD13      ILE  26  -0.512   3.209   6.242
  230    H    GLU  27           HN       GLU  27  -2.001   1.529  10.492
  231    HA   GLU  27           HA       GLU  27  -4.577   0.407  11.435
  232   1HB   GLU  27          HB2       GLU  27  -1.885  -0.495  12.264
  233   2HB   GLU  27          HB1       GLU  27  -2.993  -0.147  13.592
  234   1HG   GLU  27          HG2       GLU  27  -4.708  -1.593  12.463
  235   2HG   GLU  27          HG1       GLU  27  -3.487  -2.031  11.268
  236    H    GLN  28           HN       GLN  28  -5.631   2.054  12.387
  237    HA   GLN  28           HA       GLN  28  -4.111   3.975  14.082
  238   1HB   GLN  28          HB2       GLN  28  -4.495   5.102  11.950
  239   2HB   GLN  28          HB1       GLN  28  -6.204   4.701  12.017
  240   1HG   GLN  28          HG2       GLN  28  -5.685   7.052  12.738
  241   2HG   GLN  28          HG1       GLN  28  -6.540   6.103  13.950
  242   1HE2  GLN  28          HE21      GLN  28  -3.057   5.662  13.294
  243   2HE2  GLN  28          HE22      GLN  28  -2.534   6.284  14.782
  244    H    MET  29           HN       MET  29  -5.081   4.248  16.062
  245    HA   MET  29           HA       MET  29  -7.972   4.111  16.374
  246   1HB   MET  29          HB2       MET  29  -6.976   1.653  16.327
  247   2HB   MET  29          HB1       MET  29  -6.543   2.032  17.995
  248   1HG   MET  29          HG2       MET  29  -8.739   1.004  17.999
  249   2HG   MET  29          HG1       MET  29  -8.930   2.713  18.392
  250   1HE   MET  29          HE1       MET  29  -9.741   4.611  16.237
  251   2HE   MET  29          HE2       MET  29 -10.463   3.947  17.701
  252   3HE   MET  29          HE3       MET  29 -11.390   3.973  16.204
  253    H    LEU  30           HN       LEU  30  -5.989   6.078  16.956
  254    HA   LEU  30           HA       LEU  30  -6.368   6.295  19.904
  255   1HB   LEU  30          HB2       LEU  30  -3.790   6.774  18.383
  256   2HB   LEU  30          HB1       LEU  30  -4.053   7.290  20.049
  257    HG   LEU  30           HG       LEU  30  -4.459   4.424  19.176
  258   1HD1  LEU  30          HD11      LEU  30  -2.212   3.918  19.860
  259   2HD1  LEU  30          HD12      LEU  30  -1.954   5.566  20.439
  260   3HD1  LEU  30          HD13      LEU  30  -2.109   5.250  18.710
  261   1HD2  LEU  30          HD21      LEU  30  -4.134   4.006  21.595
  262   2HD2  LEU  30          HD22      LEU  30  -5.476   5.116  21.315
  263   3HD2  LEU  30          HD23      LEU  30  -3.918   5.737  21.861
  264    H    GLY  31           HN       GLY  31  -7.405   7.573  17.203
  265   1HA   GLY  31          HA2       GLY  31  -8.244   9.677  16.609
  266   2HA   GLY  31          HA1       GLY  31  -7.961  10.164  18.279
  267    H    ALA  32           HN       ALA  32  -6.070   9.477  15.305
  268    HA   ALA  32           HA       ALA  32  -4.593  12.012  15.747
  269   1HB   ALA  32          HB1       ALA  32  -3.240   9.318  15.418
  270   2HB   ALA  32          HB2       ALA  32  -3.242  10.302  16.880
  271   3HB   ALA  32          HB3       ALA  32  -2.414  10.877  15.433
  272    H    SER  33           HN       SER  33  -3.837  12.939  13.835
  273    HA   SER  33           HA       SER  33  -5.082  12.110  11.365
  274   1HB   SER  33          HB2       SER  33  -4.300  14.486  12.112
  275   2HB   SER  33          HB1       SER  33  -2.728  13.988  11.491
  276    HG   SER  33           HG       SER  33  -5.002  14.694  10.162
  277    H    ARG  34           HN       ARG  34  -2.083  11.298  12.902
  278    HA   ARG  34           HA       ARG  34  -0.953  10.217  10.371
  279   1HB   ARG  34          HB2       ARG  34   1.125   9.967  11.607
  280   2HB   ARG  34          HB1       ARG  34   0.495  11.585  11.917
  281   1HG   ARG  34          HG2       ARG  34  -0.364  10.924  14.070
  282   2HG   ARG  34          HG1       ARG  34  -0.022   9.225  13.746
  283   1HD   ARG  34          HD2       ARG  34   2.052   9.468  14.570
  284   2HD   ARG  34          HD1       ARG  34   2.395  10.715  13.371
  285    HE   ARG  34           HE       ARG  34   1.274  11.245  16.089
  286   1HH1  ARG  34          HH21      ARG  34   4.046  12.073  15.674
  287   2HH1  ARG  34          HH22      ARG  34   3.906  13.714  15.137
  288   1HH2  ARG  34          HH11      ARG  34   0.541  13.437  14.318
  289   2HH2  ARG  34          HH12      ARG  34   1.916  14.487  14.368
  290    H    VAL  35           HN       VAL  35  -0.117   7.957  10.446
  291    HA   VAL  35           HA       VAL  35  -1.522   6.205  12.405
  292    HB   VAL  35           HB       VAL  35  -2.034   4.611  10.547
  293   1HG1  VAL  35          HG11      VAL  35  -3.491   6.646  11.517
  294   2HG1  VAL  35          HG12      VAL  35  -4.087   5.521  10.295
  295   3HG1  VAL  35          HG13      VAL  35  -3.450   7.093   9.811
  296   1HG2  VAL  35          HG21      VAL  35  -1.134   6.985   8.920
  297   2HG2  VAL  35          HG22      VAL  35  -2.130   5.690   8.259
  298   3HG2  VAL  35          HG23      VAL  35  -0.511   5.338   8.865
  299    H    ARG  36           HN       ARG  36  -0.767   3.953  12.236
  300    HA   ARG  36           HA       ARG  36   2.201   3.918  11.687
  301   1HB   ARG  36          HB2       ARG  36   2.050   1.801  13.251
  302   2HB   ARG  36          HB1       ARG  36   2.087   3.414  13.956
  303   1HG   ARG  36          HG2       ARG  36  -0.315   3.418  14.248
  304   2HG   ARG  36          HG1       ARG  36  -0.474   1.921  13.329
  305   1HD   ARG  36          HD2       ARG  36   1.074   0.881  15.117
  306   2HD   ARG  36          HD1       ARG  36   0.708   2.313  16.077
  307    HE   ARG  36           HE       ARG  36  -1.210   0.177  15.355
  308   1HH1  ARG  36          HH21      ARG  36  -0.797   1.079  18.170
  309   2HH1  ARG  36          HH22      ARG  36  -2.157   2.119  18.432
  310   1HH2  ARG  36          HH11      ARG  36  -2.873   2.478  15.052
  311   2HH2  ARG  36          HH12      ARG  36  -3.335   2.912  16.664
  312    H    VAL  37           HN       VAL  37   2.916   2.486  10.094
  313    HA   VAL  37           HA       VAL  37   1.075   0.267   9.397
  314    HB   VAL  37           HB       VAL  37   0.384   1.283   7.516
  315   1HG1  VAL  37          HG11      VAL  37   0.725   3.450   8.536
  316   2HG1  VAL  37          HG12      VAL  37   1.264   3.542   6.859
  317   3HG1  VAL  37          HG13      VAL  37   2.445   3.404   8.159
  318   1HG2  VAL  37          HG21      VAL  37   2.288   0.052   6.509
  319   2HG2  VAL  37          HG22      VAL  37   3.313   1.467   6.759
  320   3HG2  VAL  37          HG23      VAL  37   1.944   1.554   5.651
  321    H    ARG  38           HN       ARG  38   2.022  -1.505   8.555
  322    HA   ARG  38           HA       ARG  38   5.030  -1.575   8.489
  323   1HB   ARG  38          HB2       ARG  38   4.608  -4.133   8.675
  324   2HB   ARG  38          HB1       ARG  38   4.356  -3.168  10.127
  325   1HG   ARG  38          HG2       ARG  38   1.968  -3.182   9.825
  326   2HG   ARG  38          HG1       ARG  38   2.119  -3.878   8.211
  327   1HD   ARG  38          HD2       ARG  38   1.815  -5.877   9.240
  328   2HD   ARG  38          HD1       ARG  38   3.488  -5.700   9.768
  329    HE   ARG  38           HE       ARG  38   1.087  -5.137  11.426
  330   1HH1  ARG  38          HH21      ARG  38   3.016  -7.171  12.332
  331   2HH1  ARG  38          HH22      ARG  38   4.023  -6.294  13.435
  332   1HH2  ARG  38          HH11      ARG  38   3.031  -3.172  12.274
  333   2HH2  ARG  38          HH12      ARG  38   4.031  -4.024  13.403
  334    H    CYS  39           HN       CYS  39   5.955  -2.465   6.501
  335    HA   CYS  39           HA       CYS  39   3.912  -3.114   4.423
  336   1HB   CYS  39          HB2       CYS  39   6.239  -1.378   3.705
  337   2HB   CYS  39          HB1       CYS  39   4.650  -1.475   2.958
  338    HG   CYS  39           HG       CYS  39   4.192   0.553   4.321
  339    H    LEU  40           HN       LEU  40   4.674  -4.154   2.586
  340    HA   LEU  40           HA       LEU  40   7.078  -5.794   2.987
  341   1HB   LEU  40          HB2       LEU  40   4.521  -6.293   1.803
  342   2HB   LEU  40          HB1       LEU  40   5.736  -6.430   0.543
  343    HG   LEU  40           HG       LEU  40   5.598  -8.598   1.481
  344   1HD1  LEU  40          HD11      LEU  40   7.900  -7.163   2.819
  345   2HD1  LEU  40          HD12      LEU  40   7.915  -7.952   1.242
  346   3HD1  LEU  40          HD13      LEU  40   7.746  -8.914   2.707
  347   1HD2  LEU  40          HD21      LEU  40   4.281  -8.033   3.463
  348   2HD2  LEU  40          HD22      LEU  40   5.685  -7.257   4.196
  349   3HD2  LEU  40          HD23      LEU  40   5.678  -9.002   3.933
  350    H    ASP  41           HN       ASP  41   8.070  -6.193   0.664
  351    HA   ASP  41           HA       ASP  41   9.343  -5.286  -1.089
  352   1HB   ASP  41          HB2       ASP  41   7.225  -3.737  -1.454
  353   2HB   ASP  41          HB1       ASP  41   8.168  -2.550  -0.557
  354    H    GLY  42           HN       GLY  42   9.519  -5.400   1.905
  355   1HA   GLY  42          HA2       GLY  42  11.116  -5.035   3.532
  356   2HA   GLY  42          HA1       GLY  42  12.142  -4.377   2.270
  357    H    LYS  43           HN       LYS  43   9.072  -3.114   3.899
  358    HA   LYS  43           HA       LYS  43  10.790  -0.881   4.816
  359   1HB   LYS  43          HB2       LYS  43   9.508  -0.548   2.463
  360   2HB   LYS  43          HB1       LYS  43   8.312   0.101   3.576
  361   1HG   LYS  43          HG2       LYS  43   9.784   1.909   2.925
  362   2HG   LYS  43          HG1       LYS  43  10.142   1.495   4.599
  363   1HD   LYS  43          HD2       LYS  43  11.706  -0.010   2.592
  364   2HD   LYS  43          HD1       LYS  43  12.035   1.722   2.644
  365   1HE   LYS  43          HE2       LYS  43  12.013   1.214   5.292
  366   2HE   LYS  43          HE1       LYS  43  12.537  -0.364   4.710
  367   1HZ   LYS  43          HZ1       LYS  43  14.076   1.254   3.251
  368   2HZ   LYS  43          HZ2       LYS  43  14.545   0.604   4.749
  369   3HZ   LYS  43          HZ3       LYS  43  13.922   2.182   4.662
  370    H    THR  44           HN       THR  44   9.901   0.443   6.410
  371    HA   THR  44           HA       THR  44   7.310  -0.352   7.645
  372    HB   THR  44           HB       THR  44   9.608   0.234   9.479
  373    HG1  THR  44           HG1      THR  44  10.541  -1.379   8.345
  374   1HG2  THR  44          HG21      THR  44   8.337  -1.100  11.010
  375   2HG2  THR  44          HG22      THR  44   7.319  -1.721   9.710
  376   3HG2  THR  44          HG23      THR  44   7.201  -0.028  10.191
  377    H    ARG  45           HN       ARG  45   6.150   1.557   7.710
  378    HA   ARG  45           HA       ARG  45   7.624   4.044   8.414
  379   1HB   ARG  45          HB2       ARG  45   6.352   5.127   6.415
  380   2HB   ARG  45          HB1       ARG  45   7.829   4.219   6.099
  381   1HG   ARG  45          HG2       ARG  45   5.329   2.620   6.117
  382   2HG   ARG  45          HG1       ARG  45   5.489   3.766   4.787
  383   1HD   ARG  45          HD2       ARG  45   7.415   1.553   5.541
  384   2HD   ARG  45          HD1       ARG  45   6.482   1.702   4.052
  385    HE   ARG  45           HE       ARG  45   9.013   2.973   4.562
  386   1HH1  ARG  45          HH21      ARG  45   7.808   2.429   1.837
  387   2HH1  ARG  45          HH22      ARG  45   7.505   4.034   1.267
  388   1HH2  ARG  45          HH11      ARG  45   7.829   5.476   4.411
  389   2HH2  ARG  45          HH12      ARG  45   7.489   5.767   2.741
  390    H    LEU  46           HN       LEU  46   6.216   5.904   8.711
  391    HA   LEU  46           HA       LEU  46   3.558   5.110   9.836
  392   1HB   LEU  46          HB2       LEU  46   5.221   7.639  10.144
  393   2HB   LEU  46          HB1       LEU  46   3.600   7.452  10.799
  394    HG   LEU  46           HG       LEU  46   5.040   6.935  12.609
  395   1HD1  LEU  46          HD11      LEU  46   3.246   5.244  12.227
  396   2HD1  LEU  46          HD12      LEU  46   4.654   4.569  13.043
  397   3HD1  LEU  46          HD13      LEU  46   4.401   4.263  11.325
  398   1HD2  LEU  46          HD21      LEU  46   7.093   5.875  12.452
  399   2HD2  LEU  46          HD22      LEU  46   6.994   6.584  10.840
  400   3HD2  LEU  46          HD23      LEU  46   6.596   4.882  11.082
  401    H    GLY  47           HN       GLY  47   1.729   5.767   8.668
  402   1HA   GLY  47          HA2       GLY  47   2.278   7.133   6.100
  403   2HA   GLY  47          HA1       GLY  47   0.818   6.242   6.497
  404    H    ARG  48           HN       ARG  48   1.119   8.896   5.345
  405    HA   ARG  48           HA       ARG  48  -0.328  10.459   7.420
  406   1HB   ARG  48          HB2       ARG  48   0.578  12.515   6.336
  407   2HB   ARG  48          HB1       ARG  48   1.824  11.506   7.059
  408   1HG   ARG  48          HG2       ARG  48   2.670  10.835   5.003
  409   2HG   ARG  48          HG1       ARG  48   1.126  11.051   4.180
  410   1HD   ARG  48          HD2       ARG  48   2.790  13.343   5.254
  411   2HD   ARG  48          HD1       ARG  48   2.860  12.783   3.585
  412    HE   ARG  48           HE       ARG  48   0.135  13.349   4.349
  413   1HH1  ARG  48          HH11      ARG  48   1.611  15.808   5.266
  414   2HH1  ARG  48          HH12      ARG  48   1.586  16.792   3.841
  415   1HH2  ARG  48          HH21      ARG  48   0.764  14.166   1.720
  416   2HH2  ARG  48          HH22      ARG  48   1.105  15.860   1.829
  417    H    ILE  49           HN       ILE  49  -2.191  11.485   6.775
  418    HA   ILE  49           HA       ILE  49  -3.203  10.719   4.080
  419    HB   ILE  49           HB       ILE  49  -4.334  10.717   6.690
  420   1HG1  ILE  49          HG12      ILE  49  -6.416  10.177   4.973
  421   2HG1  ILE  49          HG11      ILE  49  -5.011   9.884   3.948
  422   1HG2  ILE  49          HG21      ILE  49  -5.856  12.586   4.852
  423   2HG2  ILE  49          HG22      ILE  49  -4.927  13.113   6.256
  424   3HG2  ILE  49          HG23      ILE  49  -6.329  12.068   6.469
  425   1HD1  ILE  49          HD11      ILE  49  -5.341   7.804   4.993
  426   2HD1  ILE  49          HD12      ILE  49  -5.761   8.543   6.538
  427   3HD1  ILE  49          HD13      ILE  49  -4.086   8.550   5.984
  428    HA   PRO  50           HA       PRO  50  -3.042  14.877   2.660
  429   1HB   PRO  50          HB2       PRO  50  -5.221  14.931   0.977
  430   2HB   PRO  50          HB1       PRO  50  -3.695  14.117   0.593
  431   1HG   PRO  50          HG2       PRO  50  -6.306  12.927   1.404
  432   2HG   PRO  50          HG1       PRO  50  -5.004  12.221   0.432
  433   1HD   PRO  50          HD2       PRO  50  -5.517  11.665   3.155
  434   2HD   PRO  50          HD1       PRO  50  -4.033  11.251   2.270
  435    H    GLY  51           HN       GLY  51  -6.529  14.104   3.211
  436   1HA   GLY  51          HA2       GLY  51  -6.965  15.802   5.403
  437   2HA   GLY  51          HA1       GLY  51  -7.187  16.810   3.973
  438    H    ARG  52           HN       ARG  52  -8.592  15.564   2.206
  439    HA   ARG  52           HA       ARG  52 -11.220  15.241   3.284
  440   1HB   ARG  52          HB2       ARG  52  -9.944  15.047   0.654
  441   2HB   ARG  52          HB1       ARG  52 -11.261  13.890   0.851
  442   1HG   ARG  52          HG2       ARG  52 -11.606  16.778   1.651
  443   2HG   ARG  52          HG1       ARG  52 -11.855  16.261  -0.017
  444   1HD   ARG  52          HD2       ARG  52 -13.941  15.636   0.558
  445   2HD   ARG  52          HD1       ARG  52 -13.228  14.374   1.562
  446    HE   ARG  52           HE       ARG  52 -13.324  15.956   3.467
  447   1HH1  ARG  52          HH21      ARG  52 -13.571  18.500   1.881
  448   2HH1  ARG  52          HH22      ARG  52 -15.253  18.876   2.064
  449   1HH2  ARG  52          HH11      ARG  52 -16.118  15.689   3.147
  450   2HH2  ARG  52          HH12      ARG  52 -16.698  17.281   2.782
  451    H    LEU  53           HN       LEU  53  -8.722  12.876   2.385
  452    HA   LEU  53           HA       LEU  53 -10.315  10.523   2.782
  453   1HB   LEU  53          HB2       LEU  53  -7.409  11.143   2.559
  454   2HB   LEU  53          HB1       LEU  53  -7.838   9.617   3.329
  455    HG   LEU  53           HG       LEU  53  -9.496   9.479   1.223
  456   1HD1  LEU  53          HD11      LEU  53  -8.380  10.365  -0.782
  457   2HD1  LEU  53          HD12      LEU  53  -7.109  11.064   0.222
  458   3HD1  LEU  53          HD13      LEU  53  -8.760  11.675   0.337
  459   1HD2  LEU  53          HD21      LEU  53  -7.770   7.822   1.869
  460   2HD2  LEU  53          HD22      LEU  53  -6.531   8.833   1.123
  461   3HD2  LEU  53          HD23      LEU  53  -7.782   8.089   0.126
  462    H    LYS  54           HN       LYS  54  -8.411  12.539   4.994
  463    HA   LYS  54           HA       LYS  54  -8.215  10.906   7.255
  464   1HB   LYS  54          HB2       LYS  54  -7.610  13.477   6.793
  465   2HB   LYS  54          HB1       LYS  54  -9.098  13.721   7.707
  466   1HG   LYS  54          HG2       LYS  54  -7.227  11.720   8.840
  467   2HG   LYS  54          HG1       LYS  54  -6.660  13.390   8.870
  468   1HD   LYS  54          HD2       LYS  54  -9.075  13.898   9.782
  469   2HD   LYS  54          HD1       LYS  54  -9.065  12.187  10.209
  470   1HE   LYS  54          HE2       LYS  54  -6.555  13.409  10.962
  471   2HE   LYS  54          HE1       LYS  54  -7.899  14.308  11.661
  472   1HZ   LYS  54          HZ1       LYS  54  -7.509  11.370  11.860
  473   2HZ   LYS  54          HZ2       LYS  54  -8.781  12.256  12.557
  474   3HZ   LYS  54          HZ3       LYS  54  -7.185  12.489  13.092
  475    H    ASN  55           HN       ASN  55 -11.083  12.659   6.091
  476    HA   ASN  55           HA       ASN  55 -12.667  11.861   8.441
  477   1HB   ASN  55          HB2       ASN  55 -13.374  13.320   5.879
  478   2HB   ASN  55          HB1       ASN  55 -14.541  12.967   7.151
  479   1HD2  ASN  55          HD21      ASN  55 -14.585  15.504   7.104
  480   2HD2  ASN  55          HD22      ASN  55 -13.484  16.296   8.124
  481    H    ARG  56           HN       ARG  56 -12.312  10.887   5.047
  482    HA   ARG  56           HA       ARG  56 -14.581   9.066   5.085
  483   1HB   ARG  56          HB2       ARG  56 -13.265  10.224   3.073
  484   2HB   ARG  56          HB1       ARG  56 -12.349   8.718   3.130
  485   1HG   ARG  56          HG2       ARG  56 -14.019   7.635   2.084
  486   2HG   ARG  56          HG1       ARG  56 -15.143   8.100   3.360
  487   1HD   ARG  56          HD2       ARG  56 -16.059   9.752   2.106
  488   2HD   ARG  56          HD1       ARG  56 -14.487  10.301   1.526
  489    HE   ARG  56           HE       ARG  56 -15.680   7.831   0.358
  490   1HH1  ARG  56          HH21      ARG  56 -13.211   8.914  -0.839
  491   2HH1  ARG  56          HH22      ARG  56 -13.802   9.891  -2.140
  492   1HH2  ARG  56          HH11      ARG  56 -17.050  10.032  -0.911
  493   2HH2  ARG  56          HH12      ARG  56 -15.981  10.526  -2.182
  494    H    ILE  57           HN       ILE  57 -11.081   8.718   5.602
  495    HA   ILE  57           HA       ILE  57 -10.930   5.882   5.532
  496    HB   ILE  57           HB       ILE  57  -8.881   6.118   6.890
  497   1HG1  ILE  57          HG12      ILE  57  -8.640   8.928   7.112
  498   2HG1  ILE  57          HG11      ILE  57 -10.229   8.526   7.762
  499   1HG2  ILE  57          HG21      ILE  57  -8.203   8.361   5.331
  500   2HG2  ILE  57          HG22      ILE  57  -9.461   7.522   4.425
  501   3HG2  ILE  57          HG23      ILE  57  -7.996   6.666   4.900
  502   1HD1  ILE  57          HD11      ILE  57  -7.559   7.383   8.612
  503   2HD1  ILE  57          HD12      ILE  57  -9.107   6.714   9.127
  504   3HD1  ILE  57          HD13      ILE  57  -8.662   8.358   9.582
  505    H    TRP  58           HN       TRP  58 -11.232   4.290   7.081
  506    HA   TRP  58           HA       TRP  58 -12.100   5.083   9.803
  507   1HB   TRP  58          HB2       TRP  58 -14.080   4.751   8.085
  508   2HB   TRP  58          HB1       TRP  58 -13.750   3.038   8.348
  509    HD1  TRP  58           HD1      TRP  58 -14.515   1.982  10.577
  510    HE1  TRP  58           HE1      TRP  58 -15.755   2.866  12.657
  511    HE3  TRP  58           HE3      TRP  58 -14.379   6.996   9.619
  512    HZ2  TRP  58           HZ2      TRP  58 -16.581   5.370  13.768
  513    HZ3  TRP  58           HZ3      TRP  58 -15.398   8.605  11.203
  514    HH2  TRP  58           HH2      TRP  58 -16.498   7.800  13.275
  515    H    VAL  59           HN       VAL  59  -9.668   4.018   9.317
  516    HA   VAL  59           HA       VAL  59  -9.581   1.131   9.308
  517    HB   VAL  59           HB       VAL  59  -7.227   1.395   9.972
  518   1HG1  VAL  59          HG11      VAL  59  -8.335   2.219   7.634
  519   2HG1  VAL  59          HG12      VAL  59  -6.599   2.216   7.936
  520   3HG1  VAL  59          HG13      VAL  59  -7.525   3.703   8.135
  521   1HG2  VAL  59          HG21      VAL  59  -7.470   3.169  11.636
  522   2HG2  VAL  59          HG22      VAL  59  -7.998   4.301  10.393
  523   3HG2  VAL  59          HG23      VAL  59  -6.343   3.695  10.388
  524    H    ARG  60           HN       ARG  60  -9.748  -0.293  11.010
  525    HA   ARG  60           HA       ARG  60  -9.795   0.825  13.777
  526   1HB   ARG  60          HB2       ARG  60 -12.107   0.210  12.445
  527   2HB   ARG  60          HB1       ARG  60 -11.758  -1.318  13.250
  528   1HG   ARG  60          HG2       ARG  60 -11.533  -0.116  15.408
  529   2HG   ARG  60          HG1       ARG  60 -11.933   1.396  14.593
  530   1HD   ARG  60          HD2       ARG  60 -14.122   0.480  13.938
  531   2HD   ARG  60          HD1       ARG  60 -13.724  -1.049  14.723
  532    HE   ARG  60           HE       ARG  60 -14.177  -0.037  16.815
  533   1HH1  ARG  60          HH11      ARG  60 -15.896   1.782  14.917
  534   2HH1  ARG  60          HH12      ARG  60 -15.541   3.332  15.603
  535   1HH2  ARG  60          HH21      ARG  60 -12.830   2.189  17.454
  536   2HH2  ARG  60          HH22      ARG  60 -13.802   3.563  17.044
  537    H    GLU  61           HN       GLU  61 -10.011  -2.268  11.957
  538    HA   GLU  61           HA       GLU  61  -8.344  -3.515  14.092
  539   1HB   GLU  61          HB2       GLU  61 -10.322  -4.605  12.103
  540   2HB   GLU  61          HB1       GLU  61  -9.132  -5.668  12.857
  541   1HG   GLU  61          HG2       GLU  61  -9.931  -5.111  15.070
  542   2HG   GLU  61          HG1       GLU  61 -10.986  -3.854  14.424
  543    H    GLY  62           HN       GLY  62  -8.135  -2.437  10.795
  544   1HA   GLY  62          HA2       GLY  62  -5.523  -2.604  10.303
  545   2HA   GLY  62          HA1       GLY  62  -5.932  -4.316  10.189
  546    H    ASP  63           HN       ASP  63  -6.254  -1.195   8.686
  547    HA   ASP  63           HA       ASP  63  -7.789  -2.349   6.397
  548   1HB   ASP  63          HB2       ASP  63  -7.594   0.261   7.614
  549   2HB   ASP  63          HB1       ASP  63  -7.133   0.376   5.916
  550    H    VAL  64           HN       VAL  64  -6.879  -1.920   4.134
  551    HA   VAL  64           HA       VAL  64  -3.899  -2.145   4.267
  552    HB   VAL  64           HB       VAL  64  -5.115  -2.666   1.647
  553   1HG1  VAL  64          HG11      VAL  64  -3.679  -4.690   1.878
  554   2HG1  VAL  64          HG12      VAL  64  -3.326  -4.224   3.540
  555   3HG1  VAL  64          HG13      VAL  64  -2.794  -3.200   2.208
  556   1HG2  VAL  64          HG21      VAL  64  -5.978  -4.931   2.412
  557   2HG2  VAL  64          HG22      VAL  64  -6.975  -3.560   2.895
  558   3HG2  VAL  64          HG23      VAL  64  -5.898  -4.321   4.066
  559    H    VAL  65           HN       VAL  65  -2.558  -0.775   3.113
  560    HA   VAL  65           HA       VAL  65  -3.852   1.357   1.481
  561    HB   VAL  65           HB       VAL  65  -2.649   3.119   2.668
  562   1HG1  VAL  65          HG11      VAL  65  -4.872   1.971   3.566
  563   2HG1  VAL  65          HG12      VAL  65  -4.071   3.242   4.488
  564   3HG1  VAL  65          HG13      VAL  65  -3.832   1.549   4.922
  565   1HG2  VAL  65          HG21      VAL  65  -1.242   2.701   4.567
  566   2HG2  VAL  65          HG22      VAL  65  -0.702   1.600   3.302
  567   3HG2  VAL  65          HG23      VAL  65  -1.708   1.001   4.621
  568    H    ILE  66           HN       ILE  66  -2.326   2.563   0.157
  569    HA   ILE  66           HA       ILE  66   0.120   0.949  -0.503
  570    HB   ILE  66           HB       ILE  66  -1.596   1.547  -2.330
  571   1HG1  ILE  66          HG12      ILE  66   0.841   2.736  -3.372
  572   2HG1  ILE  66          HG11      ILE  66   1.201   1.342  -2.354
  573   1HG2  ILE  66          HG21      ILE  66  -0.260   4.200  -2.555
  574   2HG2  ILE  66          HG22      ILE  66  -1.513   4.047  -1.323
  575   3HG2  ILE  66          HG23      ILE  66  -1.895   3.724  -3.013
  576   1HD1  ILE  66          HD11      ILE  66  -0.662   1.417  -4.743
  577   2HD1  ILE  66          HD12      ILE  66  -0.523   0.041  -3.649
  578   3HD1  ILE  66          HD13      ILE  66   0.864   0.545  -4.614
  579    H    VAL  67           HN       VAL  67   2.203   2.062  -0.371
  580    HA   VAL  67           HA       VAL  67   1.950   4.788   0.824
  581    HB   VAL  67           HB       VAL  67   3.284   4.287   2.627
  582   1HG1  VAL  67          HG11      VAL  67   2.495   2.300   3.625
  583   2HG1  VAL  67          HG12      VAL  67   2.396   1.459   2.078
  584   3HG1  VAL  67          HG13      VAL  67   1.234   2.727   2.469
  585   1HG2  VAL  67          HG21      VAL  67   4.543   2.209   0.837
  586   2HG2  VAL  67          HG22      VAL  67   4.833   2.219   2.576
  587   3HG2  VAL  67          HG23      VAL  67   5.302   3.609   1.597
  588    H    LYS  68           HN       LYS  68   3.644   6.174   0.651
  589    HA   LYS  68           HA       LYS  68   5.511   5.793  -1.620
  590   1HB   LYS  68          HB2       LYS  68   4.454   8.307  -0.302
  591   2HB   LYS  68          HB1       LYS  68   5.695   8.299  -1.555
  592   1HG   LYS  68          HG2       LYS  68   3.904   6.865  -2.876
  593   2HG   LYS  68          HG1       LYS  68   2.775   7.664  -1.778
  594   1HD   LYS  68          HD2       LYS  68   3.988   9.852  -2.444
  595   2HD   LYS  68          HD1       LYS  68   4.629   8.921  -3.799
  596   1HE   LYS  68          HE2       LYS  68   1.936   8.277  -3.832
  597   2HE   LYS  68          HE1       LYS  68   1.925   9.979  -3.371
  598   1HZ   LYS  68          HZ1       LYS  68   3.272   8.799  -5.740
  599   2HZ   LYS  68          HZ2       LYS  68   3.394  10.427  -5.269
  600   3HZ   LYS  68          HZ3       LYS  68   1.894   9.788  -5.747
  601    HA   PRO  69           HA       PRO  69   8.650   5.778   1.487
  602   1HB   PRO  69          HB2       PRO  69  10.803   6.089  -0.132
  603   2HB   PRO  69          HB1       PRO  69   9.880   4.583  -0.036
  604   1HG   PRO  69          HG2       PRO  69   9.965   6.582  -2.233
  605   2HG   PRO  69          HG1       PRO  69   9.480   4.880  -2.289
  606   1HD   PRO  69          HD2       PRO  69   7.750   7.170  -2.211
  607   2HD   PRO  69          HD1       PRO  69   7.276   5.456  -2.148
  608    H    TRP  70           HN       TRP  70   9.573   7.241   2.805
  609    HA   TRP  70           HA       TRP  70  10.139   9.993   1.785
  610   1HB   TRP  70          HB2       TRP  70   9.204   9.108   4.506
  611   2HB   TRP  70          HB1       TRP  70   9.879  10.698   4.203
  612    HD1  TRP  70           HD1      TRP  70   7.661   8.650   1.968
  613    HE1  TRP  70           HE1      TRP  70   5.599   9.938   1.584
  614    HE3  TRP  70           HE3      TRP  70   8.508  12.627   5.020
  615    HZ2  TRP  70           HZ2      TRP  70   4.343  12.341   2.406
  616    HZ3  TRP  70           HZ3      TRP  70   6.819  14.439   5.202
  617    HH2  TRP  70           HH2      TRP  70   4.716  14.303   3.884
  618    H    GLU  71           HN       GLU  71  12.477  10.202   1.837
  619    HA   GLU  71           HA       GLU  71  14.714   9.809   2.455
  620   1HB   GLU  71          HB2       GLU  71  13.422   9.930   5.201
  621   2HB   GLU  71          HB1       GLU  71  15.133  10.165   4.860
  622   1HG   GLU  71          HG2       GLU  71  13.479  11.863   3.174
  623   2HG   GLU  71          HG1       GLU  71  13.167  12.149   4.886
  624    H    VAL  72           HN       VAL  72  15.439   8.358   5.036
  625    HA   VAL  72           HA       VAL  72  14.440   5.637   4.646
  626    HB   VAL  72           HB       VAL  72  16.022   5.464   2.922
  627   1HG1  VAL  72          HG11      VAL  72  17.370   7.579   4.365
  628   2HG1  VAL  72          HG12      VAL  72  17.549   7.093   2.680
  629   3HG1  VAL  72          HG13      VAL  72  18.515   6.309   3.930
  630   1HG2  VAL  72          HG21      VAL  72  16.338   3.921   5.108
  631   2HG2  VAL  72          HG22      VAL  72  17.939   4.657   5.053
  632   3HG2  VAL  72          HG23      VAL  72  17.340   3.743   3.669
  633    H    GLN  73           HN       GLN  73  17.635   6.564   5.982
  634    HA   GLN  73           HA       GLN  73  18.492   6.257   8.137
  635   1HB   GLN  73          HB2       GLN  73  15.765   7.335   8.925
  636   2HB   GLN  73          HB1       GLN  73  17.244   7.414   9.879
  637   1HG   GLN  73          HG2       GLN  73  18.111   9.139   8.654
  638   2HG   GLN  73          HG1       GLN  73  17.411   8.557   7.143
  639   1HE2  GLN  73          HE21      GLN  73  14.878   8.780   7.072
  640   2HE2  GLN  73          HE22      GLN  73  14.233  10.198   7.744
  641    H    GLY  74           HN       GLY  74  16.868   5.675  10.552
  642   1HA   GLY  74          HA2       GLY  74  16.518   2.767  10.095
  643   2HA   GLY  74          HA1       GLY  74  16.633   3.558  11.667
  644    H    ASP  75           HN       ASP  75  14.540   5.080   9.380
  645    HA   ASP  75           HA       ASP  75  12.105   3.624   9.935
  646   1HB   ASP  75          HB2       ASP  75  11.109   5.754  11.153
  647   2HB   ASP  75          HB1       ASP  75  11.953   4.524  12.088
  648    H    GLN  76           HN       GLN  76  10.606   4.225   8.320
  649    HA   GLN  76           HA       GLN  76  11.423   6.653   6.757
  650   1HB   GLN  76          HB2       GLN  76  10.459   3.966   5.964
  651   2HB   GLN  76          HB1       GLN  76   9.889   5.324   4.998
  652   1HG   GLN  76          HG2       GLN  76  12.479   6.007   5.154
  653   2HG   GLN  76          HG1       GLN  76  12.656   4.260   5.322
  654   1HE2  GLN  76          HE21      GLN  76  13.440   3.757   3.211
  655   2HE2  GLN  76          HE22      GLN  76  12.559   4.064   1.794
  656    H    LYS  77           HN       LYS  77   9.824   7.953   5.796
  657    HA   LYS  77           HA       LYS  77   7.192   7.935   7.255
  658   1HB   LYS  77          HB2       LYS  77   8.715  10.031   7.285
  659   2HB   LYS  77          HB1       LYS  77   8.260  10.215   5.597
  660   1HG   LYS  77          HG2       LYS  77   6.703  11.536   6.832
  661   2HG   LYS  77          HG1       LYS  77   5.833  10.076   6.364
  662   1HD   LYS  77          HD2       LYS  77   6.205   9.097   8.567
  663   2HD   LYS  77          HD1       LYS  77   7.194  10.478   9.045
  664   1HE   LYS  77          HE2       LYS  77   5.002  11.821   8.315
  665   2HE   LYS  77          HE1       LYS  77   4.231  10.287   8.719
  666   1HZ   LYS  77          HZ1       LYS  77   6.040  11.826  10.503
  667   2HZ   LYS  77          HZ2       LYS  77   5.265  10.364  10.890
  668   3HZ   LYS  77          HZ3       LYS  77   4.350  11.771  10.629
  669    H    CYS  78           HN       CYS  78   5.235   8.041   5.918
  670    HA   CYS  78           HA       CYS  78   5.816   7.637   3.030
  671   1HB   CYS  78          HB2       CYS  78   4.588   5.586   2.890
  672   2HB   CYS  78          HB1       CYS  78   5.736   5.410   4.209
  673    HG   CYS  78           HG       CYS  78   3.294   4.621   4.943
  674    H    ASP  79           HN       ASP  79   4.075   7.990   1.622
  675    HA   ASP  79           HA       ASP  79   1.828   9.590   2.886
  676   1HB   ASP  79          HB2       ASP  79   3.382  10.272   0.731
  677   2HB   ASP  79          HB1       ASP  79   2.071   9.426  -0.090
  678    H    ILE  80           HN       ILE  80  -0.051   8.365   3.142
  679    HA   ILE  80           HA       ILE  80  -0.223   5.975   1.357
  680    HB   ILE  80           HB       ILE  80  -1.529   4.904   3.233
  681   1HG1  ILE  80          HG12      ILE  80  -0.516   6.151   5.462
  682   2HG1  ILE  80          HG11      ILE  80  -0.908   7.530   4.440
  683   1HG2  ILE  80          HG21      ILE  80   1.305   5.693   3.903
  684   2HG2  ILE  80          HG22      ILE  80   0.890   4.529   2.645
  685   3HG2  ILE  80          HG23      ILE  80   0.475   4.195   4.326
  686   1HD1  ILE  80          HD11      ILE  80  -2.728   6.365   6.035
  687   2HD1  ILE  80          HD12      ILE  80  -2.939   5.362   4.600
  688   3HD1  ILE  80          HD13      ILE  80  -3.163   7.108   4.496
  689    H    ILE  81           HN       ILE  81  -2.119   5.059   0.868
  690    HA   ILE  81           HA       ILE  81  -4.530   6.843   0.890
  691    HB   ILE  81           HB       ILE  81  -3.343   6.365  -1.412
  692   1HG1  ILE  81          HG12      ILE  81  -5.827   5.824  -2.318
  693   2HG1  ILE  81          HG11      ILE  81  -6.223   6.287  -0.664
  694   1HG2  ILE  81          HG21      ILE  81  -5.005   3.858  -1.302
  695   2HG2  ILE  81          HG22      ILE  81  -3.315   3.832  -0.803
  696   3HG2  ILE  81          HG23      ILE  81  -3.739   4.298  -2.448
  697   1HD1  ILE  81          HD11      ILE  81  -5.952   8.455  -1.188
  698   2HD1  ILE  81          HD12      ILE  81  -5.599   7.997  -2.854
  699   3HD1  ILE  81          HD13      ILE  81  -4.288   8.140  -1.684
  700    H    TRP  82           HN       TRP  82  -6.245   5.889   1.932
  701    HA   TRP  82           HA       TRP  82  -5.835   3.115   2.885
  702   1HB   TRP  82          HB2       TRP  82  -6.406   4.197   4.788
  703   2HB   TRP  82          HB1       TRP  82  -7.137   5.537   3.915
  704    HD1  TRP  82           HD1      TRP  82  -7.954   2.289   5.653
  705    HE1  TRP  82           HE1      TRP  82 -10.513   1.972   5.722
  706    HE3  TRP  82           HE3      TRP  82  -9.395   6.076   2.547
  707    HZ2  TRP  82           HZ2      TRP  82 -12.860   3.170   4.605
  708    HZ3  TRP  82           HZ3      TRP  82 -11.793   6.464   2.065
  709    HH2  TRP  82           HH2      TRP  82 -13.527   5.018   3.089
  710    H    ARG  83           HN       ARG  83  -7.348   1.489   2.701
  711    HA   ARG  83           HA       ARG  83  -9.949   1.707   1.572
  712   1HB   ARG  83          HB2       ARG  83  -7.989   2.005  -0.388
  713   2HB   ARG  83          HB1       ARG  83  -8.445   0.305  -0.507
  714   1HG   ARG  83          HG2       ARG  83 -10.199   1.039  -1.742
  715   2HG   ARG  83          HG1       ARG  83 -10.890   1.554  -0.203
  716   1HD   ARG  83          HD2       ARG  83 -10.096   3.782  -0.472
  717   2HD   ARG  83          HD1       ARG  83  -9.014   3.319  -1.786
  718    HE   ARG  83           HE       ARG  83 -11.339   2.719  -2.945
  719   1HH1  ARG  83          HH11      ARG  83 -10.282   5.382  -3.606
  720   2HH1  ARG  83          HH12      ARG  83 -11.548   6.450  -3.097
  721   1HH2  ARG  83          HH21      ARG  83 -13.105   4.077  -1.092
  722   2HH2  ARG  83          HH22      ARG  83 -13.149   5.708  -1.670
  723    H    TYR  84           HN       TYR  84 -10.869  -0.477   1.098
  724    HA   TYR  84           HA       TYR  84  -9.499  -2.551   2.744
  725   1HB   TYR  84          HB2       TYR  84 -11.932  -1.753   3.178
  726   2HB   TYR  84          HB1       TYR  84 -12.341  -2.703   1.751
  727    HD1  TYR  84           HD1      TYR  84 -12.741  -5.004   1.960
  728    HD2  TYR  84           HD2      TYR  84 -10.501  -2.964   5.005
  729    HE1  TYR  84           HE1      TYR  84 -12.715  -7.072   3.327
  730    HE2  TYR  84           HE2      TYR  84 -10.474  -5.032   6.372
  731    HH   TYR  84           HH       TYR  84 -10.830  -7.871   5.417
  732    H    THR  85           HN       THR  85 -11.332  -2.223  -0.318
  733    HA   THR  85           HA       THR  85  -9.704  -4.485  -1.405
  734    HB   THR  85           HB       THR  85 -11.774  -4.993  -2.831
  735    HG1  THR  85           HG1      THR  85 -13.200  -3.455  -2.583
  736   1HG2  THR  85          HG21      THR  85 -11.241  -6.536  -1.113
  737   2HG2  THR  85          HG22      THR  85 -12.938  -6.136  -0.846
  738   3HG2  THR  85          HG23      THR  85 -11.689  -5.399   0.158
  739    H    LYS  86           HN       LYS  86  -8.391  -2.475  -2.017
  740    HA   LYS  86           HA       LYS  86  -9.506  -0.873  -4.232
  741   1HB   LYS  86          HB2       LYS  86  -7.348  -0.591  -2.336
  742   2HB   LYS  86          HB1       LYS  86  -6.724  -0.399  -3.973
  743   1HG   LYS  86          HG2       LYS  86  -9.293   0.972  -3.385
  744   2HG   LYS  86          HG1       LYS  86  -7.862   1.628  -2.591
  745   1HD   LYS  86          HD2       LYS  86  -6.778   1.468  -4.964
  746   2HD   LYS  86          HD1       LYS  86  -8.445   1.393  -5.533
  747   1HE   LYS  86          HE2       LYS  86  -8.968   3.521  -4.592
  748   2HE   LYS  86          HE1       LYS  86  -7.484   3.546  -3.640
  749   1HZ   LYS  86          HZ1       LYS  86  -7.281   4.950  -5.583
  750   2HZ   LYS  86          HZ2       LYS  86  -7.656   3.646  -6.604
  751   3HZ   LYS  86          HZ3       LYS  86  -6.215   3.636  -5.703
  752    H    THR  87           HN       THR  87  -8.293  -0.719  -6.303
  753    HA   THR  87           HA       THR  87  -7.662  -3.386  -7.334
  754    HB   THR  87           HB       THR  87  -7.212  -1.999  -9.479
  755    HG1  THR  87           HG1      THR  87  -6.956   0.017  -8.680
  756   1HG2  THR  87          HG21      THR  87  -9.664  -1.679  -9.824
  757   2HG2  THR  87          HG22      THR  87  -9.912  -1.989  -8.106
  758   3HG2  THR  87          HG23      THR  87  -9.265  -3.258  -9.147
  759    H    GLN  88           HN       GLN  88  -5.801  -1.166  -5.668
  760    HA   GLN  88           HA       GLN  88  -3.327  -1.821  -7.197
  761   1HB   GLN  88          HB2       GLN  88  -2.413  -0.073  -5.372
  762   2HB   GLN  88          HB1       GLN  88  -3.124   0.447  -6.896
  763   1HG   GLN  88          HG2       GLN  88  -5.214   0.946  -5.872
  764   2HG   GLN  88          HG1       GLN  88  -4.790   0.071  -4.401
  765   1HE2  GLN  88          HE21      GLN  88  -3.736   2.924  -6.341
  766   2HE2  GLN  88          HE22      GLN  88  -3.190   3.813  -5.002
  767    H    VAL  89           HN       VAL  89  -4.470  -1.659  -3.785
  768    HA   VAL  89           HA       VAL  89  -2.226  -3.109  -2.740
  769    HB   VAL  89           HB       VAL  89  -5.015  -2.780  -1.594
  770   1HG1  VAL  89          HG11      VAL  89  -4.368  -4.122   0.098
  771   2HG1  VAL  89          HG12      VAL  89  -2.927  -3.137   0.353
  772   3HG1  VAL  89          HG13      VAL  89  -2.883  -4.482  -0.782
  773   1HG2  VAL  89          HG21      VAL  89  -2.406  -1.301  -1.092
  774   2HG2  VAL  89          HG22      VAL  89  -3.912  -1.031  -0.214
  775   3HG2  VAL  89          HG23      VAL  89  -3.813  -0.649  -1.933
  776    H    GLU  90           HN       GLU  90  -5.357  -4.171  -4.039
  777    HA   GLU  90           HA       GLU  90  -5.185  -6.905  -3.185
  778   1HB   GLU  90          HB2       GLU  90  -6.635  -5.479  -5.403
  779   2HB   GLU  90          HB1       GLU  90  -6.627  -7.242  -5.357
  780   1HG   GLU  90          HG2       GLU  90  -7.481  -7.157  -3.018
  781   2HG   GLU  90          HG1       GLU  90  -7.568  -5.400  -3.137
  782    H    TRP  91           HN       TRP  91  -3.928  -5.200  -6.037
  783    HA   TRP  91           HA       TRP  91  -2.959  -7.515  -7.436
  784   1HB   TRP  91          HB2       TRP  91  -2.596  -4.577  -7.604
  785   2HB   TRP  91          HB1       TRP  91  -1.279  -5.542  -8.265
  786    HD1  TRP  91           HD1      TRP  91  -5.034  -6.418  -8.354
  787    HE1  TRP  91           HE1      TRP  91  -5.743  -6.674 -10.818
  788    HE3  TRP  91           HE3      TRP  91  -0.695  -5.039 -10.663
  789    HZ2  TRP  91           HZ2      TRP  91  -4.616  -6.334 -13.427
  790    HZ3  TRP  91           HZ3      TRP  91  -0.540  -5.012 -13.135
  791    HH2  TRP  91           HH2      TRP  91  -2.494  -5.657 -14.519
  792    H    LEU  92           HN       LEU  92  -1.162  -5.114  -5.447
  793    HA   LEU  92           HA       LEU  92   1.318  -6.499  -5.474
  794   1HB   LEU  92          HB2       LEU  92   1.773  -5.244  -3.288
  795   2HB   LEU  92          HB1       LEU  92   1.391  -4.258  -4.696
  796    HG   LEU  92           HG       LEU  92  -1.104  -4.613  -3.716
  797   1HD1  LEU  92          HD11      LEU  92  -0.018  -4.029  -1.115
  798   2HD1  LEU  92          HD12      LEU  92   0.576  -5.599  -1.656
  799   3HD1  LEU  92          HD13      LEU  92  -1.157  -5.293  -1.572
  800   1HD2  LEU  92          HD21      LEU  92   1.032  -2.570  -3.277
  801   2HD2  LEU  92          HD22      LEU  92  -0.449  -2.414  -2.332
  802   3HD2  LEU  92          HD23      LEU  92  -0.523  -2.408  -4.094
  803    H    LYS  93           HN       LYS  93  -1.526  -6.936  -3.418
  804    HA   LYS  93           HA       LYS  93  -0.388  -8.608  -1.417
  805   1HB   LYS  93          HB2       LYS  93  -3.097  -8.091  -2.505
  806   2HB   LYS  93          HB1       LYS  93  -2.892  -9.653  -1.713
  807   1HG   LYS  93          HG2       LYS  93  -2.262  -8.661   0.340
  808   2HG   LYS  93          HG1       LYS  93  -1.922  -7.107  -0.417
  809   1HD   LYS  93          HD2       LYS  93  -4.003  -6.739   0.609
  810   2HD   LYS  93          HD1       LYS  93  -4.448  -7.124  -1.053
  811   1HE   LYS  93          HE2       LYS  93  -5.892  -8.452   0.288
  812   2HE   LYS  93          HE1       LYS  93  -4.641  -9.562  -0.268
  813   1HZ   LYS  93          HZ1       LYS  93  -3.483  -9.260   1.826
  814   2HZ   LYS  93          HZ2       LYS  93  -5.067  -9.806   2.100
  815   3HZ   LYS  93          HZ3       LYS  93  -4.672  -8.173   2.359
  816    H    ARG  94           HN       ARG  94  -1.921  -9.481  -4.538
  817    HA   ARG  94           HA       ARG  94  -1.498 -12.291  -4.390
  818   1HB   ARG  94          HB2       ARG  94  -1.891 -10.331  -6.624
  819   2HB   ARG  94          HB1       ARG  94  -1.381 -11.972  -7.019
  820   1HG   ARG  94          HG2       ARG  94  -3.389 -12.422  -5.188
  821   2HG   ARG  94          HG1       ARG  94  -3.985 -11.003  -6.051
  822   1HD   ARG  94          HD2       ARG  94  -2.918 -12.732  -8.021
  823   2HD   ARG  94          HD1       ARG  94  -3.880 -13.745  -6.946
  824    HE   ARG  94           HE       ARG  94  -4.909 -11.540  -8.628
  825   1HH1  ARG  94          HH11      ARG  94  -5.971 -14.409  -8.434
  826   2HH1  ARG  94          HH12      ARG  94  -7.437 -14.157  -7.546
  827   1HH2  ARG  94          HH21      ARG  94  -6.557 -10.967  -6.485
  828   2HH2  ARG  94          HH22      ARG  94  -7.769 -12.203  -6.439
  829    H    LYS  95           HN       LYS  95   0.631  -9.657  -5.411
  830    HA   LYS  95           HA       LYS  95   2.730 -11.255  -6.527
  831   1HB   LYS  95          HB2       LYS  95   2.399  -8.462  -5.610
  832   2HB   LYS  95          HB1       LYS  95   4.050  -9.078  -5.531
  833   1HG   LYS  95          HG2       LYS  95   4.095  -9.568  -7.852
  834   2HG   LYS  95          HG1       LYS  95   2.343  -9.424  -7.998
  835   1HD   LYS  95          HD2       LYS  95   2.391  -7.084  -7.852
  836   2HD   LYS  95          HD1       LYS  95   3.984  -7.069  -7.094
  837   1HE   LYS  95          HE2       LYS  95   4.973  -7.903  -9.222
  838   2HE   LYS  95          HE1       LYS  95   3.380  -7.813  -9.972
  839   1HZ   LYS  95          HZ1       LYS  95   4.689  -5.834 -10.432
  840   2HZ   LYS  95          HZ2       LYS  95   4.858  -5.532  -8.769
  841   3HZ   LYS  95          HZ3       LYS  95   3.326  -5.445  -9.500
  842    H    GLY  96           HN       GLY  96   1.977 -10.288  -3.185
  843   1HA   GLY  96          HA2       GLY  96   4.480 -11.099  -2.025
  844   2HA   GLY  96          HA1       GLY  96   2.950 -10.946  -1.153
  845    H    TYR  97           HN       TYR  97   1.379 -12.779  -2.518
  846    HA   TYR  97           HA       TYR  97   2.204 -15.280  -1.337
  847   1HB   TYR  97          HB2       TYR  97   0.199 -15.223  -3.572
  848   2HB   TYR  97          HB1       TYR  97   0.176 -16.157  -2.081
  849    HD1  TYR  97           HD1      TYR  97   0.735 -13.942  -0.099
  850    HD2  TYR  97           HD2      TYR  97  -1.888 -14.112  -3.498
  851    HE1  TYR  97           HE1      TYR  97  -0.702 -12.206   0.924
  852    HE2  TYR  97           HE2      TYR  97  -3.327 -12.377  -2.475
  853    HH   TYR  97           HH       TYR  97  -3.502 -11.653   0.496
  854    H    LEU  98           HN       LEU  98   2.376 -13.957  -4.613
  855    HA   LEU  98           HA       LEU  98   3.185 -16.244  -6.059
  856   1HB   LEU  98          HB2       LEU  98   2.765 -13.624  -6.637
  857   2HB   LEU  98          HB1       LEU  98   4.525 -13.665  -6.674
  858    HG   LEU  98           HG       LEU  98   2.638 -15.401  -8.283
  859   1HD1  LEU  98          HD11      LEU  98   4.603 -13.198  -8.950
  860   2HD1  LEU  98          HD12      LEU  98   2.853 -13.169  -9.172
  861   3HD1  LEU  98          HD13      LEU  98   3.850 -14.235 -10.163
  862   1HD2  LEU  98          HD21      LEU  98   4.863 -16.145  -9.333
  863   2HD2  LEU  98          HD22      LEU  98   4.498 -16.793  -7.733
  864   3HD2  LEU  98          HD23      LEU  98   5.640 -15.459  -7.906
  865    H    ASP  99           HN       ASP  99   5.254 -13.718  -4.597
  866    HA   ASP  99           HA       ASP  99   7.750 -15.019  -5.017
  867   1HB   ASP  99          HB2       ASP  99   7.470 -12.625  -4.354
  868   2HB   ASP  99          HB1       ASP  99   7.003 -13.158  -2.740
  869    H    GLU 100           HN       GLU 100   5.374 -15.340  -2.398
  870    HA   GLU 100           HA       GLU 100   6.959 -16.786  -0.537
  871   1HB   GLU 100          HB2       GLU 100   4.020 -16.593  -1.095
  872   2HB   GLU 100          HB1       GLU 100   4.594 -17.839   0.013
  873   1HG   GLU 100          HG2       GLU 100   5.482 -16.268   1.524
  874   2HG   GLU 100          HG1       GLU 100   5.501 -14.982   0.317
  875    H    LEU 101           HN       LEU 101   4.707 -18.123  -3.018
  876    HA   LEU 101           HA       LEU 101   6.517 -20.467  -3.227
  877   1HB   LEU 101          HB2       LEU 101   4.398 -21.948  -3.362
  878   2HB   LEU 101          HB1       LEU 101   4.960 -21.449  -1.777
  879    HG   LEU 101           HG       LEU 101   2.464 -21.286  -2.130
  880   1HD1  LEU 101          HD11      LEU 101   3.181 -18.487  -1.631
  881   2HD1  LEU 101          HD12      LEU 101   4.159 -19.638  -0.721
  882   3HD1  LEU 101          HD13      LEU 101   2.401 -19.661  -0.573
  883   1HD2  LEU 101          HD21      LEU 101   3.058 -18.820  -3.763
  884   2HD2  LEU 101          HD22      LEU 101   1.517 -19.643  -3.536
  885   3HD2  LEU 101          HD23      LEU 101   2.774 -20.384  -4.526
  886    H    LEU 102           HN       LEU 102   6.232 -21.698  -5.216
  887    HA   LEU 102           HA       LEU 102   5.785 -21.957  -7.502
  888   1HB   LEU 102          HB2       LEU 102   3.410 -21.202  -6.774
  889   2HB   LEU 102          HB1       LEU 102   3.873 -19.624  -7.407
  890    HG   LEU 102           HG       LEU 102   4.687 -21.277  -9.438
  891   1HD1  LEU 102          HD11      LEU 102   3.627 -23.217  -8.270
  892   2HD1  LEU 102          HD12      LEU 102   2.906 -22.893  -9.846
  893   3HD1  LEU 102          HD13      LEU 102   2.072 -22.391  -8.376
  894   1HD2  LEU 102          HD21      LEU 102   3.470 -19.307  -9.931
  895   2HD2  LEU 102          HD22      LEU 102   2.105 -19.795  -8.926
  896   3HD2  LEU 102          HD23      LEU 102   2.403 -20.605 -10.465
  Start of MODEL   10
    1   1H    MET   1          HT1       MET   1 -17.726  -8.638 -29.861
    2   2H    MET   1          HT2       MET   1 -17.288  -7.495 -31.039
    3   3H    MET   1          HT3       MET   1 -18.753  -7.331 -30.196
    4    HA   MET   1           HA       MET   1 -16.865  -5.833 -29.476
    5   1HB   MET   1          HB2       MET   1 -17.480  -6.043 -27.115
    6   2HB   MET   1          HB1       MET   1 -18.910  -6.254 -28.124
    7   1HG   MET   1          HG2       MET   1 -18.315  -8.802 -27.989
    8   2HG   MET   1          HG1       MET   1 -17.363  -8.326 -26.584
    9   1HE   MET   1          HE1       MET   1 -21.844  -7.980 -27.295
   10   2HE   MET   1          HE2       MET   1 -20.978  -9.479 -27.618
   11   3HE   MET   1          HE3       MET   1 -20.516  -8.003 -28.464
   12    H    ALA   2           HN       ALA   2 -14.902  -5.726 -28.276
   13    HA   ALA   2           HA       ALA   2 -13.198  -8.100 -28.551
   14   1HB   ALA   2          HB1       ALA   2 -11.424  -6.557 -27.641
   15   2HB   ALA   2          HB2       ALA   2 -12.657  -5.300 -27.523
   16   3HB   ALA   2          HB3       ALA   2 -12.215  -5.957 -29.098
   17    H    GLU   3           HN       GLU   3 -14.211  -5.994 -25.826
   18    HA   GLU   3           HA       GLU   3 -14.139  -8.362 -24.043
   19   1HB   GLU   3          HB2       GLU   3 -12.769  -7.223 -22.364
   20   2HB   GLU   3          HB1       GLU   3 -11.883  -7.328 -23.884
   21   1HG   GLU   3          HG2       GLU   3 -13.385  -4.918 -23.986
   22   2HG   GLU   3          HG1       GLU   3 -12.621  -4.973 -22.397
   23    H    GLN   4           HN       GLN   4 -15.127  -7.826 -21.877
   24    HA   GLN   4           HA       GLN   4 -17.311  -5.818 -22.238
   25   1HB   GLN   4          HB2       GLN   4 -18.552  -7.135 -20.559
   26   2HB   GLN   4          HB1       GLN   4 -18.067  -8.140 -21.922
   27   1HG   GLN   4          HG2       GLN   4 -16.817  -9.474 -20.598
   28   2HG   GLN   4          HG1       GLN   4 -16.005  -8.090 -19.866
   29   1HE2  GLN   4          HE21      GLN   4 -17.202  -6.987 -18.033
   30   2HE2  GLN   4          HE22      GLN   4 -18.272  -7.905 -17.089
   31    H    GLN   5           HN       GLN   5 -14.363  -6.039 -20.714
   32    HA   GLN   5           HA       GLN   5 -15.284  -4.398 -18.386
   33   1HB   GLN   5          HB2       GLN   5 -13.213  -6.505 -18.690
   34   2HB   GLN   5          HB1       GLN   5 -12.761  -5.119 -17.697
   35   1HG   GLN   5          HG2       GLN   5 -14.179  -5.703 -16.029
   36   2HG   GLN   5          HG1       GLN   5 -15.477  -6.103 -17.156
   37   1HE2  GLN   5          HE21      GLN   5 -12.668  -7.422 -15.443
   38   2HE2  GLN   5          HE22      GLN   5 -12.990  -9.049 -15.809
   39    H    GLN   6           HN       GLN   6 -13.256  -2.972 -17.625
   40    HA   GLN   6           HA       GLN   6 -11.813  -1.186 -18.077
   41   1HB   GLN   6          HB2       GLN   6 -10.699  -2.977 -19.559
   42   2HB   GLN   6          HB1       GLN   6 -11.543  -2.214 -20.907
   43   1HG   GLN   6          HG2       GLN   6  -9.873  -0.711 -21.021
   44   2HG   GLN   6          HG1       GLN   6 -10.388  -0.096 -19.449
   45   1HE2  GLN   6          HE21      GLN   6  -9.104  -0.639 -17.596
   46   2HE2  GLN   6          HE22      GLN   6  -7.659  -1.523 -17.705
   47    H    GLU   7           HN       GLU   7 -13.049   0.638 -18.049
   48    HA   GLU   7           HA       GLU   7 -14.714   1.253 -20.452
   49   1HB   GLU   7          HB2       GLU   7 -15.423   1.272 -17.784
   50   2HB   GLU   7          HB1       GLU   7 -15.059   2.970 -18.085
   51   1HG   GLU   7          HG2       GLU   7 -16.892   3.245 -19.386
   52   2HG   GLU   7          HG1       GLU   7 -16.608   1.733 -20.248
   53    H    GLN   8           HN       GLN   8 -13.133   3.314 -17.975
   54    HA   GLN   8           HA       GLN   8 -11.292   4.483 -19.909
   55   1HB   GLN   8          HB2       GLN   8 -13.737   5.493 -20.232
   56   2HB   GLN   8          HB1       GLN   8 -13.257   6.479 -18.850
   57   1HG   GLN   8          HG2       GLN   8 -11.018   6.696 -20.354
   58   2HG   GLN   8          HG1       GLN   8 -12.213   6.484 -21.633
   59   1HE2  GLN   8          HE21      GLN   8 -11.501   8.511 -18.748
   60   2HE2  GLN   8          HE22      GLN   8 -12.364   9.864 -19.299
   61    H    GLN   9           HN       GLN   9 -11.292   3.313 -17.148
   62    HA   GLN   9           HA       GLN   9  -9.969   5.609 -15.761
   63   1HB   GLN   9          HB2       GLN   9 -12.335   4.394 -14.926
   64   2HB   GLN   9          HB1       GLN   9 -11.096   3.630 -13.932
   65   1HG   GLN   9          HG2       GLN   9 -10.238   5.864 -13.295
   66   2HG   GLN   9          HG1       GLN   9 -11.504   6.617 -14.267
   67   1HE2  GLN   9          HE21      GLN   9 -13.688   6.600 -13.429
   68   2HE2  GLN   9          HE22      GLN   9 -14.048   6.078 -11.854
   69    H    ILE  10           HN       ILE  10  -8.453   4.792 -14.002
   70    HA   ILE  10           HA       ILE  10  -6.956   2.438 -15.037
   71    HB   ILE  10           HB       ILE  10  -5.012   3.307 -14.065
   72   1HG1  ILE  10          HG12      ILE  10  -6.021   3.613 -11.778
   73   2HG1  ILE  10          HG11      ILE  10  -4.917   4.901 -12.245
   74   1HG2  ILE  10          HG21      ILE  10  -4.898   5.657 -14.718
   75   2HG2  ILE  10          HG22      ILE  10  -6.658   5.771 -14.701
   76   3HG2  ILE  10          HG23      ILE  10  -5.852   4.750 -15.892
   77   1HD1  ILE  10          HD11      ILE  10  -7.930   4.971 -12.114
   78   2HD1  ILE  10          HD12      ILE  10  -7.032   6.143 -13.078
   79   3HD1  ILE  10          HD13      ILE  10  -6.770   6.048 -11.337
   80    H    ARG  11           HN       ARG  11  -6.185   0.804 -13.522
   81    HA   ARG  11           HA       ARG  11  -6.935   0.680 -10.801
   82   1HB   ARG  11          HB2       ARG  11  -8.760  -1.099 -11.026
   83   2HB   ARG  11          HB1       ARG  11  -9.227   0.561 -11.383
   84   1HG   ARG  11          HG2       ARG  11  -9.469   0.163 -13.629
   85   2HG   ARG  11          HG1       ARG  11  -8.160  -1.015 -13.666
   86   1HD   ARG  11          HD2       ARG  11  -9.529  -2.768 -13.004
   87   2HD   ARG  11          HD1       ARG  11 -10.661  -1.705 -12.171
   88    HE   ARG  11           HE       ARG  11 -11.517  -1.032 -14.418
   89   1HH1  ARG  11          HH21      ARG  11  -9.040  -2.285 -15.812
   90   2HH1  ARG  11          HH22      ARG  11  -9.773  -3.665 -16.559
   91   1HH2  ARG  11          HH11      ARG  11 -12.681  -3.477 -14.664
   92   2HH2  ARG  11          HH12      ARG  11 -11.839  -4.341 -15.906
   93    H    VAL  12           HN       VAL  12  -6.277  -1.038 -13.624
   94    HA   VAL  12           HA       VAL  12  -5.313  -3.432 -12.265
   95    HB   VAL  12           HB       VAL  12  -4.419  -3.696 -14.850
   96   1HG1  VAL  12          HG11      VAL  12  -7.147  -4.457 -13.812
   97   2HG1  VAL  12          HG12      VAL  12  -5.656  -5.316 -13.423
   98   3HG1  VAL  12          HG13      VAL  12  -6.231  -5.257 -15.089
   99   1HG2  VAL  12          HG21      VAL  12  -5.617  -1.589 -15.464
  100   2HG2  VAL  12          HG22      VAL  12  -7.126  -2.320 -14.920
  101   3HG2  VAL  12          HG23      VAL  12  -6.262  -3.003 -16.297
  102    H    ARG  13           HN       ARG  13  -3.626  -2.019 -14.809
  103    HA   ARG  13           HA       ARG  13  -1.035  -2.451 -13.635
  104   1HB   ARG  13          HB2       ARG  13  -1.574  -2.337 -16.126
  105   2HB   ARG  13          HB1       ARG  13  -1.621  -0.584 -15.943
  106   1HG   ARG  13          HG2       ARG  13   0.733  -1.080 -14.721
  107   2HG   ARG  13          HG1       ARG  13   0.706  -2.440 -15.844
  108   1HD   ARG  13          HD2       ARG  13  -0.102   0.116 -17.061
  109   2HD   ARG  13          HD1       ARG  13   1.561   0.104 -16.472
  110    HE   ARG  13           HE       ARG  13   2.092  -1.348 -18.243
  111   1HH1  ARG  13          HH11      ARG  13  -0.608  -0.355 -19.431
  112   2HH1  ARG  13          HH12      ARG  13  -1.301  -1.867 -19.913
  113   1HH2  ARG  13          HH21      ARG  13   0.915  -3.784 -18.045
  114   2HH2  ARG  13          HH22      ARG  13  -0.438  -3.813 -19.127
  115    H    ILE  14           HN       ILE  14   0.253  -1.108 -12.467
  116    HA   ILE  14           HA       ILE  14  -0.880   1.354 -11.372
  117    HB   ILE  14           HB       ILE  14   1.292   1.467 -10.119
  118   1HG1  ILE  14          HG12      ILE  14   1.929  -1.198 -11.405
  119   2HG1  ILE  14          HG11      ILE  14   2.566   0.316 -12.044
  120   1HG2  ILE  14          HG21      ILE  14   0.888  -0.546  -8.778
  121   2HG2  ILE  14          HG22      ILE  14  -0.043  -1.258 -10.096
  122   3HG2  ILE  14          HG23      ILE  14  -0.647   0.175  -9.261
  123   1HD1  ILE  14          HD11      ILE  14   3.435   0.796  -9.696
  124   2HD1  ILE  14          HD12      ILE  14   4.231  -0.528 -10.545
  125   3HD1  ILE  14          HD13      ILE  14   3.031  -0.875  -9.302
  126    HA   PRO  15           HA       PRO  15   1.011   4.262 -14.068
  127   1HB   PRO  15          HB2       PRO  15   1.576   6.313 -12.322
  128   2HB   PRO  15          HB1       PRO  15  -0.055   5.926 -12.896
  129   1HG   PRO  15          HG2       PRO  15   1.175   5.387 -10.232
  130   2HG   PRO  15          HG1       PRO  15  -0.528   5.628 -10.653
  131   1HD   PRO  15          HD2       PRO  15   0.704   3.140 -10.150
  132   2HD   PRO  15          HD1       PRO  15  -0.878   3.376 -10.922
  133    H    ARG  16           HN       ARG  16   2.887   4.076 -10.992
  134    HA   ARG  16           HA       ARG  16   5.381   4.765 -12.363
  135   1HB   ARG  16          HB2       ARG  16   4.520   4.261  -9.571
  136   2HB   ARG  16          HB1       ARG  16   6.189   3.823  -9.939
  137   1HG   ARG  16          HG2       ARG  16   6.260   6.175 -11.107
  138   2HG   ARG  16          HG1       ARG  16   4.869   6.520 -10.079
  139   1HD   ARG  16          HD2       ARG  16   6.109   6.480  -8.151
  140   2HD   ARG  16          HD1       ARG  16   7.200   5.232  -8.754
  141    HE   ARG  16           HE       ARG  16   7.965   7.314 -10.291
  142   1HH1  ARG  16          HH11      ARG  16   6.695   9.284  -8.472
  143   2HH1  ARG  16          HH12      ARG  16   7.957   9.625  -7.337
  144   1HH2  ARG  16          HH21      ARG  16   9.825   6.814  -8.166
  145   2HH2  ARG  16          HH22      ARG  16   9.734   8.223  -7.163
  146    H    LYS  17           HN       LYS  17   7.250   3.310 -12.465
  147    HA   LYS  17           HA       LYS  17   6.552   0.406 -12.394
  148   1HB   LYS  17          HB2       LYS  17   7.995   1.888 -14.618
  149   2HB   LYS  17          HB1       LYS  17   7.890   0.131 -14.502
  150   1HG   LYS  17          HG2       LYS  17   5.984   0.347 -15.713
  151   2HG   LYS  17          HG1       LYS  17   5.255   0.892 -14.204
  152   1HD   LYS  17          HD2       LYS  17   4.826   2.858 -15.218
  153   2HD   LYS  17          HD1       LYS  17   6.564   3.155 -15.230
  154   1HE   LYS  17          HE2       LYS  17   6.714   1.921 -17.399
  155   2HE   LYS  17          HE1       LYS  17   4.957   1.772 -17.399
  156   1HZ   LYS  17          HZ1       LYS  17   6.503   4.309 -17.399
  157   2HZ   LYS  17          HZ2       LYS  17   4.809   4.199 -17.318
  158   3HZ   LYS  17          HZ3       LYS  17   5.634   3.665 -18.704
  159    H    GLU  18           HN       GLU  18   7.807   1.345 -10.253
  160    HA   GLU  18           HA       GLU  18  10.559   0.288 -10.539
  161   1HB   GLU  18          HB2       GLU  18  11.493   2.223  -9.248
  162   2HB   GLU  18          HB1       GLU  18  10.908   2.671 -10.850
  163   1HG   GLU  18          HG2       GLU  18   8.703   2.883  -9.055
  164   2HG   GLU  18          HG1       GLU  18  10.075   3.696  -8.303
  165    H    GLU  19           HN       GLU  19  11.603   0.290  -8.200
  166    HA   GLU  19           HA       GLU  19   9.732  -1.163  -6.477
  167   1HB   GLU  19          HB2       GLU  19  12.676  -0.669  -6.532
  168   2HB   GLU  19          HB1       GLU  19  11.946  -1.098  -4.984
  169   1HG   GLU  19          HG2       GLU  19  10.888  -3.081  -6.078
  170   2HG   GLU  19          HG1       GLU  19  11.748  -2.679  -7.565
  171    H    ASN  20           HN       ASN  20  10.529   2.122  -6.793
  172    HA   ASN  20           HA       ASN  20  10.720   3.082  -4.147
  173   1HB   ASN  20          HB2       ASN  20   9.434   4.261  -6.619
  174   2HB   ASN  20          HB1       ASN  20   9.507   5.142  -5.093
  175   1HD2  ASN  20          HD21      ASN  20  11.714   5.618  -4.214
  176   2HD2  ASN  20          HD22      ASN  20  13.040   5.683  -5.271
  177    H    GLU  21           HN       GLU  21   7.838   2.130  -6.000
  178    HA   GLU  21           HA       GLU  21   5.929   3.011  -4.019
  179   1HB   GLU  21          HB2       GLU  21   5.879   1.685  -6.594
  180   2HB   GLU  21          HB1       GLU  21   4.786   0.877  -5.469
  181   1HG   GLU  21          HG2       GLU  21   4.750   3.862  -5.508
  182   2HG   GLU  21          HG1       GLU  21   4.023   3.024  -6.880
  183    H    ILE  22           HN       ILE  22   5.585   2.105  -2.059
  184    HA   ILE  22           HA       ILE  22   6.364  -0.757  -1.651
  185    HB   ILE  22           HB       ILE  22   6.730   1.710  -0.100
  186   1HG1  ILE  22          HG12      ILE  22   8.521   0.348   0.905
  187   2HG1  ILE  22          HG11      ILE  22   7.892  -1.085   0.099
  188   1HG2  ILE  22          HG21      ILE  22   6.342   0.758   2.095
  189   2HG2  ILE  22          HG22      ILE  22   5.818  -0.766   1.381
  190   3HG2  ILE  22          HG23      ILE  22   4.841   0.687   1.173
  191   1HD1  ILE  22          HD11      ILE  22   8.810   1.415  -1.351
  192   2HD1  ILE  22          HD12      ILE  22   8.342  -0.119  -2.084
  193   3HD1  ILE  22          HD13      ILE  22   9.812  -0.017  -1.118
  194    H    LEU  23           HN       LEU  23   4.852  -1.985  -0.084
  195    HA   LEU  23           HA       LEU  23   2.087  -0.762  -0.232
  196   1HB   LEU  23          HB2       LEU  23   1.064  -2.832  -0.881
  197   2HB   LEU  23          HB1       LEU  23   2.361  -2.500  -2.009
  198    HG   LEU  23           HG       LEU  23   2.493  -4.816  -1.561
  199   1HD1  LEU  23          HD11      LEU  23   4.655  -3.426  -1.260
  200   2HD1  LEU  23          HD12      LEU  23   4.652  -5.115  -0.765
  201   3HD1  LEU  23          HD13      LEU  23   4.497  -3.845   0.445
  202   1HD2  LEU  23          HD21      LEU  23   1.353  -4.116   0.939
  203   2HD2  LEU  23          HD22      LEU  23   2.850  -4.985   1.277
  204   3HD2  LEU  23          HD23      LEU  23   1.606  -5.729   0.275
  205    H    GLY  24           HN       GLY  24   1.098  -0.652   1.798
  206   1HA   GLY  24          HA2       GLY  24   2.002  -2.703   3.768
  207   2HA   GLY  24          HA1       GLY  24   2.181  -1.004   4.176
  208    H    ILE  25           HN       ILE  25   0.758  -2.777   5.735
  209    HA   ILE  25           HA       ILE  25  -2.111  -2.125   5.261
  210    HB   ILE  25           HB       ILE  25  -2.455  -3.657   7.277
  211   1HG1  ILE  25          HG12      ILE  25   0.352  -4.624   6.744
  212   2HG1  ILE  25          HG11      ILE  25   0.061  -3.355   7.933
  213   1HG2  ILE  25          HG21      ILE  25  -1.194  -4.636   4.715
  214   2HG2  ILE  25          HG22      ILE  25  -2.904  -4.585   5.142
  215   3HG2  ILE  25          HG23      ILE  25  -1.835  -5.749   5.924
  216   1HD1  ILE  25          HD11      ILE  25   0.064  -5.810   8.764
  217   2HD1  ILE  25          HD12      ILE  25  -1.520  -5.922   7.995
  218   3HD1  ILE  25          HD13      ILE  25  -1.251  -4.762   9.296
  219    H    ILE  26           HN       ILE  26  -3.043  -0.536   6.482
  220    HA   ILE  26           HA       ILE  26  -1.304   0.834   8.453
  221    HB   ILE  26           HB       ILE  26  -2.697   1.830   6.368
  222   1HG1  ILE  26          HG12      ILE  26  -2.665   3.833   8.409
  223   2HG1  ILE  26          HG11      ILE  26  -1.250   2.798   8.600
  224   1HG2  ILE  26          HG21      ILE  26  -4.434   2.460   8.759
  225   2HG2  ILE  26          HG22      ILE  26  -4.867   1.260   7.540
  226   3HG2  ILE  26          HG23      ILE  26  -4.690   2.954   7.086
  227   1HD1  ILE  26          HD11      ILE  26  -0.892   4.731   7.018
  228   2HD1  ILE  26          HD12      ILE  26  -2.099   4.006   5.957
  229   3HD1  ILE  26          HD13      ILE  26  -0.598   3.149   6.300
  230    H    GLU  27           HN       GLU  27  -2.163   1.634  10.408
  231    HA   GLU  27           HA       GLU  27  -4.629   0.345  11.456
  232   1HB   GLU  27          HB2       GLU  27  -1.839   0.078  12.581
  233   2HB   GLU  27          HB1       GLU  27  -3.261  -0.098  13.608
  234   1HG   GLU  27          HG2       GLU  27  -3.365  -2.250  12.941
  235   2HG   GLU  27          HG1       GLU  27  -3.828  -1.656  11.347
  236    H    GLN  28           HN       GLN  28  -5.833   1.846  12.487
  237    HA   GLN  28           HA       GLN  28  -4.487   4.172  13.796
  238   1HB   GLN  28          HB2       GLN  28  -5.772   4.518  11.468
  239   2HB   GLN  28          HB1       GLN  28  -7.174   4.549  12.532
  240   1HG   GLN  28          HG2       GLN  28  -4.816   6.429  12.477
  241   2HG   GLN  28          HG1       GLN  28  -6.532   6.812  12.413
  242   1HE2  GLN  28          HE21      GLN  28  -3.826   6.274  14.543
  243   2HE2  GLN  28          HE22      GLN  28  -4.670   6.486  15.998
  244    H    MET  29           HN       MET  29  -4.859   3.640  15.937
  245    HA   MET  29           HA       MET  29  -7.701   3.323  16.761
  246   1HB   MET  29          HB2       MET  29  -5.997   1.148  16.651
  247   2HB   MET  29          HB1       MET  29  -5.844   1.664  18.330
  248   1HG   MET  29          HG2       MET  29  -7.680   0.127  18.272
  249   2HG   MET  29          HG1       MET  29  -8.392   1.735  18.411
  250   1HE   MET  29          HE1       MET  29  -9.557   3.038  16.491
  251   2HE   MET  29          HE2       MET  29 -10.504   1.895  17.439
  252   3HE   MET  29          HE3       MET  29 -10.750   2.000  15.698
  253    H    LEU  30           HN       LEU  30  -6.374   5.687  16.940
  254    HA   LEU  30           HA       LEU  30  -5.995   5.994  19.875
  255   1HB   LEU  30          HB2       LEU  30  -4.131   7.095  17.746
  256   2HB   LEU  30          HB1       LEU  30  -4.074   7.537  19.451
  257    HG   LEU  30           HG       LEU  30  -3.914   4.650  18.582
  258   1HD1  LEU  30          HD11      LEU  30  -1.432   4.893  18.761
  259   2HD1  LEU  30          HD12      LEU  30  -1.644   6.640  18.873
  260   3HD1  LEU  30          HD13      LEU  30  -2.111   5.787  17.401
  261   1HD2  LEU  30          HD21      LEU  30  -2.761   4.442  20.764
  262   2HD2  LEU  30          HD22      LEU  30  -4.369   5.140  20.956
  263   3HD2  LEU  30          HD23      LEU  30  -2.944   6.177  21.020
  264    H    GLY  31           HN       GLY  31  -6.092   7.851  16.798
  265   1HA   GLY  31          HA2       GLY  31  -7.898   9.399  16.275
  266   2HA   GLY  31          HA1       GLY  31  -8.196   9.585  18.004
  267    H    ALA  32           HN       ALA  32  -5.689  10.216  15.530
  268    HA   ALA  32           HA       ALA  32  -5.119  12.795  16.905
  269   1HB   ALA  32          HB1       ALA  32  -3.345  11.464  17.745
  270   2HB   ALA  32          HB2       ALA  32  -2.637  12.331  16.384
  271   3HB   ALA  32          HB3       ALA  32  -3.117  10.644  16.201
  272    H    SER  33           HN       SER  33  -3.489  11.147  14.180
  273    HA   SER  33           HA       SER  33  -4.839  12.559  12.083
  274   1HB   SER  33          HB2       SER  33  -2.858  14.090  13.516
  275   2HB   SER  33          HB1       SER  33  -2.308  13.820  11.865
  276    HG   SER  33           HG       SER  33  -3.893  15.652  12.507
  277    H    ARG  34           HN       ARG  34  -1.665  11.287  13.115
  278    HA   ARG  34           HA       ARG  34  -1.249  10.152  10.390
  279   1HB   ARG  34          HB2       ARG  34   1.056   9.709  11.164
  280   2HB   ARG  34          HB1       ARG  34   0.631  11.405  11.378
  281   1HG   ARG  34          HG2       ARG  34  -0.118   9.897  13.730
  282   2HG   ARG  34          HG1       ARG  34   1.584   9.626  13.354
  283   1HD   ARG  34          HD2       ARG  34   2.112  11.916  13.519
  284   2HD   ARG  34          HD1       ARG  34   0.431  12.412  13.329
  285    HE   ARG  34           HE       ARG  34   0.448  10.937  15.689
  286   1HH1  ARG  34          HH21      ARG  34   3.280  11.949  15.948
  287   2HH1  ARG  34          HH22      ARG  34   3.048  13.436  16.806
  288   1HH2  ARG  34          HH11      ARG  34  -0.358  13.597  16.138
  289   2HH2  ARG  34          HH12      ARG  34   0.983  14.371  16.914
  290    H    VAL  35           HN       VAL  35  -0.518   7.889  10.250
  291    HA   VAL  35           HA       VAL  35  -1.637   6.143  12.412
  292    HB   VAL  35           HB       VAL  35  -2.102   4.480  10.561
  293   1HG1  VAL  35          HG11      VAL  35  -4.029   5.397  11.385
  294   2HG1  VAL  35          HG12      VAL  35  -4.110   5.956   9.715
  295   3HG1  VAL  35          HG13      VAL  35  -3.553   7.047  10.986
  296   1HG2  VAL  35          HG21      VAL  35  -1.522   6.947   8.932
  297   2HG2  VAL  35          HG22      VAL  35  -2.428   5.570   8.309
  298   3HG2  VAL  35          HG23      VAL  35  -0.750   5.367   8.815
  299    H    ARG  36           HN       ARG  36  -0.804   3.906  12.232
  300    HA   ARG  36           HA       ARG  36   2.142   3.956  11.606
  301   1HB   ARG  36          HB2       ARG  36   2.043   1.801  13.154
  302   2HB   ARG  36          HB1       ARG  36   2.119   3.409  13.866
  303   1HG   ARG  36          HG2       ARG  36  -0.168   3.404  14.429
  304   2HG   ARG  36          HG1       ARG  36  -0.542   2.124  13.274
  305   1HD   ARG  36          HD2       ARG  36   0.876   0.567  14.668
  306   2HD   ARG  36          HD1       ARG  36   0.986   1.848  15.875
  307    HE   ARG  36           HE       ARG  36  -1.645   0.696  15.029
  308   1HH1  ARG  36          HH21      ARG  36  -1.619   3.079  16.854
  309   2HH1  ARG  36          HH22      ARG  36  -1.709   2.339  18.418
  310   1HH2  ARG  36          HH11      ARG  36  -0.803  -0.814  17.275
  311   2HH2  ARG  36          HH12      ARG  36  -1.246   0.132  18.657
  312    H    VAL  37           HN       VAL  37   2.875   2.514  10.005
  313    HA   VAL  37           HA       VAL  37   1.045   0.286   9.310
  314    HB   VAL  37           HB       VAL  37   0.342   1.301   7.434
  315   1HG1  VAL  37          HG11      VAL  37   0.630   3.468   8.440
  316   2HG1  VAL  37          HG12      VAL  37   1.225   3.576   6.784
  317   3HG1  VAL  37          HG13      VAL  37   2.364   3.446   8.123
  318   1HG2  VAL  37          HG21      VAL  37   2.244   0.109   6.396
  319   2HG2  VAL  37          HG22      VAL  37   3.270   1.516   6.678
  320   3HG2  VAL  37          HG23      VAL  37   1.903   1.629   5.570
  321    H    ARG  38           HN       ARG  38   1.994  -1.473   8.417
  322    HA   ARG  38           HA       ARG  38   5.007  -1.515   8.315
  323   1HB   ARG  38          HB2       ARG  38   4.535  -4.110   8.498
  324   2HB   ARG  38          HB1       ARG  38   4.498  -3.124   9.958
  325   1HG   ARG  38          HG2       ARG  38   2.031  -2.931   9.750
  326   2HG   ARG  38          HG1       ARG  38   2.083  -3.959   8.317
  327   1HD   ARG  38          HD2       ARG  38   1.608  -5.518   9.986
  328   2HD   ARG  38          HD1       ARG  38   3.367  -5.618   9.908
  329    HE   ARG  38           HE       ARG  38   1.804  -4.307  12.066
  330   1HH1  ARG  38          HH21      ARG  38   3.798  -6.537  12.515
  331   2HH1  ARG  38          HH22      ARG  38   5.173  -5.665  13.107
  332   1HH2  ARG  38          HH11      ARG  38   4.016  -2.576  12.012
  333   2HH2  ARG  38          HH12      ARG  38   5.296  -3.415  12.822
  334    H    CYS  39           HN       CYS  39   5.895  -2.324   6.292
  335    HA   CYS  39           HA       CYS  39   3.816  -3.108   4.295
  336   1HB   CYS  39          HB2       CYS  39   6.050  -1.282   3.495
  337   2HB   CYS  39          HB1       CYS  39   4.452  -1.465   2.784
  338    HG   CYS  39           HG       CYS  39   4.089   0.641   4.111
  339    H    LEU  40           HN       LEU  40   4.561  -4.145   2.450
  340    HA   LEU  40           HA       LEU  40   6.996  -5.741   2.791
  341   1HB   LEU  40          HB2       LEU  40   4.457  -6.377   1.920
  342   2HB   LEU  40          HB1       LEU  40   5.333  -6.195   0.411
  343    HG   LEU  40           HG       LEU  40   6.877  -7.901   0.978
  344   1HD1  LEU  40          HD11      LEU  40   5.977  -7.318   3.773
  345   2HD1  LEU  40          HD12      LEU  40   7.606  -7.594   3.155
  346   3HD1  LEU  40          HD13      LEU  40   6.515  -8.957   3.407
  347   1HD2  LEU  40          HD21      LEU  40   4.729  -8.822   0.363
  348   2HD2  LEU  40          HD22      LEU  40   4.120  -8.615   2.006
  349   3HD2  LEU  40          HD23      LEU  40   5.381  -9.802   1.675
  350    H    ASP  41           HN       ASP  41   7.974  -6.133   0.502
  351    HA   ASP  41           HA       ASP  41   9.195  -5.252  -1.303
  352   1HB   ASP  41          HB2       ASP  41   7.005  -3.730  -1.600
  353   2HB   ASP  41          HB1       ASP  41   8.052  -2.500  -0.891
  354    H    GLY  42           HN       GLY  42   9.439  -5.221   1.698
  355   1HA   GLY  42          HA2       GLY  42  11.114  -4.786   3.229
  356   2HA   GLY  42          HA1       GLY  42  12.048  -4.092   1.917
  357    H    LYS  43           HN       LYS  43   9.006  -2.995   3.690
  358    HA   LYS  43           HA       LYS  43  10.626  -0.636   4.478
  359   1HB   LYS  43          HB2       LYS  43   8.751  -0.564   2.329
  360   2HB   LYS  43          HB1       LYS  43   8.159   0.454   3.630
  361   1HG   LYS  43          HG2       LYS  43   9.564   2.005   2.712
  362   2HG   LYS  43          HG1       LYS  43  10.791   1.142   3.634
  363   1HD   LYS  43          HD2       LYS  43  10.950  -0.381   1.511
  364   2HD   LYS  43          HD1       LYS  43  10.164   0.970   0.697
  365   1HE   LYS  43          HE2       LYS  43  12.259   1.801   0.453
  366   2HE   LYS  43          HE1       LYS  43  12.113   2.248   2.151
  367   1HZ   LYS  43          HZ1       LYS  43  13.234  -0.305   1.127
  368   2HZ   LYS  43          HZ2       LYS  43  13.095   0.130   2.764
  369   3HZ   LYS  43          HZ3       LYS  43  14.135   0.995   1.737
  370    H    THR  44           HN       THR  44   9.756   0.600   6.137
  371    HA   THR  44           HA       THR  44   7.282  -0.306   7.506
  372    HB   THR  44           HB       THR  44   9.599   0.297   9.286
  373    HG1  THR  44           HG1      THR  44  10.563  -1.194   7.943
  374   1HG2  THR  44          HG21      THR  44   8.458  -1.255  10.744
  375   2HG2  THR  44          HG22      THR  44   7.411  -1.780   9.425
  376   3HG2  THR  44          HG23      THR  44   7.267  -0.143  10.066
  377    H    ARG  45           HN       ARG  45   6.110   1.581   7.630
  378    HA   ARG  45           HA       ARG  45   7.585   4.063   8.321
  379   1HB   ARG  45          HB2       ARG  45   6.298   5.171   6.355
  380   2HB   ARG  45          HB1       ARG  45   7.754   4.243   6.006
  381   1HG   ARG  45          HG2       ARG  45   5.183   2.735   6.034
  382   2HG   ARG  45          HG1       ARG  45   5.437   3.839   4.687
  383   1HD   ARG  45          HD2       ARG  45   7.219   1.537   5.523
  384   2HD   ARG  45          HD1       ARG  45   6.308   1.691   4.024
  385    HE   ARG  45           HE       ARG  45   8.925   2.719   4.433
  386   1HH1  ARG  45          HH21      ARG  45   7.611   2.510   1.743
  387   2HH1  ARG  45          HH22      ARG  45   7.443   4.173   1.290
  388   1HH2  ARG  45          HH11      ARG  45   7.977   5.372   4.507
  389   2HH2  ARG  45          HH12      ARG  45   7.626   5.797   2.871
  390    H    LEU  46           HN       LEU  46   6.209   5.918   8.663
  391    HA   LEU  46           HA       LEU  46   3.570   5.152   9.857
  392   1HB   LEU  46          HB2       LEU  46   5.369   7.573  10.174
  393   2HB   LEU  46          HB1       LEU  46   3.699   7.590  10.721
  394    HG   LEU  46           HG       LEU  46   5.253   7.024  12.560
  395   1HD1  LEU  46          HD11      LEU  46   3.741   4.521  11.830
  396   2HD1  LEU  46          HD12      LEU  46   2.900   6.003  12.285
  397   3HD1  LEU  46          HD13      LEU  46   3.995   5.223  13.427
  398   1HD2  LEU  46          HD21      LEU  46   6.858   5.834  10.880
  399   2HD2  LEU  46          HD22      LEU  46   5.844   4.419  11.165
  400   3HD2  LEU  46          HD23      LEU  46   6.702   5.174  12.507
  401    H    GLY  47           HN       GLY  47   1.741   5.773   8.673
  402   1HA   GLY  47          HA2       GLY  47   2.245   7.186   6.125
  403   2HA   GLY  47          HA1       GLY  47   0.795   6.281   6.534
  404    H    ARG  48           HN       ARG  48   1.113   8.976   5.418
  405    HA   ARG  48           HA       ARG  48  -0.386  10.494   7.494
  406   1HB   ARG  48          HB2       ARG  48   0.599  12.576   6.515
  407   2HB   ARG  48          HB1       ARG  48   1.795  11.528   7.271
  408   1HG   ARG  48          HG2       ARG  48   2.872  11.169   5.313
  409   2HG   ARG  48          HG1       ARG  48   1.365  10.894   4.440
  410   1HD   ARG  48          HD2       ARG  48   2.265  13.657   5.272
  411   2HD   ARG  48          HD1       ARG  48   2.722  12.944   3.727
  412    HE   ARG  48           HE       ARG  48   0.016  12.653   3.665
  413   1HH1  ARG  48          HH11      ARG  48  -0.199  14.840   5.711
  414   2HH1  ARG  48          HH12      ARG  48  -0.315  16.256   4.720
  415   1HH2  ARG  48          HH21      ARG  48   0.857  14.670   1.859
  416   2HH2  ARG  48          HH22      ARG  48   0.284  16.159   2.532
  417    H    ILE  49           HN       ILE  49  -2.183  11.629   6.788
  418    HA   ILE  49           HA       ILE  49  -3.108  10.967   4.034
  419    HB   ILE  49           HB       ILE  49  -4.355  10.951   6.610
  420   1HG1  ILE  49          HG12      ILE  49  -6.352  10.240   5.069
  421   2HG1  ILE  49          HG11      ILE  49  -5.153  10.330   3.779
  422   1HG2  ILE  49          HG21      ILE  49  -6.345  12.305   6.235
  423   2HG2  ILE  49          HG22      ILE  49  -5.721  12.849   4.680
  424   3HG2  ILE  49          HG23      ILE  49  -4.917  13.336   6.173
  425   1HD1  ILE  49          HD11      ILE  49  -4.181   8.921   6.163
  426   2HD1  ILE  49          HD12      ILE  49  -4.111   8.445   4.467
  427   3HD1  ILE  49          HD13      ILE  49  -5.571   8.141   5.408
  428    HA   PRO  50           HA       PRO  50  -2.793  15.188   2.809
  429   1HB   PRO  50          HB2       PRO  50  -4.842  15.320   0.977
  430   2HB   PRO  50          HB1       PRO  50  -3.295  14.512   0.671
  431   1HG   PRO  50          HG2       PRO  50  -5.962  13.306   1.247
  432   2HG   PRO  50          HG1       PRO  50  -4.599  12.633   0.338
  433   1HD   PRO  50          HD2       PRO  50  -5.301  11.971   2.993
  434   2HD   PRO  50          HD1       PRO  50  -3.761  11.584   2.198
  435    H    GLY  51           HN       GLY  51  -6.256  14.278   3.291
  436   1HA   GLY  51          HA2       GLY  51  -6.813  16.016   5.414
  437   2HA   GLY  51          HA1       GLY  51  -7.064  16.976   3.957
  438    H    ARG  52           HN       ARG  52  -8.409  15.661   2.213
  439    HA   ARG  52           HA       ARG  52 -11.021  15.222   3.288
  440   1HB   ARG  52          HB2       ARG  52  -9.744  15.118   0.662
  441   2HB   ARG  52          HB1       ARG  52 -10.980  13.874   0.844
  442   1HG   ARG  52          HG2       ARG  52 -11.514  16.728   1.663
  443   2HG   ARG  52          HG1       ARG  52 -11.735  16.202  -0.006
  444   1HD   ARG  52          HD2       ARG  52 -13.775  15.446   0.576
  445   2HD   ARG  52          HD1       ARG  52 -12.977  14.223   1.566
  446    HE   ARG  52           HE       ARG  52 -13.284  15.655   3.504
  447   1HH1  ARG  52          HH21      ARG  52 -13.106  18.347   2.289
  448   2HH1  ARG  52          HH22      ARG  52 -14.755  18.879   2.282
  449   1HH2  ARG  52          HH11      ARG  52 -16.062  15.693   2.750
  450   2HH2  ARG  52          HH12      ARG  52 -16.431  17.373   2.543
  451    H    LEU  53           HN       LEU  53  -8.397  12.980   2.477
  452    HA   LEU  53           HA       LEU  53  -9.896  10.552   2.768
  453   1HB   LEU  53          HB2       LEU  53  -7.022  11.311   2.687
  454   2HB   LEU  53          HB1       LEU  53  -7.402   9.769   3.454
  455    HG   LEU  53           HG       LEU  53  -8.871   9.332   1.356
  456   1HD1  LEU  53          HD11      LEU  53  -8.015  10.498  -0.675
  457   2HD1  LEU  53          HD12      LEU  53  -7.042  11.540   0.363
  458   3HD1  LEU  53          HD13      LEU  53  -8.802  11.605   0.451
  459   1HD2  LEU  53          HD21      LEU  53  -6.601   8.302   1.987
  460   2HD2  LEU  53          HD22      LEU  53  -5.889   9.464   0.869
  461   3HD2  LEU  53          HD23      LEU  53  -7.035   8.262   0.278
  462    H    LYS  54           HN       LYS  54  -8.214  12.621   5.113
  463    HA   LYS  54           HA       LYS  54  -8.186  10.881   7.348
  464   1HB   LYS  54          HB2       LYS  54  -7.609  13.583   6.885
  465   2HB   LYS  54          HB1       LYS  54  -8.879  13.604   8.108
  466   1HG   LYS  54          HG2       LYS  54  -6.701  11.610   8.486
  467   2HG   LYS  54          HG1       LYS  54  -6.274  13.303   8.735
  468   1HD   LYS  54          HD2       LYS  54  -7.161  13.120  10.800
  469   2HD   LYS  54          HD1       LYS  54  -8.741  13.013  10.025
  470   1HE   LYS  54          HE2       LYS  54  -8.813  11.011  11.143
  471   2HE   LYS  54          HE1       LYS  54  -7.937  10.456   9.717
  472   1HZ   LYS  54          HZ1       LYS  54  -5.856  10.867  10.886
  473   2HZ   LYS  54          HZ2       LYS  54  -6.827   9.764  11.739
  474   3HZ   LYS  54          HZ3       LYS  54  -6.708  11.377  12.261
  475    H    ASN  55           HN       ASN  55 -10.847  12.774   5.984
  476    HA   ASN  55           HA       ASN  55 -12.631  12.194   8.246
  477   1HB   ASN  55          HB2       ASN  55 -13.090  13.496   5.547
  478   2HB   ASN  55          HB1       ASN  55 -14.351  13.298   6.764
  479   1HD2  ASN  55          HD21      ASN  55 -14.319  14.713   8.603
  480   2HD2  ASN  55          HD22      ASN  55 -13.194  15.971   8.775
  481    H    ARG  56           HN       ARG  56 -11.955  10.844   5.060
  482    HA   ARG  56           HA       ARG  56 -14.366   9.157   5.089
  483   1HB   ARG  56          HB2       ARG  56 -12.446  10.025   3.128
  484   2HB   ARG  56          HB1       ARG  56 -12.547   8.265   3.103
  485   1HG   ARG  56          HG2       ARG  56 -14.373   8.606   1.792
  486   2HG   ARG  56          HG1       ARG  56 -15.191   8.947   3.315
  487   1HD   ARG  56          HD2       ARG  56 -15.687  10.819   1.943
  488   2HD   ARG  56          HD1       ARG  56 -14.391  11.376   2.999
  489    HE   ARG  56           HE       ARG  56 -12.922  11.414   1.119
  490   1HH1  ARG  56          HH11      ARG  56 -15.125  12.486  -0.468
  491   2HH1  ARG  56          HH12      ARG  56 -15.263  11.370  -1.785
  492   1HH2  ARG  56          HH21      ARG  56 -13.451   8.863  -0.200
  493   2HH2  ARG  56          HH22      ARG  56 -14.313   9.314  -1.633
  494    H    ILE  57           HN       ILE  57 -10.885   8.767   5.695
  495    HA   ILE  57           HA       ILE  57 -10.697   5.957   5.691
  496    HB   ILE  57           HB       ILE  57  -8.843   6.238   7.354
  497   1HG1  ILE  57          HG12      ILE  57  -8.569   9.042   7.378
  498   2HG1  ILE  57          HG11      ILE  57 -10.251   8.735   7.811
  499   1HG2  ILE  57          HG21      ILE  57  -8.046   8.386   5.646
  500   2HG2  ILE  57          HG22      ILE  57  -9.062   7.291   4.708
  501   3HG2  ILE  57          HG23      ILE  57  -7.623   6.678   5.524
  502   1HD1  ILE  57          HD11      ILE  57  -9.170   8.610   9.886
  503   2HD1  ILE  57          HD12      ILE  57  -7.746   7.824   9.206
  504   3HD1  ILE  57          HD13      ILE  57  -9.246   6.917   9.400
  505    H    TRP  58           HN       TRP  58 -11.417   4.365   7.005
  506    HA   TRP  58           HA       TRP  58 -12.340   5.011   9.747
  507   1HB   TRP  58          HB2       TRP  58 -14.251   5.093   7.946
  508   2HB   TRP  58          HB1       TRP  58 -14.121   3.334   7.997
  509    HD1  TRP  58           HD1      TRP  58 -15.090   2.101  10.048
  510    HE1  TRP  58           HE1      TRP  58 -16.350   2.849  12.169
  511    HE3  TRP  58           HE3      TRP  58 -14.421   7.152   9.729
  512    HZ2  TRP  58           HZ2      TRP  58 -16.987   5.273  13.549
  513    HZ3  TRP  58           HZ3      TRP  58 -15.363   8.655  11.459
  514    HH2  TRP  58           HH2      TRP  58 -16.643   7.723  13.367
  515    H    VAL  59           HN       VAL  59 -10.080   3.773   9.575
  516    HA   VAL  59           HA       VAL  59 -10.228   0.901   9.138
  517    HB   VAL  59           HB       VAL  59  -7.946   0.838   9.957
  518   1HG1  VAL  59          HG11      VAL  59  -8.007   3.519   8.620
  519   2HG1  VAL  59          HG12      VAL  59  -8.648   2.130   7.744
  520   3HG1  VAL  59          HG13      VAL  59  -6.973   2.128   8.294
  521   1HG2  VAL  59          HG21      VAL  59  -6.955   3.025  10.857
  522   2HG2  VAL  59          HG22      VAL  59  -8.045   2.163  11.943
  523   3HG2  VAL  59          HG23      VAL  59  -8.617   3.577  11.058
  524    H    ARG  60           HN       ARG  60 -10.097  -0.743  10.809
  525    HA   ARG  60           HA       ARG  60 -10.772   0.160  13.562
  526   1HB   ARG  60          HB2       ARG  60 -12.795  -0.547  11.943
  527   2HB   ARG  60          HB1       ARG  60 -12.326  -2.152  12.505
  528   1HG   ARG  60          HG2       ARG  60 -14.000  -1.290  14.027
  529   2HG   ARG  60          HG1       ARG  60 -12.447  -1.285  14.866
  530   1HD   ARG  60          HD2       ARG  60 -12.243   1.036  14.755
  531   2HD   ARG  60          HD1       ARG  60 -13.305   1.165  13.354
  532    HE   ARG  60           HE       ARG  60 -14.967   0.229  15.370
  533   1HH1  ARG  60          HH21      ARG  60 -15.293   2.950  14.167
  534   2HH1  ARG  60          HH22      ARG  60 -15.078   3.986  15.538
  535   1HH2  ARG  60          HH11      ARG  60 -13.605   1.523  17.499
  536   2HH2  ARG  60          HH12      ARG  60 -14.120   3.176  17.431
  537    H    GLU  61           HN       GLU  61 -10.145  -2.753  11.537
  538    HA   GLU  61           HA       GLU  61  -8.428  -3.745  13.776
  539   1HB   GLU  61          HB2       GLU  61 -10.627  -5.125  12.291
  540   2HB   GLU  61          HB1       GLU  61  -9.233  -6.082  12.791
  541   1HG   GLU  61          HG2       GLU  61 -10.114  -6.204  14.858
  542   2HG   GLU  61          HG1       GLU  61  -9.901  -4.460  15.010
  543    H    GLY  62           HN       GLY  62  -7.944  -2.435  10.932
  544   1HA   GLY  62          HA2       GLY  62  -5.574  -2.955  10.115
  545   2HA   GLY  62          HA1       GLY  62  -6.152  -4.609   9.929
  546    H    ASP  63           HN       ASP  63  -6.237  -1.382   8.621
  547    HA   ASP  63           HA       ASP  63  -7.924  -2.287   6.319
  548   1HB   ASP  63          HB2       ASP  63  -7.672   0.184   7.714
  549   2HB   ASP  63          HB1       ASP  63  -7.050   0.449   6.086
  550    H    VAL  64           HN       VAL  64  -7.043  -1.738   4.061
  551    HA   VAL  64           HA       VAL  64  -4.068  -2.079   4.125
  552    HB   VAL  64           HB       VAL  64  -5.145  -2.485   1.484
  553   1HG1  VAL  64          HG11      VAL  64  -3.786  -4.240   3.548
  554   2HG1  VAL  64          HG12      VAL  64  -3.007  -3.335   2.252
  555   3HG1  VAL  64          HG13      VAL  64  -4.043  -4.709   1.870
  556   1HG2  VAL  64          HG21      VAL  64  -6.422  -4.581   2.037
  557   2HG2  VAL  64          HG22      VAL  64  -7.244  -3.105   2.541
  558   3HG2  VAL  64          HG23      VAL  64  -6.398  -4.095   3.732
  559    H    VAL  65           HN       VAL  65  -2.739  -0.706   3.025
  560    HA   VAL  65           HA       VAL  65  -3.990   1.504   1.468
  561    HB   VAL  65           HB       VAL  65  -2.755   3.205   2.724
  562   1HG1  VAL  65          HG11      VAL  65  -4.031   1.555   4.879
  563   2HG1  VAL  65          HG12      VAL  65  -5.024   2.118   3.537
  564   3HG1  VAL  65          HG13      VAL  65  -4.184   3.283   4.559
  565   1HG2  VAL  65          HG21      VAL  65  -1.944   1.111   4.734
  566   2HG2  VAL  65          HG22      VAL  65  -1.285   2.729   4.496
  567   3HG2  VAL  65          HG23      VAL  65  -0.915   1.450   3.343
  568    H    ILE  66           HN       ILE  66  -2.456   2.707   0.161
  569    HA   ILE  66           HA       ILE  66  -0.015   1.078  -0.496
  570    HB   ILE  66           HB       ILE  66  -1.749   1.738  -2.324
  571   1HG1  ILE  66          HG12      ILE  66   0.358   2.508  -3.803
  572   2HG1  ILE  66          HG11      ILE  66   1.222   1.944  -2.374
  573   1HG2  ILE  66          HG21      ILE  66  -0.216   4.293  -2.543
  574   2HG2  ILE  66          HG22      ILE  66  -1.534   4.234  -1.373
  575   3HG2  ILE  66          HG23      ILE  66  -1.854   3.917  -3.078
  576   1HD1  ILE  66          HD11      ILE  66   0.002  -0.214  -2.511
  577   2HD1  ILE  66          HD12      ILE  66   0.952   0.101  -3.964
  578   3HD1  ILE  66          HD13      ILE  66  -0.794   0.349  -3.980
  579    H    VAL  67           HN       VAL  67   2.076   2.201  -0.422
  580    HA   VAL  67           HA       VAL  67   1.857   4.915   0.809
  581    HB   VAL  67           HB       VAL  67   3.104   4.364   2.639
  582   1HG1  VAL  67          HG11      VAL  67   2.435   2.284   3.536
  583   2HG1  VAL  67          HG12      VAL  67   2.423   1.507   1.953
  584   3HG1  VAL  67          HG13      VAL  67   1.172   2.677   2.372
  585   1HG2  VAL  67          HG21      VAL  67   4.558   2.462   0.803
  586   2HG2  VAL  67          HG22      VAL  67   4.781   2.387   2.550
  587   3HG2  VAL  67          HG23      VAL  67   5.197   3.858   1.671
  588    H    LYS  68           HN       LYS  68   3.618   6.272   0.668
  589    HA   LYS  68           HA       LYS  68   5.464   5.848  -1.614
  590   1HB   LYS  68          HB2       LYS  68   4.548   8.439  -0.331
  591   2HB   LYS  68          HB1       LYS  68   5.628   8.311  -1.719
  592   1HG   LYS  68          HG2       LYS  68   2.882   7.060  -1.772
  593   2HG   LYS  68          HG1       LYS  68   3.116   8.759  -2.183
  594   1HD   LYS  68          HD2       LYS  68   3.600   8.052  -4.274
  595   2HD   LYS  68          HD1       LYS  68   5.123   7.463  -3.610
  596   1HE   LYS  68          HE2       LYS  68   4.174   5.575  -4.689
  597   2HE   LYS  68          HE1       LYS  68   3.825   5.330  -2.979
  598   1HZ   LYS  68          HZ1       LYS  68   1.962   6.512  -4.968
  599   2HZ   LYS  68          HZ2       LYS  68   1.627   6.256  -3.322
  600   3HZ   LYS  68          HZ3       LYS  68   1.876   4.932  -4.357
  601    HA   PRO  69           HA       PRO  69   8.613   5.848   1.490
  602   1HB   PRO  69          HB2       PRO  69  10.773   6.160  -0.126
  603   2HB   PRO  69          HB1       PRO  69   9.850   4.654  -0.025
  604   1HG   PRO  69          HG2       PRO  69   9.943   6.640  -2.230
  605   2HG   PRO  69          HG1       PRO  69   9.444   4.943  -2.277
  606   1HD   PRO  69          HD2       PRO  69   7.734   7.257  -2.203
  607   2HD   PRO  69          HD1       PRO  69   7.242   5.548  -2.154
  608    H    TRP  70           HN       TRP  70   9.560   7.287   2.810
  609    HA   TRP  70           HA       TRP  70  10.114  10.055   1.821
  610   1HB   TRP  70          HB2       TRP  70   9.184   9.134   4.535
  611   2HB   TRP  70          HB1       TRP  70   9.870  10.725   4.260
  612    HD1  TRP  70           HD1      TRP  70   7.649   8.773   1.950
  613    HE1  TRP  70           HE1      TRP  70   5.579  10.063   1.640
  614    HE3  TRP  70           HE3      TRP  70   8.486  12.598   5.186
  615    HZ2  TRP  70           HZ2      TRP  70   4.313  12.422   2.577
  616    HZ3  TRP  70           HZ3      TRP  70   6.791  14.396   5.458
  617    HH2  TRP  70           HH2      TRP  70   4.688  14.312   4.143
  618    H    GLU  71           HN       GLU  71  12.450  10.248   1.840
  619    HA   GLU  71           HA       GLU  71  14.699   9.835   2.427
  620   1HB   GLU  71          HB2       GLU  71  13.446  10.093   5.178
  621   2HB   GLU  71          HB1       GLU  71  15.152  10.320   4.799
  622   1HG   GLU  71          HG2       GLU  71  14.349  12.098   3.106
  623   2HG   GLU  71          HG1       GLU  71  12.809  12.027   3.964
  624    H    VAL  72           HN       VAL  72  15.649   8.543   4.900
  625    HA   VAL  72           HA       VAL  72  14.654   5.752   4.659
  626    HB   VAL  72           HB       VAL  72  17.568   6.556   4.326
  627   1HG1  VAL  72          HG11      VAL  72  17.523   4.512   5.568
  628   2HG1  VAL  72          HG12      VAL  72  17.810   4.051   3.890
  629   3HG1  VAL  72          HG13      VAL  72  16.203   3.867   4.592
  630   1HG2  VAL  72          HG21      VAL  72  15.504   5.392   2.434
  631   2HG2  VAL  72          HG22      VAL  72  17.237   5.360   2.103
  632   3HG2  VAL  72          HG23      VAL  72  16.398   6.903   2.254
  633    H    GLN  73           HN       GLN  73  17.610   7.066   6.186
  634    HA   GLN  73           HA       GLN  73  18.342   6.931   8.413
  635   1HB   GLN  73          HB2       GLN  73  15.461   7.716   8.954
  636   2HB   GLN  73          HB1       GLN  73  16.848   8.011  10.002
  637   1HG   GLN  73          HG2       GLN  73  17.536   9.809   8.795
  638   2HG   GLN  73          HG1       GLN  73  17.188   9.028   7.255
  639   1HE2  GLN  73          HE21      GLN  73  14.594   8.703   6.985
  640   2HE2  GLN  73          HE22      GLN  73  13.684  10.089   7.342
  641    H    GLY  74           HN       GLY  74  16.623   6.266  10.743
  642   1HA   GLY  74          HA2       GLY  74  16.705   3.323  10.453
  643   2HA   GLY  74          HA1       GLY  74  16.526   4.208  11.965
  644    H    ASP  75           HN       ASP  75  14.482   5.385   9.490
  645    HA   ASP  75           HA       ASP  75  12.260   3.572   9.711
  646   1HB   ASP  75          HB2       ASP  75  12.066   4.414  11.994
  647   2HB   ASP  75          HB1       ASP  75  12.153   6.079  11.426
  648    H    GLN  76           HN       GLN  76  10.632   4.219   8.203
  649    HA   GLN  76           HA       GLN  76  11.412   6.688   6.689
  650   1HB   GLN  76          HB2       GLN  76  10.277   4.051   5.795
  651   2HB   GLN  76          HB1       GLN  76  10.143   5.489   4.782
  652   1HG   GLN  76          HG2       GLN  76  12.714   5.738   5.295
  653   2HG   GLN  76          HG1       GLN  76  12.613   4.018   5.658
  654   1HE2  GLN  76          HE21      GLN  76  14.107   3.908   3.667
  655   2HE2  GLN  76          HE22      GLN  76  13.373   3.841   2.139
  656    H    LYS  77           HN       LYS  77   9.815   8.035   5.819
  657    HA   LYS  77           HA       LYS  77   7.180   7.901   7.252
  658   1HB   LYS  77          HB2       LYS  77   8.676  10.026   7.312
  659   2HB   LYS  77          HB1       LYS  77   8.162  10.250   5.645
  660   1HG   LYS  77          HG2       LYS  77   6.612  11.493   6.975
  661   2HG   LYS  77          HG1       LYS  77   5.764  10.029   6.481
  662   1HD   LYS  77          HD2       LYS  77   5.350   9.652   8.664
  663   2HD   LYS  77          HD1       LYS  77   7.068   9.309   8.851
  664   1HE   LYS  77          HE2       LYS  77   7.542  11.577   9.473
  665   2HE   LYS  77          HE1       LYS  77   5.928  12.110   8.999
  666   1HZ   LYS  77          HZ1       LYS  77   6.129  11.837  11.400
  667   2HZ   LYS  77          HZ2       LYS  77   6.530  10.199  11.193
  668   3HZ   LYS  77          HZ3       LYS  77   4.988  10.762  10.754
  669    H    CYS  78           HN       CYS  78   5.214   8.055   5.924
  670    HA   CYS  78           HA       CYS  78   5.785   7.694   3.030
  671   1HB   CYS  78          HB2       CYS  78   4.389   5.693   2.895
  672   2HB   CYS  78          HB1       CYS  78   5.709   5.437   4.031
  673    HG   CYS  78           HG       CYS  78   3.206   4.744   4.944
  674    H    ASP  79           HN       ASP  79   4.037   8.070   1.630
  675    HA   ASP  79           HA       ASP  79   1.808   9.665   2.945
  676   1HB   ASP  79          HB2       ASP  79   3.362  10.408   0.816
  677   2HB   ASP  79          HB1       ASP  79   2.056   9.585  -0.037
  678    H    ILE  80           HN       ILE  80  -0.056   8.448   3.195
  679    HA   ILE  80           HA       ILE  80  -0.291   6.114   1.340
  680    HB   ILE  80           HB       ILE  80  -1.578   5.006   3.207
  681   1HG1  ILE  80          HG12      ILE  80  -0.406   6.283   5.406
  682   2HG1  ILE  80          HG11      ILE  80  -1.044   7.599   4.427
  683   1HG2  ILE  80          HG21      ILE  80   1.319   5.757   3.630
  684   2HG2  ILE  80          HG22      ILE  80   0.715   4.432   2.636
  685   3HG2  ILE  80          HG23      ILE  80   0.499   4.389   4.384
  686   1HD1  ILE  80          HD11      ILE  80  -2.810   5.236   4.754
  687   2HD1  ILE  80          HD12      ILE  80  -3.216   6.950   4.724
  688   3HD1  ILE  80          HD13      ILE  80  -2.556   6.227   6.190
  689    H    ILE  81           HN       ILE  81  -2.204   5.256   0.836
  690    HA   ILE  81           HA       ILE  81  -4.586   7.074   0.996
  691    HB   ILE  81           HB       ILE  81  -5.319   6.305  -1.177
  692   1HG1  ILE  81          HG12      ILE  81  -3.326   4.789  -2.317
  693   2HG1  ILE  81          HG11      ILE  81  -3.354   4.166  -0.669
  694   1HG2  ILE  81          HG21      ILE  81  -3.603   7.205  -2.600
  695   2HG2  ILE  81          HG22      ILE  81  -2.348   6.818  -1.424
  696   3HG2  ILE  81          HG23      ILE  81  -3.526   8.081  -1.071
  697   1HD1  ILE  81          HD11      ILE  81  -5.669   3.594  -0.821
  698   2HD1  ILE  81          HD12      ILE  81  -4.937   3.025  -2.321
  699   3HD1  ILE  81          HD13      ILE  81  -5.871   4.521  -2.309
  700    H    TRP  82           HN       TRP  82  -6.350   6.108   1.948
  701    HA   TRP  82           HA       TRP  82  -5.961   3.329   2.894
  702   1HB   TRP  82          HB2       TRP  82  -6.570   4.414   4.787
  703   2HB   TRP  82          HB1       TRP  82  -7.301   5.744   3.901
  704    HD1  TRP  82           HD1      TRP  82  -8.112   2.484   5.626
  705    HE1  TRP  82           HE1      TRP  82 -10.667   2.144   5.660
  706    HE3  TRP  82           HE3      TRP  82  -9.549   6.263   2.505
  707    HZ2  TRP  82           HZ2      TRP  82 -13.012   3.319   4.516
  708    HZ3  TRP  82           HZ3      TRP  82 -11.946   6.629   1.996
  709    HH2  TRP  82           HH2      TRP  82 -13.678   5.164   2.996
  710    H    ARG  83           HN       ARG  83  -7.440   1.700   2.625
  711    HA   ARG  83           HA       ARG  83 -10.011   1.963   1.392
  712   1HB   ARG  83          HB2       ARG  83  -8.032   2.233  -0.482
  713   2HB   ARG  83          HB1       ARG  83  -8.292   0.490  -0.514
  714   1HG   ARG  83          HG2       ARG  83 -10.010   0.974  -1.920
  715   2HG   ARG  83          HG1       ARG  83 -10.873   1.435  -0.453
  716   1HD   ARG  83          HD2       ARG  83  -9.679   3.748  -0.811
  717   2HD   ARG  83          HD1       ARG  83  -9.509   3.192  -2.474
  718    HE   ARG  83           HE       ARG  83 -11.975   3.074  -2.599
  719   1HH1  ARG  83          HH11      ARG  83 -12.767   2.887   0.217
  720   2HH1  ARG  83          HH12      ARG  83 -13.226   4.509   0.614
  721   1HH2  ARG  83          HH21      ARG  83 -11.614   5.919  -2.122
  722   2HH2  ARG  83          HH22      ARG  83 -12.571   6.230  -0.712
  723    H    TYR  84           HN       TYR  84 -11.061  -0.118   1.200
  724    HA   TYR  84           HA       TYR  84  -9.756  -2.210   2.862
  725   1HB   TYR  84          HB2       TYR  84 -12.161  -1.251   3.238
  726   2HB   TYR  84          HB1       TYR  84 -12.605  -2.309   1.900
  727    HD1  TYR  84           HD1      TYR  84 -13.071  -4.570   2.306
  728    HD2  TYR  84           HD2      TYR  84 -10.773  -2.340   5.171
  729    HE1  TYR  84           HE1      TYR  84 -13.110  -6.511   3.849
  730    HE2  TYR  84           HE2      TYR  84 -10.812  -4.281   6.713
  731    HH   TYR  84           HH       TYR  84 -11.252  -7.179   6.009
  732    H    THR  85           HN       THR  85 -11.468  -1.825  -0.249
  733    HA   THR  85           HA       THR  85 -10.132  -4.336  -1.181
  734    HB   THR  85           HB       THR  85 -12.119  -4.599  -2.720
  735    HG1  THR  85           HG1      THR  85 -13.343  -2.717  -0.995
  736   1HG2  THR  85          HG21      THR  85 -13.564  -5.544  -1.006
  737   2HG2  THR  85          HG22      THR  85 -12.795  -4.554   0.233
  738   3HG2  THR  85          HG23      THR  85 -11.882  -5.835  -0.564
  739    H    LYS  86           HN       LYS  86  -8.630  -2.184  -1.506
  740    HA   LYS  86           HA       LYS  86  -9.197  -0.632  -3.898
  741   1HB   LYS  86          HB2       LYS  86  -7.311  -0.533  -1.794
  742   2HB   LYS  86          HB1       LYS  86  -6.374  -0.757  -3.269
  743   1HG   LYS  86          HG2       LYS  86  -8.597   1.246  -3.303
  744   2HG   LYS  86          HG1       LYS  86  -7.105   1.673  -2.467
  745   1HD   LYS  86          HD2       LYS  86  -5.824   1.082  -4.526
  746   2HD   LYS  86          HD1       LYS  86  -7.351   0.782  -5.355
  747   1HE   LYS  86          HE2       LYS  86  -6.846   3.415  -3.980
  748   2HE   LYS  86          HE1       LYS  86  -6.256   3.127  -5.615
  749   1HZ   LYS  86          HZ1       LYS  86  -9.072   2.935  -4.694
  750   2HZ   LYS  86          HZ2       LYS  86  -8.537   2.525  -6.253
  751   3HZ   LYS  86          HZ3       LYS  86  -8.419   4.129  -5.705
  752    H    THR  87           HN       THR  87  -8.361  -0.924  -5.984
  753    HA   THR  87           HA       THR  87  -7.719  -3.652  -6.756
  754    HB   THR  87           HB       THR  87  -7.283  -1.310  -8.590
  755    HG1  THR  87           HG1      THR  87  -9.797  -2.371  -7.799
  756   1HG2  THR  87          HG21      THR  87  -8.494  -4.070  -8.932
  757   2HG2  THR  87          HG22      THR  87  -6.858  -3.597  -9.392
  758   3HG2  THR  87          HG23      THR  87  -8.247  -2.895 -10.223
  759    H    GLN  88           HN       GLN  88  -5.852  -0.888  -5.808
  760    HA   GLN  88           HA       GLN  88  -3.380  -1.720  -7.128
  761   1HB   GLN  88          HB2       GLN  88  -4.316   0.610  -5.825
  762   2HB   GLN  88          HB1       GLN  88  -2.959   0.029  -4.861
  763   1HG   GLN  88          HG2       GLN  88  -1.575  -0.101  -6.919
  764   2HG   GLN  88          HG1       GLN  88  -2.928   0.546  -7.850
  765   1HE2  GLN  88          HE21      GLN  88  -3.795   2.753  -6.966
  766   2HE2  GLN  88          HE22      GLN  88  -2.632   3.849  -6.392
  767    H    VAL  89           HN       VAL  89  -4.611  -1.750  -3.760
  768    HA   VAL  89           HA       VAL  89  -2.321  -3.064  -2.643
  769    HB   VAL  89           HB       VAL  89  -5.180  -3.069  -1.628
  770   1HG1  VAL  89          HG11      VAL  89  -2.859  -4.454  -0.740
  771   2HG1  VAL  89          HG12      VAL  89  -4.411  -4.312   0.085
  772   3HG1  VAL  89          HG13      VAL  89  -3.136  -3.134   0.395
  773   1HG2  VAL  89          HG21      VAL  89  -2.834  -1.236  -1.011
  774   2HG2  VAL  89          HG22      VAL  89  -4.407  -1.182  -0.218
  775   3HG2  VAL  89          HG23      VAL  89  -4.270  -0.787  -1.930
  776    H    GLU  90           HN       GLU  90  -5.318  -4.347  -4.087
  777    HA   GLU  90           HA       GLU  90  -4.871  -7.078  -3.300
  778   1HB   GLU  90          HB2       GLU  90  -6.467  -7.667  -5.086
  779   2HB   GLU  90          HB1       GLU  90  -7.063  -6.311  -4.132
  780   1HG   GLU  90          HG2       GLU  90  -6.399  -4.733  -5.835
  781   2HG   GLU  90          HG1       GLU  90  -5.563  -5.989  -6.745
  782    H    TRP  91           HN       TRP  91  -3.722  -5.135  -6.024
  783    HA   TRP  91           HA       TRP  91  -2.615  -7.273  -7.592
  784   1HB   TRP  91          HB2       TRP  91  -2.439  -4.326  -7.502
  785   2HB   TRP  91          HB1       TRP  91  -0.991  -5.118  -8.123
  786    HD1  TRP  91           HD1      TRP  91  -4.752  -5.934  -8.604
  787    HE1  TRP  91           HE1      TRP  91  -5.197  -6.160 -11.133
  788    HE3  TRP  91           HE3      TRP  91  -0.105  -4.844 -10.416
  789    HZ2  TRP  91           HZ2      TRP  91  -3.768  -5.912 -13.599
  790    HZ3  TRP  91           HZ3      TRP  91   0.325  -4.845 -12.856
  791    HH2  TRP  91           HH2      TRP  91  -1.499  -5.376 -14.448
  792    H    LEU  92           HN       LEU  92  -1.012  -4.980  -5.356
  793    HA   LEU  92           HA       LEU  92   1.529  -6.287  -5.359
  794   1HB   LEU  92          HB2       LEU  92   1.858  -5.053  -3.147
  795   2HB   LEU  92          HB1       LEU  92   1.466  -4.049  -4.538
  796    HG   LEU  92           HG       LEU  92  -1.036  -4.563  -3.641
  797   1HD1  LEU  92          HD11      LEU  92  -0.274  -3.976  -0.997
  798   2HD1  LEU  92          HD12      LEU  92   0.735  -5.337  -1.486
  799   3HD1  LEU  92          HD13      LEU  92  -1.018  -5.464  -1.579
  800   1HD2  LEU  92          HD21      LEU  92   0.943  -2.405  -3.274
  801   2HD2  LEU  92          HD22      LEU  92  -0.390  -2.372  -2.120
  802   3HD2  LEU  92          HD23      LEU  92  -0.721  -2.319  -3.851
  803    H    LYS  93           HN       LYS  93  -1.377  -6.809  -3.407
  804    HA   LYS  93           HA       LYS  93  -0.253  -8.511  -1.409
  805   1HB   LYS  93          HB2       LYS  93  -2.968  -7.981  -2.512
  806   2HB   LYS  93          HB1       LYS  93  -2.760  -9.499  -1.642
  807   1HG   LYS  93          HG2       LYS  93  -2.141  -8.408   0.359
  808   2HG   LYS  93          HG1       LYS  93  -1.768  -6.901  -0.476
  809   1HD   LYS  93          HD2       LYS  93  -3.834  -6.266   0.240
  810   2HD   LYS  93          HD1       LYS  93  -4.399  -7.212  -1.136
  811   1HE   LYS  93          HE2       LYS  93  -5.639  -8.244   0.502
  812   2HE   LYS  93          HE1       LYS  93  -4.165  -9.199   0.662
  813   1HZ   LYS  93          HZ1       LYS  93  -4.923  -8.384   2.803
  814   2HZ   LYS  93          HZ2       LYS  93  -4.844  -6.780   2.250
  815   3HZ   LYS  93          HZ3       LYS  93  -3.424  -7.700   2.406
  816    H    ARG  94           HN       ARG  94  -1.826  -9.329  -4.521
  817    HA   ARG  94           HA       ARG  94  -1.498 -12.143  -4.418
  818   1HB   ARG  94          HB2       ARG  94  -1.561 -10.209  -6.745
  819   2HB   ARG  94          HB1       ARG  94  -1.489 -11.956  -6.968
  820   1HG   ARG  94          HG2       ARG  94  -3.550 -11.059  -5.056
  821   2HG   ARG  94          HG1       ARG  94  -3.814 -10.530  -6.719
  822   1HD   ARG  94          HD2       ARG  94  -3.118 -13.103  -7.173
  823   2HD   ARG  94          HD1       ARG  94  -3.850 -13.273  -5.578
  824    HE   ARG  94           HE       ARG  94  -5.259 -12.245  -7.999
  825   1HH1  ARG  94          HH21      ARG  94  -6.444 -11.123  -5.536
  826   2HH1  ARG  94          HH22      ARG  94  -7.609 -12.322  -5.083
  827   1HH2  ARG  94          HH11      ARG  94  -6.229 -14.800  -7.091
  828   2HH2  ARG  94          HH12      ARG  94  -7.487 -14.410  -5.966
  829    H    LYS  95           HN       LYS  95   0.733  -9.592  -5.450
  830    HA   LYS  95           HA       LYS  95   2.781 -11.282  -6.517
  831   1HB   LYS  95          HB2       LYS  95   2.837  -8.497  -5.336
  832   2HB   LYS  95          HB1       LYS  95   4.275  -9.275  -5.999
  833   1HG   LYS  95          HG2       LYS  95   3.230  -9.502  -8.171
  834   2HG   LYS  95          HG1       LYS  95   1.688  -8.925  -7.537
  835   1HD   LYS  95          HD2       LYS  95   2.358  -6.734  -7.512
  836   2HD   LYS  95          HD1       LYS  95   4.031  -7.141  -7.129
  837   1HE   LYS  95          HE2       LYS  95   4.321  -7.978  -9.464
  838   2HE   LYS  95          HE1       LYS  95   2.682  -7.438  -9.829
  839   1HZ   LYS  95          HZ1       LYS  95   4.340  -5.795 -10.476
  840   2HZ   LYS  95          HZ2       LYS  95   4.895  -5.699  -8.874
  841   3HZ   LYS  95          HZ3       LYS  95   3.322  -5.187  -9.264
  842    H    GLY  96           HN       GLY  96   2.039 -10.248  -3.196
  843   1HA   GLY  96          HA2       GLY  96   4.525 -11.075  -2.016
  844   2HA   GLY  96          HA1       GLY  96   2.994 -10.897  -1.153
  845    H    TYR  97           HN       TYR  97   1.414 -12.738  -2.515
  846    HA   TYR  97           HA       TYR  97   2.204 -15.222  -1.279
  847   1HB   TYR  97          HB2       TYR  97   0.224 -15.174  -3.539
  848   2HB   TYR  97          HB1       TYR  97   0.185 -16.106  -2.046
  849    HD1  TYR  97           HD1      TYR  97   0.743 -13.920  -0.054
  850    HD2  TYR  97           HD2      TYR  97  -1.834 -14.021  -3.488
  851    HE1  TYR  97           HE1      TYR  97  -0.677 -12.167   0.962
  852    HE2  TYR  97           HE2      TYR  97  -3.255 -12.269  -2.473
  853    HH   TYR  97           HH       TYR  97  -2.318 -10.369   0.064
  854    H    LEU  98           HN       LEU  98   2.444 -13.999  -4.606
  855    HA   LEU  98           HA       LEU  98   3.277 -16.417  -5.866
  856   1HB   LEU  98          HB2       LEU  98   2.593 -14.335  -7.074
  857   2HB   LEU  98          HB1       LEU  98   4.088 -13.567  -6.548
  858    HG   LEU  98           HG       LEU  98   4.007 -14.649  -8.918
  859   1HD1  LEU  98          HD11      LEU  98   6.348 -15.753  -7.498
  860   2HD1  LEU  98          HD12      LEU  98   6.032 -14.045  -7.190
  861   3HD1  LEU  98          HD13      LEU  98   6.276 -14.613  -8.841
  862   1HD2  LEU  98          HD21      LEU  98   3.060 -16.820  -7.877
  863   2HD2  LEU  98          HD22      LEU  98   4.712 -17.130  -7.344
  864   3HD2  LEU  98          HD23      LEU  98   4.352 -16.989  -9.065
  865    H    ASP  99           HN       ASP  99   5.174 -13.790  -4.369
  866    HA   ASP  99           HA       ASP  99   7.750 -14.967  -4.833
  867   1HB   ASP  99          HB2       ASP  99   7.271 -12.557  -4.176
  868   2HB   ASP  99          HB1       ASP  99   7.011 -13.139  -2.532
  869    H    GLU 100           HN       GLU 100   5.384 -15.327  -2.213
  870    HA   GLU 100           HA       GLU 100   7.031 -16.674  -0.323
  871   1HB   GLU 100          HB2       GLU 100   4.077 -16.623  -0.869
  872   2HB   GLU 100          HB1       GLU 100   4.723 -17.771   0.304
  873   1HG   GLU 100          HG2       GLU 100   5.534 -16.072   1.714
  874   2HG   GLU 100          HG1       GLU 100   5.494 -14.862   0.432
  875    H    LEU 101           HN       LEU 101   4.799 -18.130  -2.749
  876    HA   LEU 101           HA       LEU 101   6.674 -20.423  -2.936
  877   1HB   LEU 101          HB2       LEU 101   4.615 -21.979  -2.979
  878   2HB   LEU 101          HB1       LEU 101   5.166 -21.398  -1.418
  879    HG   LEU 101           HG       LEU 101   2.661 -21.344  -1.770
  880   1HD1  LEU 101          HD11      LEU 101   2.538 -19.670  -0.264
  881   2HD1  LEU 101          HD12      LEU 101   3.295 -18.509  -1.353
  882   3HD1  LEU 101          HD13      LEU 101   4.295 -19.609  -0.405
  883   1HD2  LEU 101          HD21      LEU 101   3.158 -18.900  -3.467
  884   2HD2  LEU 101          HD22      LEU 101   1.653 -19.785  -3.226
  885   3HD2  LEU 101          HD23      LEU 101   2.945 -20.493  -4.194
  886    H    LEU 102           HN       LEU 102   6.217 -21.809  -4.855
  887    HA   LEU 102           HA       LEU 102   5.693 -22.136  -7.113
  888   1HB   LEU 102          HB2       LEU 102   3.395 -21.186  -6.323
  889   2HB   LEU 102          HB1       LEU 102   3.927 -19.693  -7.096
  890    HG   LEU 102           HG       LEU 102   4.510 -21.810  -8.901
  891   1HD1  LEU 102          HD11      LEU 102   2.873 -23.166  -7.649
  892   2HD1  LEU 102          HD12      LEU 102   2.258 -22.760  -9.251
  893   3HD1  LEU 102          HD13      LEU 102   1.671 -21.889  -7.834
  894   1HD2  LEU 102          HD21      LEU 102   2.325 -19.701  -8.893
  895   2HD2  LEU 102          HD22      LEU 102   2.864 -20.600 -10.312
  896   3HD2  LEU 102          HD23      LEU 102   3.967 -19.486  -9.502