*HEADER   COMPLEX (PROTO-ONCOGENE/EARLY PROTEIN)  10-JUL-97   1AOU    
*TITLE    NMR STRUCTURE OF THE FYN SH2 DOMAIN COMPLEXED WITH A        
*TITLE   2 PHOSPHOTYROSYL PEPTIDE, 22 STRUCTURES                      
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: FYN PROTEIN-TYROSINE KINASE;                     
*COMPND  3 CHAIN: F;                                                  
*COMPND  4 FRAGMENT: SH2 DOMAIN;                                      
*COMPND  5 SYNONYM: SRC HOMOLOGY 2 DOMAIN;                            
*COMPND  6 EC: 2.7.1.112;                                             
*COMPND  7 ENGINEERED: YES;                                           
*COMPND  8 MUTATION: C97S, C98S, C104S;                               
*COMPND  9 MOL_ID: 2;                                                 
*COMPND 10 MOLECULE: PHOSPHOTYROSYL PEPTIDE;                          
*COMPND 11 CHAIN: P                                                   
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                         
*SOURCE  3 ORGANISM_COMMON: HUMAN;                                    
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                       
*SOURCE  5 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                      
*SOURCE  6 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM;            
*SOURCE  7 EXPRESSION_SYSTEM_PLASMID: PRK172;                         
*SOURCE  8 EXPRESSION_SYSTEM_GENE: LYSS;                              
*SOURCE  9 MOL_ID: 2;                                                 
*SOURCE 10 ORGANISM_SCIENTIFIC: HAMSTER POLYOMAVIRUS                  
*KEYWDS   SH2 DOMAIN, SIGNAL TRANSDUCTION, PEPTIDE COMPLEX,           
*KEYWDS  2 COMPLEX (PROTO-ONCOGENE/EARLY PROTEIN)                     
*EXPDTA   NMR, 22 STRUCTURES                                          
*AUTHOR   T.D.MULHERN,G.L.SHAW,C.J.MORTON,A.J.DAY,I.D.CAMPBELL        
*REVDAT  1   14-JAN-98 1AOU    0                                      
 
NMR structure of the Fyn SH2 domain complexed with a phosphotyrosyl peptide

!Residue  E1 (201)
!Intra-residue
!Intra-peptide
!peptide-protein

!Residue  P2 (202)
!Intra-residue
!Intra-peptide
assign ( segid "fSH2" and resid 202 and name ha  )( segid "fSH2" and resid 203 and name hn  ) 0.0 1.8 2.7

!peptide-protein


!Residue  Q3 (203)
!Intra-residue
assign ( segid "fSH2" and resid 203 and name hn  )( segid "fSH2" and resid 203 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 203 and name hn  )( segid "fSH2" and resid 203 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 203 and name hn  )( segid "fSH2" and resid 203 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 203 and name ha  )( segid "fSH2" and resid 203 and name he21) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 203 and name ha  )( segid "fSH2" and resid 203 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 203 and name ha  )( segid "fSH2" and resid 203 and name hg* ) 0.0 1.8 5.0


!Intra-peptide
assign ( segid "fSH2" and resid 203 and name ha  )( segid "fSH2" and resid 204 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 203 and name hb* )( segid "fSH2" and resid 204 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 203 and name hg* )( segid "fSH2" and resid 204 and name hn  ) 0.0 1.8 5.0

!peptide-protein

!Residue pY4 (204)
!Intra-residue
assign ( segid "fSH2" and resid 204 and name ha  )( segid "fSH2" and resid 204 and name hd*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 204 and name hb1 )( segid "fSH2" and resid 204 and name hd*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name hb2 )( segid "fSH2" and resid 204 and name he*) 0.0 1.8 5.0

!Intra-peptide

!peptide-protein
assign ( segid "fSH2" and resid 204 and name hb1 )( segid "fSH2" and resid 62 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name hb1 )( segid "fSH2" and resid 62 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 38 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 60 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 60 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 61 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 62 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 62 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 204 and name hd* )( segid "fSH2" and resid 62 and name hg* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 204 and name he* )( segid "fSH2" and resid 38 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name he* )( segid "fSH2" and resid 38 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name he* )( segid "fSH2" and resid 44 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name he* )( segid "fSH2" and resid 44 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name he* )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 204 and name he* )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0


!Residue  E5 (205)
!Intra-residue
assign ( segid "fSH2" and resid 205 and name hn )( segid "fSH2" and resid 205 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 205 and name hn )( segid "fSH2" and resid 205 and name hg* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 205 and name ha )( segid "fSH2" and resid 205 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 205 and name ha )( segid "fSH2" and resid 205 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 205 and name ha )( segid "fSH2" and resid 205 and name hg* ) 0.0 1.8 3.5
!Intra-peptide
assign ( segid "fSH2" and resid 205 and name ha )( segid "fSH2" and resid 206 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 205 and name ha )( segid "fSH2" and resid 206 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 205 and name ha )( segid "fSH2" and resid 206 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 205 and name hb*)( segid "fSH2" and resid 206 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 205 and name hg*)( segid "fSH2" and resid 206 and name hn  ) 0.0 1.8 5.0

!peptide-protein
assign ( segid "fSH2" and resid 205 and name hn  )( segid "fSH2" and resid 61 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 205 and name hb* )( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 205 and name hg* )( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 205 and name hb* )( segid "fSH2" and resid 61 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 205 and name hg* )( segid "fSH2" and resid 61 and name he* ) 0.0 1.8 5.0

!Residue  E6 (206)
!Intra-residue
assign ( segid "fSH2" and resid 206 and name hb*)( segid "fSH2" and resid 206 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 206 and name hg*)( segid "fSH2" and resid 206 and name hn  ) 0.0 1.8 5.0
!Intra-peptide

assign ( segid "fSH2" and resid 206 and name ha )( segid "fSH2" and resid 207 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 206 and name hb*)( segid "fSH2" and resid 207 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 206 and name hg*)( segid "fSH2" and resid 207 and name hn  ) 0.0 1.8 5.0
!peptide-protein


!Residue  I7 (207)
!Intra-residue
assign ( segid "fSH2" and resid 207 and name ha   )( segid "fSH2" and resid 207 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name ha   )( segid "fSH2" and resid 207 and name hg1*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 207 and name hg1* )( segid "fSH2" and resid 207 and name hn  ) 0.0 1.8 5.0

!Intra-peptide
!peptide-protein
assign ( segid "fSH2" and resid 207 and name hn   )( segid "fSH2" and resid 73 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name hg1* )( segid "fSH2" and resid 61 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name hg1* )( segid "fSH2" and resid 74 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name hg1* )( segid "fSH2" and resid 95 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name hg1* )( segid "fSH2" and resid 95 and name ha1 ) 0.0 1.8 3.5 !m.c. 5.0
assign ( segid "fSH2" and resid 207 and name hg1* )( segid "fSH2" and resid 95 and name ha2 ) 0.0 1.8 3.5 !m.c. 5.0
assign ( segid "fSH2" and resid 207 and name hd1* )( segid "fSH2" and resid 61 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 207 and name hd1* )( segid "fSH2" and resid 73 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name hd1* )( segid "fSH2" and resid 74 and name hg2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 207 and name hd1* )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 207 and name hd1* )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 207 and name hd1* )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0

!Residue  P8 (208)
!Intra-residue
!Intra-peptide
assign ( segid "fSH2" and resid 208 and name ha )( segid "fSH2" and resid 209 and name hn ) 0.0 1.8 2.7
!peptide-protein


!Residue  I9 (209)
!Intra-residue
assign ( segid "fSH2" and resid 209 and name ha )( segid "fSH2" and resid 209 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 209 and name hb )( segid "fSH2" and resid 209 and name hn ) 0.0 1.8 3.5
!Intra-peptide
assign ( segid "fSH2" and resid 209 and name ha )( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 209 and name hb )( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 209 and name hn )( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 209 and name hn )( segid "fSH2" and resid 210 and name hb1) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 209 and name hn )( segid "fSH2" and resid 210 and name hb2) 0.0 1.8 5.0
!peptide-protein


!Residue Y10 (210)
!Intra-residue
assign ( segid "fSH2" and resid 210 and name ha )( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 210 and name ha )( segid "fSH2" and resid 210 and name hd*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 210 and name hb1)( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 210 and name hb2)( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 210 and name hd*)( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 210 and name he*)( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 210 and name hb1)( segid "fSH2" and resid 210 and name hd*) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 210 and name hb2)( segid "fSH2" and resid 210 and name hd*) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 210 and name hb1)( segid "fSH2" and resid 210 and name he*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 210 and name hb2)( segid "fSH2" and resid 210 and name he*) 0.0 1.8 5.0

!Intra-peptide
assign ( segid "fSH2" and resid 210 and name ha )( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 210 and name hb1)( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 210 and name hb2)( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 210 and name hd*)( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 5.0
!peptide-protein


!Residue L11 (211)
!Intra-residue
assign ( segid "fSH2" and resid 211 and name ha )( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 211 and name hd*)( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 5.0
!Intra-peptide
!peptide-protein



!INTRARESIDUE NOES

!Residue 143 (1)

!Residue 144 (2)

!Residue 145 (3)
assign ( segid "fSH2" and resid 3 and name ha  )( segid "fSH2" and resid 3 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 3 and name hg* )( segid "fSH2" and resid 3 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 3 and name hb1 )( segid "fSH2" and resid 3 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 3 and name hb2 )( segid "fSH2" and resid 3 and name hn  ) 0.0 1.8 3.5

!Residue 146 (4)
assign ( segid "fSH2" and resid 4 and name hb* )( segid "fSH2" and resid 4 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 4 and name ha* )( segid "fSH2" and resid 4 and name hn  ) 0.0 1.8 3.5

!Residue 147 (5)
assign ( segid "fSH2" and resid 5 and name ha* )( segid "fSH2" and resid 5 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 5 and name hg* )( segid "fSH2" and resid 5 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 5 and name hb* )( segid "fSH2" and resid 5 and name hn  ) 0.0 1.8 3.5

!Residue 148 (6)
assign ( segid "fSH2" and resid 6 and name hg* )( segid "fSH2" and resid 6 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 6 and name hb* )( segid "fSH2" and resid 6 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 6 and name ha* )( segid "fSH2" and resid 6 and name hn  ) 0.0 1.8 5.0

!Residue 149 (7)
assign ( segid "fSH2" and resid 7 and name he1 )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hd1 )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 7 and name ha  )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 7 and name hb1 )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hb1 )( segid "fSH2" and resid 7 and name hd1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hb2 )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hb2 )( segid "fSH2" and resid 7 and name hd1 ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 7 and name hb2 )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hb2 )( segid "fSH2" and resid 7 and name hd1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hb1 )( segid "fSH2" and resid 7 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hb1 )( segid "fSH2" and resid 7 and name hd1 ) 0.0 1.8 5.0


!Residue 150 (8)
assign ( segid "fSH2" and resid 8 and name hb1 )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name ha  )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 8 and name hb2 )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 3.5

!Residue 151 (9)
assign ( segid "fSH2" and resid 9 and name hd* )( segid "fSH2" and resid 9 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 9 and name ha  )( segid "fSH2" and resid 9 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hb1 )( segid "fSH2" and resid 9 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hb2 )( segid "fSH2" and resid 9 and name hn  ) 0.0 1.8 5.0

!Residue 152 (10)
!assign ( segid "fSH2" and resid 10 and name ha1 )( segid "fSH2" and resid 10 and name hn ) 0.0 1.8 3.5 !2.7 m.c.
!assign ( segid "fSH2" and resid 10 and name ha2 )( segid "fSH2" and resid 10 and name hn ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 10 and name ha2 )( segid "fSH2" and resid 10 and name hn ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 10 and name ha1 )( segid "fSH2" and resid 10 and name hn ) 0.0 1.8 3.5 !2.7 m.c.

!Residue 153 (11)
assign ( segid "fSH2" and resid 11 and name ha* )( segid "fSH2" and resid 11 and name hn ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 11 and name hb* )( segid "fSH2" and resid 11 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 11 and name hg* )( segid "fSH2" and resid 11 and name hn ) 0.0 1.8 2.7

!Residue 154 (12)
assign ( segid "fSH2" and resid 12 and name ha  )( segid "fSH2" and resid 12 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 12 and name ha  )( segid "fSH2" and resid 12 and name hd1*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name ha  )( segid "fSH2" and resid 12 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hb* )( segid "fSH2" and resid 12 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hd1*)( segid "fSH2" and resid 12 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hd2*)( segid "fSH2" and resid 12 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hg* )( segid "fSH2" and resid 12 and name hn  ) 0.0 1.8 5.0

!Residue 155 (13)
assign ( segid "fSH2" and resid 13 and name ha1 )( segid "fSH2" and resid 13 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 13 and name ha2 )( segid "fSH2" and resid 13 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 13 and name ha2 )( segid "fSH2" and resid 13 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 13 and name ha1 )( segid "fSH2" and resid 13 and name hn* ) 0.0 1.8 3.5

!Residue 156 (14)
assign ( segid "fSH2" and resid 14 and name ha* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 14 and name hg* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 14 and name hb* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 14 and name hd* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 5.0

!Residue 157 (15)
assign ( segid "fSH2" and resid 15 and name ha* )( segid "fSH2" and resid 15 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 15 and name hb* )( segid "fSH2" and resid 15 and name hn* ) 0.0 1.8 2.7

!Residue 158 (16)
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 2.7
!assign ( segid "fSH2" and resid 16 and name hb1* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 2.7
!assign ( segid "fSH2" and resid 16 and name hb2* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 16 and name hb2* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 16 and name hb1* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 2.7

!Residue 159 (17)
assign ( segid "fSH2" and resid 17 and name ha* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 17 and name hb* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 2.7

!Residue 160 (18)
!assign ( segid "fSH2" and resid 18 and name hg1* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 18 and name hg2* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 18 and name hg2* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 18 and name hg1* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5

assign ( segid "fSH2" and resid 18 and name hb* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 18 and name ha  )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 5.0

!Residue 161 (19)
assign ( segid "fSH2" and resid 19 and name ha* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 19 and name hb* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 19 and name hg* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 19 and name hg* )( segid "fSH2" and resid 19 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 19 and name hd* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 19 and name hd* )( segid "fSH2" and resid 19 and name ha  ) 0.0 1.8 3.5

!Residue 162 (20)
assign ( segid "fSH2" and resid 20 and name ha* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 20 and name hb* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 20 and name hg* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 5.0

!Residue 163 (21)
assign ( segid "fSH2" and resid 21 and name hd* )( segid "fSH2" and resid 21 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 21 and name ha* )( segid "fSH2" and resid 21 and name hn* ) 0.0 1.8 3.5

!Residue 164 (22)
assign ( segid "fSH2" and resid 22 and name ha* )( segid "fSH2" and resid 22 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 22 and name hg* )( segid "fSH2" and resid 22 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 22 and name hd1*)( segid "fSH2" and resid 22 and name hn* ) 0.0 1.8 2.7

!Residue 165 (23)
assign ( segid "fSH2" and resid 23 and name ha* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 23 and name hb* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 2.7

!Residue 166 (24)
assign ( segid "fSH2" and resid 24 and name hn  )( segid "fSH2" and resid 24 and name hb1  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name hn  )( segid "fSH2" and resid 24 and name hb2  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name ha* )( segid "fSH2" and resid 24 and name hb1  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name ha* )( segid "fSH2" and resid 24 and name hb2  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name ha* )( segid "fSH2" and resid 24 and name hd*  ) 0.0 1.8 5.0

!Residue 167 (25)
assign ( segid "fSH2" and resid 25 and name ha1* )( segid "fSH2" and resid 25 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 25 and name ha2* )( segid "fSH2" and resid 25 and name hn* ) 0.0 1.8 3.5

!Residue 168 (26)
assign ( segid "fSH2" and resid 26 and name hn   )( segid "fSH2" and resid 26 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 26 and name ha   )( segid "fSH2" and resid 26 and name hn* ) 0.0 1.8 3.5

!Residue 169 (27)

!Residue 170 (28)
assign ( segid "fSH2" and resid 28 and name ha  )( segid "fSH2" and resid 28 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 28 and name hb* )( segid "fSH2" and resid 28 and name hn* ) 0.0 1.8 2.7

!Residue 171 (29)
assign ( segid "fSH2" and resid 29 and name ha1 )( segid "fSH2" and resid 29 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 29 and name ha2 )( segid "fSH2" and resid 29 and name hn* ) 0.0 1.8 3.5

!Residue 172 (30)
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 30 and name ha  )( segid "fSH2" and resid 30 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hb* )( segid "fSH2" and resid 30 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hg2*)( segid "fSH2" and resid 30 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hg2*)( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 2.7

!Residue 173 (31)
assign ( segid "fSH2" and resid 31 and name hb1* )( segid "fSH2" and resid 31 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name hb2* )( segid "fSH2" and resid 31 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name hd* )( segid "fSH2" and resid 31 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name ha* )( segid "fSH2" and resid 31 and name hn* ) 0.0 1.8 5.0

!Residue 174 (32)
assign ( segid "fSH2" and resid 32 and name ha* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 32 and name hb* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 32 and name hd1* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 32 and name hd2* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 5.0

!Residue 175 (33)
assign ( segid "fSH2" and resid 33 and name ha* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name hb* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 33 and name hg1* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 33 and name hg2* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name hd1* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0

!Residue 176 (34)
assign ( segid "fSH2" and resid 34 and name ha* )( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0

!Residue 177 (35)
assign ( segid "fSH2" and resid 35 and name ha* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name hg* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 35 and name hb1* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name hb2* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 3.5

!Residue 178 (36)
assign ( segid "fSH2" and resid 36 and name ha* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 3.5


!Residue 179 (37)
assign ( segid "fSH2" and resid 37 and name ha* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 37 and name hg* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 37 and name hb* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 3.5

!Residue 180 (38)
assign ( segid "fSH2" and resid 38 and name ha* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 38 and name hb* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 38 and name hg2*)( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 3.5

!Residue 181 (39)
assign ( segid "fSH2" and resid 39 and name ha* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 39 and name hb* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 39 and name hg2*)( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5

!Residue 182 (40)
assign ( segid "fSH2" and resid 40 and name ha* )( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 40 and name hb* )( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 40 and name hg* )( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 2.7

!Residue 183 (41)
assign ( segid "fSH2" and resid 41 and name ha2* )( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 2.7

!Residue 184 (42)
assign ( segid "fSH2" and resid 42 and name ha* )( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 42 and name hb* )( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 2.7

!Residue 185 (43)
assign ( segid "fSH2" and resid 43 and name ha   )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 43 and name hb1  )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 43 and name hb2  )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 5.0

!Residue 186 (44)
assign ( segid "fSH2" and resid 44 and name ha   )( segid "fSH2" and resid 44 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 44 and name hb1  )( segid "fSH2" and resid 44 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 44 and name hb2  )( segid "fSH2" and resid 44 and name hn  ) 0.0 1.8 5.0

!Residue 187 (45)
assign ( segid "fSH2" and resid 45 and name ha* )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hb* )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hg  )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 5.0

!Residue 188 (46)
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 46 and name hb1 )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 46 and name hb2 )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 3.5

!Residue 189 (47)
assign ( segid "fSH2" and resid 47 and name ha  )( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 47 and name hb* )( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hd1*)( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 5.0

!Residue 190 (48)
assign ( segid "fSH2" and resid 48 and name ha  )( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 48 and name hd* )( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 5.0

!Residue 191 (49)
assign ( segid "fSH2" and resid 49 and name ha  )( segid "fSH2" and resid 49 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 49 and name hb1 )( segid "fSH2" and resid 49 and name hn  ) 0.0 1.8 3.5

!Residue 192 (50)
!assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 50 and name hn  ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 50 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 50 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 50 and name hd1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 50 and name he3 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hb1 )( segid "fSH2" and resid 50 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hb2 )( segid "fSH2" and resid 50 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hb1 )( segid "fSH2" and resid 50 and name he3 ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 50 and name hb2 )( segid "fSH2" and resid 50 and name he3 ) 0.0 1.8 5.0 !3.5 olp

!Residue 193 (51)
assign ( segid "fSH2" and resid 51 and name ha  )( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 5.0 !3.5 olp

!Residue 194 (52)

!Residue 195 (53)
assign ( segid "fSH2" and resid 53 and name ha  )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 53 and name hb1 )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name hb2 )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name he* )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 53 and name he* )( segid "fSH2" and resid 53 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name he* )( segid "fSH2" and resid 53 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name he* )( segid "fSH2" and resid 53 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name hg* )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 3.5

!Residue 196 (54)
assign ( segid "fSH2" and resid 54 and name ha* )( segid "fSH2" and resid 54 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 54 and name hg* )( segid "fSH2" and resid 54 and name hn* ) 0.0 1.8 2.7

!Residue 197 (55)
assign ( segid "fSH2" and resid 55 and name ha1 )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 55 and name ha2 )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 2.7
!assign ( segid "fSH2" and resid 55 and name ha2 )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 2.7
!assign ( segid "fSH2" and resid 55 and name ha1 )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 2.7

!Residue 198 (56)
assign ( segid "fSH2" and resid 56 and name ha  )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 56 and name hb1 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 56 and name hb2 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 3.5

!Residue 199 (57)
assign ( segid "fSH2" and resid 57 and name ha  )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 57 and name ha  )( segid "fSH2" and resid 57 and name hd2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 57 and name hb1 )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 57 and name hb1 )( segid "fSH2" and resid 57 and name hd2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 57 and name hb2 )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 57 and name hb2 )( segid "fSH2" and resid 57 and name hd2 ) 0.0 1.8 5.0

!Residue 200 (58)
assign ( segid "fSH2" and resid 58 and name ha  )( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 58 and name hg1*)( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 58 and name hg2*)( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 5.0

!Residue 201 (59)
assign ( segid "fSH2" and resid 59 and name ha* )( segid "fSH2" and resid 59 and name hn* ) 0.0 1.8 3.5

!Residue 202 (60)
assign ( segid "fSH2" and resid 60 and name hn  )( segid "fSH2" and resid 60 and name hd2) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 60 and name ha  )( segid "fSH2" and resid 60 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 60 and name ha  )( segid "fSH2" and resid 60 and name hd2) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 60 and name hb1 )( segid "fSH2" and resid 60 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 60 and name hb2 )( segid "fSH2" and resid 60 and name hn ) 0.0 1.8 5.0

!Residue 203 (61)
assign ( segid "fSH2" and resid 61 and name ha  )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 61 and name ha  )( segid "fSH2" and resid 61 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 61 and name hb* )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 2.7

!Residue 204 (62)
assign ( segid "fSH2" and resid 62 and name ha  )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 62 and name hb1 )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 62 and name hb2 )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 62 and name hg* )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0

!Residue 205 (63)
assign ( segid "fSH2" and resid 63 and name hb* )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 63 and name hg11)( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hg12)( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hd1*)( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name ha  )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 63 and name ha  )( segid "fSH2" and resid 63 and name hg2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 63 and name ha  )( segid "fSH2" and resid 63 and name hd1*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 63 and name hg2*)( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0

!Residue 206 (64)
assign ( segid "fSH2" and resid 64 and name ha  )( segid "fSH2" and resid 64 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 64 and name hd* )( segid "fSH2" and resid 64 and name hn  ) 0.0 1.8 3.5

!Residue 207 (65)
assign ( segid "fSH2" and resid 65 and name ha  )( segid "fSH2" and resid 65 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 65 and name hg1 )( segid "fSH2" and resid 65 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name hg2 )( segid "fSH2" and resid 65 and name hn  ) 0.0 1.8 5.0

!Residue 208 (66)
assign ( segid "fSH2" and resid 66 and name ha  )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hb* )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 66 and name hg  )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd1*)( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 3.5

!Residue 209 (67)
assign ( segid "fSH2" and resid 67 and name ha  )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 67 and name hb1 )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 67 and name hb2 )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 3.5

!Residue 210 (68)
assign ( segid "fSH2" and resid 68 and name ha* )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5 !2.7
assign ( segid "fSH2" and resid 68 and name hb* )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 2.7

!Residue 211 (69)
assign ( segid "fSH2" and resid 69 and name ha1 )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 2.7

!Residue 212 (70)
assign ( segid "fSH2" and resid 70 and name ha1 )( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 2.7

!Residue 213 (71)
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name ha  )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hb2 )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 3.5

!Residue 214 (72)
assign ( segid "fSH2" and resid 72 and name hd* )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 72 and name he* )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name ha  )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 72 and name ha  )( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hb1 )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb2 )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0


!Residue 215 (73)
assign ( segid "fSH2" and resid 73 and name ha  )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hb* )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hg2*)( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0

!Residue 216 (74)
assign ( segid "fSH2" and resid 74 and name ha  )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 74 and name hb* )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 74 and name hg2*)( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 3.5

!Residue 217 (75)
assign ( segid "fSH2" and resid 75 and name hb* )( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name ha  )( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 75 and name hg2*)( segid "fSH2" and resid 75 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 75 and name hg2*)( segid "fSH2" and resid 75 and name hb  ) 0.0 1.8 2.7

!Residue 218 (76)
assign ( segid "fSH2" and resid 76 and name ha  )( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 76 and name hd* )( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 5.0

!Residue 219 (77)
assign ( segid "fSH2" and resid 77 and name ha  )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 77 and name hb* )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 2.7

!Residue 220 (78)
assign ( segid "fSH2" and resid 78 and name ha  )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 78 and name hg1 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 78 and name hg2 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 78 and name hg2 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 78 and name hg1 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 78 and name hb1 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 78 and name hb2 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 78 and name hb2 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 78 and name hb1 )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5

!Residue 221 (79)
assign ( segid "fSH2" and resid 79 and name hd* )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 79 and name ha  )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 79 and name ha  )( segid "fSH2" and resid 79 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 79 and name hb* )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 79 and name he* )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0

!Residue 222 (80)
assign ( segid "fSH2" and resid 80 and name ha  )( segid "fSH2" and resid 80 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 80 and name hg1*)( segid "fSH2" and resid 80 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 80 and name hg2*)( segid "fSH2" and resid 80 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 80 and name hb* )( segid "fSH2" and resid 80 and name hn  ) 0.0 1.8 2.7

!Residue 223 (81)
assign ( segid "fSH2" and resid 81 and name ha  )( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hb  )( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 81 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 81 and name hg2*) 0.0 1.8 5.0

!Residue 224 (82)
assign ( segid "fSH2" and resid 82 and name ha  )( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hb* )( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 82 and name hg  )( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 82 and name hd2*)( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 82 and name hd1*)( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hd1*)( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hd2*)( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0

!Residue 225 (83)
assign ( segid "fSH2" and resid 83 and name ha  )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 83 and name hg* )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 83 and name hb* )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 3.5

!Residue 226 (84)
assign ( segid "fSH2" and resid 84 and name he21)( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 84 and name ha  )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name hg* )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name hb* )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5

!Residue 227 (85)
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hg* )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0 !3.5 cannot be satisfied


!Residue 228 (86)

!Residue 229 (87)
assign ( segid "fSH2" and resid 87 and name ha  )( segid "fSH2" and resid 87 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 87 and name hg* )( segid "fSH2" and resid 87 and name hn  ) 0.0 1.8 5.0

!Residue 230 (88)
assign ( segid "fSH2" and resid 88 and name ha  )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 88 and name hb1 )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 88 and name hb2 )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 2.7

!Residue 231 (89)
assign ( segid "fSH2" and resid 89 and name ha  )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name hb1 )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name hb2 )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 5.0

!Residue 232 (90)
assign ( segid "fSH2" and resid 90 and name ha  )( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 90 and name hb1 )( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 90 and name hb2 )( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 3.5

!Residue 233 (91)
assign ( segid "fSH2" and resid 91 and name ha  )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 91 and name hg1 )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 91 and name hg2 )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 91 and name hb* )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 2.7

!Residue 234 (92)
assign ( segid "fSH2" and resid 92 and name ha* )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 92 and name hb1 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 92 and name hb2 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0 !3.5 olp
!assign ( segid "fSH2" and resid 92 and name hg1 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 92 and name hg2 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hg2 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hg1 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 92 and name hd* )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0

!Residue 235 (93)
assign ( segid "fSH2" and resid 93 and name ha* )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 2.7

!Residue 236 (94)
assign ( segid "fSH2" and resid 94 and name ha* )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 2.7

!Residue 237 (95)
assign ( segid "fSH2" and resid 95 and name ha2 )( segid "fSH2" and resid 95 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 95 and name ha1 )( segid "fSH2" and resid 95 and name hn  ) 0.0 1.8 3.5

!Residue 238 (96)
assign ( segid "fSH2" and resid 96 and name ha  )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 96 and name ha  )( segid "fSH2" and resid 96 and name hd1*) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 96 and name ha  )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name ha  )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name ha  )( segid "fSH2" and resid 96 and name hd1*) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 96 and name hb* )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 96 and name hg  )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5


!Residue 239 (97)
assign ( segid "fSH2" and resid 97 and name ha  )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 97 and name hb* )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 3.5

!Residue 240 (98)
assign ( segid "fSH2" and resid 98 and name ha  )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 98 and name hb1 )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 98 and name hb2 )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0

!Residue 241 (99)
assign ( segid "fSH2" and resid 99 and name ha  )( segid "fSH2" and resid 99 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 99 and name hn  )( segid "fSH2" and resid 99 and name hd* ) 0.0 1.8 5.0

!Residue 242 (100)
assign ( segid "fSH2" and resid 100 and name ha  )( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 100 and name ha  )( segid "fSH2" and resid 100 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 100 and name hg  )( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 100 and name hd1*)( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 100 and name hd2*)( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 3.5

!Residue 243 (101)
assign ( segid "fSH2" and resid 101 and name ha  )( segid "fSH2" and resid 101 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 101 and name hb* )( segid "fSH2" and resid 101 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 101 and name hg1*)( segid "fSH2" and resid 101 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 101 and name hg2*)( segid "fSH2" and resid 101 and name hn  ) 0.0 1.8 3.5

!Residue 244 (102)
assign ( segid "fSH2" and resid 102 and name hb* )( segid "fSH2" and resid 102 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 102 and name hg2*)( segid "fSH2" and resid 102 and name hn  ) 0.0 1.8 5.0

!Residue 245 (103)

!Residue 246 (104)
assign ( segid "fSH2" and resid 104 and name ha  )( segid "fSH2" and resid 104 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 104 and name hb1 )( segid "fSH2" and resid 104 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 104 and name hb2 )( segid "fSH2" and resid 104 and name hn  ) 0.0 1.8 3.5

!Residue 247 (105)
assign ( segid "fSH2" and resid 105 and name hd2 )( segid "fSH2" and resid 105 and name hn  ) 0.0 1.8 3.5

!Residue 248 (106)
assign ( segid "fSH2" and resid 106 and name ha  )( segid "fSH2" and resid 106 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 106 and name hb1 )( segid "fSH2" and resid 106 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 106 and name hb2 )( segid "fSH2" and resid 106 and name hn  ) 0.0 1.8 3.5

!SEQUENTIAL NOES

!Residue 143 (1)

!Residue 144 (2)
assign ( segid "fSH2" and resid 2 and name ha  )( segid "fSH2" and resid 3 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 3 and name hn  ) 0.0 1.8 5.0

!Residue 145 (3)
assign ( segid "fSH2" and resid 3 and name ha  )( segid "fSH2" and resid 4 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 3 and name hb2 )( segid "fSH2" and resid 4 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 3 and name hb1 )( segid "fSH2" and resid 4 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 3 and name ha  )( segid "fSH2" and resid 4 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 3 and name hn  )( segid "fSH2" and resid 4 and name hn* ) 0.0 1.8 3.5

!Residue 146 (4)
assign ( segid "fSH2" and resid 4 and name ha* )( segid "fSH2" and resid 5 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 4 and name hb* )( segid "fSH2" and resid 5 and name hn* ) 0.0 1.8 3.5

!Residue 147 (5)
assign ( segid "fSH2" and resid 5 and name ha* )( segid "fSH2" and resid 6 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 5 and name hn* )( segid "fSH2" and resid 6 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 5 and name hb* )( segid "fSH2" and resid 6 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 5 and name hg2*)( segid "fSH2" and resid 6 and name hn* ) 0.0 1.8 5.0

!Residue 148 (6)
assign ( segid "fSH2" and resid 6 and name hn* )( segid "fSH2" and resid 7 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 6 and name hn* )( segid "fSH2" and resid 7 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 6 and name ha* )( segid "fSH2" and resid 7 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 6 and name hb* )( segid "fSH2" and resid 7 and name hn* ) 0.0 1.8 3.5

!Residue 149 (7)
assign ( segid "fSH2" and resid 7 and name hn  )( segid "fSH2" and resid 8 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hn  )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 7 and name hb2 )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hb1 )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 7 and name ha  )( segid "fSH2" and resid 8 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 8 and name hd* ) 0.0 1.8 3.5

!Residue 150 (8)
assign ( segid "fSH2" and resid 8 and name hn  )( segid "fSH2" and resid 9 and name hd*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 9 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 9 and name ha ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name ha  )( segid "fSH2" and resid 9 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 8 and name hb2 )( segid "fSH2" and resid 9 and name hn ) 0.0 1.8 5.0

!Residue 151 (9)
assign ( segid "fSH2" and resid 9 and name hn* )( segid "fSH2" and resid 10 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name ha* )( segid "fSH2" and resid 10 and name hn* ) 0.0 1.8 3.5

!Residue 152 (10)
assign ( segid "fSH2" and resid 10 and name hn* )( segid "fSH2" and resid 11 and name hn* ) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 10 and name hn* )( segid "fSH2" and resid 11 and name hg* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 10 and name ha1* )( segid "fSH2" and resid 11 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 10 and name ha2* )( segid "fSH2" and resid 11 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 10 and name ha2* )( segid "fSH2" and resid 11 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 10 and name ha1* )( segid "fSH2" and resid 11 and name hn* ) 0.0 1.8 3.5

!Residue 153 (11)
assign ( segid "fSH2" and resid 11 and name hn* )( segid "fSH2" and resid 12 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 11 and name hn* )( segid "fSH2" and resid 12 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 11 and name hn* )( segid "fSH2" and resid 12 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 11 and name ha* )( segid "fSH2" and resid 12 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 11 and name hb* )( segid "fSH2" and resid 12 and name hn* ) 0.0 1.8 5.0

!Residue 154 (12)
assign ( segid "fSH2" and resid 12 and name hn* )( segid "fSH2" and resid 13 and name hn ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 12 and name hn* )( segid "fSH2" and resid 13 and name ha2 ) 0.0 1.8 5.0 !v.w.
!assign ( segid "fSH2" and resid 12 and name hn* )( segid "fSH2" and resid 13 and name ha1 ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 12 and name ha* )( segid "fSH2" and resid 13 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 12 and name hg* )( segid "fSH2" and resid 13 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hb* )( segid "fSH2" and resid 13 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hd1*)( segid "fSH2" and resid 13 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 12 and name hd2*)( segid "fSH2" and resid 13 and name hn ) 0.0 1.8 3.5


!Residue 155 (13)
assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 13 and name ha1* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 13 and name ha2* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 13 and name ha2* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 13 and name ha1* )( segid "fSH2" and resid 14 and name hn* ) 0.0 1.8 3.5


!Residue 156 (14)
assign ( segid "fSH2" and resid 14 and name hn* )( segid "fSH2" and resid 15 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 14 and name ha* )( segid "fSH2" and resid 15 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 14 and name hb* )( segid "fSH2" and resid 15 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 14 and name hd* )( segid "fSH2" and resid 15 and name hn* ) 0.0 1.8 3.5

!Residue 157 (15)
assign ( segid "fSH2" and resid 15 and name hn* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 15 and name hn* )( segid "fSH2" and resid 16 and name ha* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 15 and name hn* )( segid "fSH2" and resid 16 and name hb1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 15 and name hn* )( segid "fSH2" and resid 16 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 15 and name hn* )( segid "fSH2" and resid 16 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 15 and name hn* )( segid "fSH2" and resid 16 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 15 and name ha* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 15 and name hb* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 2.7

!Residue 158 (16)
assign ( segid "fSH2" and resid 16 and name hn* )( segid "fSH2" and resid 17 and name ha* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 16 and name hn* )( segid "fSH2" and resid 17 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 16 and name hn* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 16 and name hb1* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 16 and name hb2* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 16 and name hb2* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 16 and name hb1* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 3.5

!Residue 159 (17)
assign ( segid "fSH2" and resid 17 and name hn* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 17 and name ha* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 17 and name hb* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 17 and name hb* )( segid "fSH2" and resid 18 and name hg* ) 0.0 1.8 5.0


!Residue 160 (18)
assign ( segid "fSH2" and resid 18 and name hn* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 18 and name hg1* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 18 and name hg2* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 18 and name hg2* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hg1* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5

assign ( segid "fSH2" and resid 18 and name ha* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hb* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5

!Residue 161 (19)
assign ( segid "fSH2" and resid 19 and name hn* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 19 and name ha* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 19 and name hb* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 19 and name hg* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 19 and name hd* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 5.0

!Residue 162 (20)
assign ( segid "fSH2" and resid 20 and name hn* )( segid "fSH2" and resid 21 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 20 and name hb* )( segid "fSH2" and resid 21 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 20 and name hg* )( segid "fSH2" and resid 21 and name hn* ) 0.0 1.8 5.0

!Residue 163 (21)
assign ( segid "fSH2" and resid 21 and name ha* )( segid "fSH2" and resid 22 and name hn* ) 0.0 1.8 3.5

!Residue 164 (22)
assign ( segid "fSH2" and resid 22 and name hn* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 22 and name hg* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd1* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name ha* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 5.0

!Residue 165 (23)

!Residue 166 (24)
assign ( segid "fSH2" and resid 24 and name hb1 )( segid "fSH2" and resid 25 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name hb2 )( segid "fSH2" and resid 25 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name hd* )( segid "fSH2" and resid 25 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 24 and name ha )( segid "fSH2" and resid 25 and name hn* ) 0.0 1.8 3.5

!Residue 167 (25)
assign ( segid "fSH2" and resid 25 and name hn*  )( segid "fSH2" and resid 26 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 25 and name ha1* )( segid "fSH2" and resid 26 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 25 and name ha2* )( segid "fSH2" and resid 26 and name hn* ) 0.0 1.8 3.5

!Residue 168 (26)

!Residue 169 (27)
assign ( segid "fSH2" and resid 27 and name ha  )( segid "fSH2" and resid 28 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 27 and name hb* )( segid "fSH2" and resid 28 and name hn* ) 0.0 1.8 3.5

!Residue 170 (28)
assign ( segid "fSH2" and resid 28 and name hn* )( segid "fSH2" and resid 29 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 28 and name ha  )( segid "fSH2" and resid 29 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 28 and name hb* )( segid "fSH2" and resid 29 and name hn ) 0.0 1.8 3.5

!Residue 171 (29)
assign ( segid "fSH2" and resid 29 and name hn )( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 29 and name hn )( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 29 and name ha1 )( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 29 and name ha2 )( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 3.5

!Residue 172 (30)
assign ( segid "fSH2" and resid 30 and name ha* )( segid "fSH2" and resid 31 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hb* )( segid "fSH2" and resid 31 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hg1 )( segid "fSH2" and resid 31 and name hn ) 0.0 1.8 5.0

!Residue 173 (31)
assign ( segid "fSH2" and resid 31 and name hn* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name ha  )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 31 and name hb1* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name hb2* )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name hd*  )( segid "fSH2" and resid 32 and name hn* ) 0.0 1.8 5.0

!Residue 174 (32)
assign ( segid "fSH2" and resid 32 and name hn* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 32 and name hd1* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 32 and name hd2* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0

!Residue 175 (33)
assign ( segid "fSH2" and resid 33 and name ha* )( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 33 and name hb* )( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name hg1*)( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name hg2*)( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name hd1*)( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name hn* )( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0

!Residue 176 (34)
assign ( segid "fSH2" and resid 34 and name hn* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 34 and name ha* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 2.7

!Residue 177 (35)
assign ( segid "fSH2" and resid 35 and name hn* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name ha* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 35 and name hg* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 35 and name hb1* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name hb2* )( segid "fSH2" and resid 36 and name hn* ) 0.0 1.8 5.0

!Residue 178 (36)
assign ( segid "fSH2" and resid 36 and name ha* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0

!Residue 179 (37)
assign ( segid "fSH2" and resid 37 and name hn* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 37 and name ha* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 37 and name hg* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 37 and name hb* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 3.5

!Residue 180 (38)
assign ( segid "fSH2" and resid 38 and name hn  )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 38 and name ha  )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 38 and name hb  )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 38 and name hg2*)( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5


!Residue 181 (39)
assign ( segid "fSH2" and resid 39 and name hn* )( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 39 and name ha* )( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 39 and name hb* )( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 39 and name hg2*)( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 2.7

!Residue 182 (40)
assign ( segid "fSH2" and resid 40 and name ha  )( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 40 and name hn* )( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 40 and name hb* )( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 40 and name hg* )( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 40 and name ha* )( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 3.5

!Residue 183 (41)
assign ( segid "fSH2" and resid 41 and name hn*  )( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 41 and name ha2* )( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 2.7

!Residue 184 (42)
assign ( segid "fSH2" and resid 42 and name hn* )( segid "fSH2" and resid 43 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 42 and name hn* )( segid "fSH2" and resid 43 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 42 and name ha* )( segid "fSH2" and resid 43 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 42 and name hb* )( segid "fSH2" and resid 43 and name hn* ) 0.0 1.8 2.7

!Residue 185 (43)
assign ( segid "fSH2" and resid 43 and name hn   )( segid "fSH2" and resid 44 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name ha   )( segid "fSH2" and resid 44 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 43 and name hb1  )( segid "fSH2" and resid 44 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name hb2  )( segid "fSH2" and resid 44 and name hn* ) 0.0 1.8 5.0

!Residue 186 (44)
assign ( segid "fSH2" and resid 44 and name ha   )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 44 and name hb1  )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 44 and name hb2  )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 5.0

!Residue 187 (45)
assign ( segid "fSH2" and resid 45 and name ha* )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 45 and name hb* )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hg  )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd1*)( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.

!Residue 188 (46)
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 46 and name hb2 )( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 46 and name hb1 )( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 3.5

!Residue 189 (47)
assign ( segid "fSH2" and resid 47 and name ha* )( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hd1*)( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 5.0

!Residue 190 (48)
assign ( segid "fSH2" and resid 48 and name hn* )( segid "fSH2" and resid 49 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 48 and name ha* )( segid "fSH2" and resid 49 and name hn* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 48 and name hd* )( segid "fSH2" and resid 49 and name hn* ) 0.0 1.8 3.5

!Residue 191 (49)
assign ( segid "fSH2" and resid 49 and name ha* )( segid "fSH2" and resid 50 and name hn* ) 0.0 1.8 2.7

!Residue 192 (50)
assign ( segid "fSH2" and resid 50 and name hn  )( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name he1*)( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 50 and name hb1 )( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hb2 )( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hz3 )( segid "fSH2" and resid 51 and name hn  ) 0.0 1.8 5.0 !3.5 ~4 

!Residue 193 (51)
assign ( segid "fSH2" and resid 51 and name hn  )( segid "fSH2" and resid 52 and name hn  ) 0.0 1.8 5.0

!Residue 194 (52)
assign ( segid "fSH2" and resid 52 and name hn  )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 52 and name hn  )( segid "fSH2" and resid 53 and name he* ) 0.0 1.8 5.0

!Residue 195 (53)
assign ( segid "fSH2" and resid 53 and name hn  )( segid "fSH2" and resid 54 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 53 and name hn  )( segid "fSH2" and resid 54 and name ha ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name hn  )( segid "fSH2" and resid 54 and name hg*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name ha  )( segid "fSH2" and resid 54 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 53 and name hb1 )( segid "fSH2" and resid 54 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name hb2 )( segid "fSH2" and resid 54 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name he* )( segid "fSH2" and resid 54 and name hn ) 0.0 1.8 3.5

!Residue 196 (54)
assign ( segid "fSH2" and resid 54 and name hn  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 54 and name hn  )( segid "fSH2" and resid 55 and name ha2 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 54 and name hn  )( segid "fSH2" and resid 55 and name ha1 ) 0.0 1.8 5.0 !3.5 m.c.

assign ( segid "fSH2" and resid 54 and name hg* )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 54 and name ha  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 3.5

!Residue 197 (55)
assign ( segid "fSH2" and resid 55 and name hn  )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 55 and name ha1 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 55 and name ha2 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 55 and name ha2 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 55 and name ha1 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 3.5


!Residue 198 (56)
assign ( segid "fSH2" and resid 56 and name hn  )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 56 and name ha  )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 56 and name hb1 )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 56 and name hb2 )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 3.5

!Residue 199 (57)
assign ( segid "fSH2" and resid 57 and name hb1 )( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 57 and name hb2 )( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 57 and name hn  )( segid "fSH2" and resid 58 and name hg1*) 0.0 1.8 5.0

!Residue 200 (58)
assign ( segid "fSH2" and resid 58 and name ha  )( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 58 and name hg1*)( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 58 and name hg2*)( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.

!Residue 201 (59)
assign ( segid "fSH2" and resid 59 and name ha  )( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 2.7

!Residue 202 (60)
assign ( segid "fSH2" and resid 60 and name hn  )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 60 and name hn  )( segid "fSH2" and resid 61 and name hb* ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 60 and name ha  )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 60 and name hb2 )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 60 and name hb1 )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 3.5

!Residue 203 (61)
assign ( segid "fSH2" and resid 61 and name hn  )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 61 and name ha  )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 61 and name hb* )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0

!Residue 204 (62)
assign ( segid "fSH2" and resid 62 and name hn  )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 62 and name ha  )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 3.5

!Residue 205 (63)
assign ( segid "fSH2" and resid 63 and name hn  )( segid "fSH2" and resid 64 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name ha  )( segid "fSH2" and resid 64 and name hn  ) 0.0 1.8 2.7

!Residue 206 (64)
assign ( segid "fSH2" and resid 64 and name hn  )( segid "fSH2" and resid 65 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 64 and name ha  )( segid "fSH2" and resid 65 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 64 and name hd* )( segid "fSH2" and resid 65 and name hn  ) 0.0 1.8 3.5

!Residue 207 (65)
assign ( segid "fSH2" and resid 65 and name hn  )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 65 and name hn  )( segid "fSH2" and resid 66 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name hn  )( segid "fSH2" and resid 66 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name ha  )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 65 and name hg1 )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name hg2 )( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 5.0

!Residue 208 (66)
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name ha  )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 66 and name hb* )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hg  )( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd1*)( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 67 and name hn  ) 0.0 1.8 5.0

!Residue 209 (67)
assign ( segid "fSH2" and resid 67 and name hn  )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 67 and name hn  )( segid "fSH2" and resid 68 and name hd21) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 67 and name hn  )( segid "fSH2" and resid 68 and name ha  ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 67 and name ha  )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 67 and name hb1 )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 67 and name hb2 )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5

!Residue 210 (68)
assign ( segid "fSH2" and resid 68 and name hn  )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 68 and name hn  )( segid "fSH2" and resid 69 and name ha1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 68 and name hn  )( segid "fSH2" and resid 69 and name ha2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 68 and name ha  )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 3.5 
assign ( segid "fSH2" and resid 68 and name hb* )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.

!Residue 211 (69)
assign ( segid "fSH2" and resid 69 and name hn  )( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 69 and name ha1 )( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 2.7

!Residue 212 (70)
assign ( segid "fSH2" and resid 70 and name hn  )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 70 and name hn  )( segid "fSH2" and resid 71 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 70 and name ha1 )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 2.7

!Residue 213 (71)
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name ha  )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 71 and name ha  )( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name ha  )( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hb1 )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hb2 )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0

!Residue 214 (72)
assign ( segid "fSH2" and resid 72 and name hn  )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hn  )( segid "fSH2" and resid 73 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hd* )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name ha  )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 72 and name hb1 )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hb2 )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb2 )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb1 )( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0


!Residue 215 (73)
assign ( segid "fSH2" and resid 73 and name hn  )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 73 and name ha  )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name ha  )( segid "fSH2" and resid 74 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hb* )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 73 and name hg1*)( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hg2*)( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hg2*)( segid "fSH2" and resid 74 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0

!Residue 216 (74)
assign ( segid "fSH2" and resid 74 and name ha  )( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 74 and name hb* )( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 74 and name hg2*)( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 5.0

!Residue 217 (75)
assign ( segid "fSH2" and resid 75 and name hn  )( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 75 and name hg2*)( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name ha  )( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 3.5

!Residue 218 (76)
assign ( segid "fSH2" and resid 76 and name hn  )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 76 and name hn  )( segid "fSH2" and resid 77 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 76 and name ha  )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 3.5

!Residue 219 (77)
assign ( segid "fSH2" and resid 77 and name hn  )( segid "fSH2" and resid 78 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 77 and name ha  )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 77 and name hb* )( segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 3.5

!Residue 220 (78)
assign ( segid "fSH2" and resid 78 and name hn  )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 78 and name ha  )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 78 and name ha  )( segid "fSH2" and resid 79 and name hd*) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 78 and name hg1 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 78 and name hg2 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 78 and name hg2 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 78 and name hg1 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 78 and name hb1 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 78 and name hb2 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 78 and name hb2 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 78 and name hb1 )( segid "fSH2" and resid 79 and name hn ) 0.0 1.8 3.5

!Residue 221 (79)
assign ( segid "fSH2" and resid 79 and name hd* )( segid "fSH2" and resid 80 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 79 and name ha  )( segid "fSH2" and resid 80 and name hn ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 79 and name hn  )( segid "fSH2" and resid 80 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hb* )( segid "fSH2" and resid 80 and name hn ) 0.0 1.8 3.5

!Residue 222 (80)
assign ( segid "fSH2" and resid 80 and name hn  )( segid "fSH2" and resid 81 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 80 and name ha  )( segid "fSH2" and resid 81 and name hn ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 80 and name hg1 )( segid "fSH2" and resid 81 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 80 and name hg2 )( segid "fSH2" and resid 81 and name hn ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 80 and name hb* )( segid "fSH2" and resid 81 and name hn ) 0.0 1.8 3.5

!Residue 223 (81)
assign ( segid "fSH2" and resid 81 and name hn  )( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name ha  )( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 82 and name hn  ) 0.0 1.8 5.0

!Residue 224 (82)
assign ( segid "fSH2" and resid 82 and name hn  )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 82 and name hn  )( segid "fSH2" and resid 83 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name ha  )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hb* )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 82 and name hg  )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 82 and name hd1*)( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 82 and name hd2*)( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hd2*)( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hd1*)( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0

!Residue 225 (83)
assign ( segid "fSH2" and resid 83 and name hn  )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 83 and name ha  )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5

!Residue 226 (84)
assign ( segid "fSH2" and resid 84 and name hn  )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name ha  )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name hb* )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name hg* )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0

!Residue 227 (85)
assign ( segid "fSH2" and resid 85 and name hn  )( segid "fSH2" and resid 86 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hn  )( segid "fSH2" and resid 86 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hn  )( segid "fSH2" and resid 86 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 86 and name hg1*) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 86 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 86 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 86 and name hb  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 86 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 86 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 86 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 86 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 86 and name hg2*) 0.0 1.8 5.0


!Residue 228 (86)

!Residue 229 (87)
assign ( segid "fSH2" and resid 87 and name ha  )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 87 and name hg* )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 87 and name hb1 )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 87 and name hb2 )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 3.5

!Residue 230 (88)
assign ( segid "fSH2" and resid 88 and name hn  )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 88 and name hn  )( segid "fSH2" and resid 89 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 88 and name hn  )( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 88 and name ha  )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 88 and name hb2 )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 88 and name hb1 )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5

!Residue 231 (89)
assign ( segid "fSH2" and resid 89 and name hn  )( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name hb1*)( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name hb2*)( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name ha  )( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 3.5

!Residue 232 (90)
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 91 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 91 and name hg1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 91 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name ha  )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 90 and name hb1 )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 90 and name hb2 )( segid "fSH2" and resid 91 and name hn  ) 0.0 1.8 3.5

!Residue 233 (91)
assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 92 and name hb2 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 92 and name hg1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 92 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 92 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 92 and name hg1 ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 91 and name ha  )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 91 and name hb* )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 91 and name hg1 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 91 and name hg2 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0

!Residue 234 (92)
assign ( segid "fSH2" and resid 92 and name hn  )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name ha  )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 92 and name ha  )( segid "fSH2" and resid 93 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hb1 )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 92 and name hb2 )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 92 and name hg1 )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hg2 )( segid "fSH2" and resid 93 and name hn  ) 0.0 1.8 5.0


!Residue 235 (93)
assign ( segid "fSH2" and resid 93 and name hn  )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 93 and name ha  )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid 94 and name ha  ) 0.0 1.8 5.0

!Residue 236 (94)
assign ( segid "fSH2" and resid 94 and name hn  )( segid "fSH2" and resid 95 and name ha1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 94 and name hn  )( segid "fSH2" and resid 95 and name ha2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 94 and name ha  )( segid "fSH2" and resid 95 and name hn  ) 0.0 1.8 3.5

!Residue 237 (95)
assign ( segid "fSH2" and resid 95 and name hn  )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 95 and name hn  )( segid "fSH2" and resid 96 and name hg  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 95 and name ha1 )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 95 and name ha2 )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 3.5

!Residue 238 (96)
assign ( segid "fSH2" and resid 96 and name hn  )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name hb* )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name hg  )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name ha  )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 3.5

!Residue 239 (97)
assign ( segid "fSH2" and resid 97 and name hn  )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 97 and name ha  )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 97 and name hb* )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0

!Residue 240 (98)
assign ( segid "fSH2" and resid 98 and name hn  )( segid "fSH2" and resid 99 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 98 and name ha  )( segid "fSH2" and resid 99 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 98 and name hb1 )( segid "fSH2" and resid 99 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 98 and name hb2 )( segid "fSH2" and resid 99 and name hn  ) 0.0 1.8 5.0

!Residue 241 (99)
!assign ( segid "fSH2" and resid 99 and name hn  )( segid "fSH2" and resid 100 and name hg  ) 0.0 1.8 5.0 !rm olp
assign ( segid "fSH2" and resid 99 and name ha  )( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 99 and name hb* )( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 5.0

!Residue 242 (100)

!Residue 243 (101)
assign ( segid "fSH2" and resid 101 and name ha  )( segid "fSH2" and resid 102 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 101 and name ha  )( segid "fSH2" and resid 102 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 101 and name hb* )( segid "fSH2" and resid 102 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 101 and name hg1*)( segid "fSH2" and resid 102 and name hn  ) 0.0 1.8 5.0

!Residue 244 (102)

!Residue 245 (103)
assign ( segid "fSH2" and resid 103 and name ha  )( segid "fSH2" and resid 104 and name hn  ) 0.0 1.8 5.0

!Residue 246 (104)
assign ( segid "fSH2" and resid 104 and name ha  )( segid "fSH2" and resid 105 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 104 and name hb2 )( segid "fSH2" and resid 105 and name hn  ) 0.0 1.8 5.0

!Residue 247 (105)
assign ( segid "fSH2" and resid 105 and name hn  )( segid "fSH2" and resid 106 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 105 and name hd2 )( segid "fSH2" and resid 106 and name hn  ) 0.0 1.8 3.5

!Residue 248 (106)

!MEDIUM RANGE NOES

!Residue 143 (1)

!Residue 144 (2)
assign ( segid "fSH2" and resid 2 and name ha  )( segid "fSH2" and resid 7 and name hh2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 7 and name hh2 ) 0.0 1.8 5.0

!Residue 145 (3)
assign ( segid "fSH2" and resid 3 and name hn  )( segid "fSH2" and resid 7 and name hh2 ) 0.0 1.8 3.5

!Residue 146 (4)
assign ( segid "fSH2" and resid 4 and name hb* )( segid "fSH2" and resid 8 and name hd* ) 0.0 1.8 5.0

!Residue 147 (5)
!assign ( segid "fSH2" and resid 5 and name hn  )( segid "fSH2" and resid 8 and name hb2 ) 0.0 1.8 5.0 !v.w.

!Residue 148 (6)
assign ( segid "fSH2" and resid 6 and name ha* )( segid "fSH2" and resid 8 and name hn* ) 0.0 1.8 5.0

!Residue 149 (7)
assign ( segid "fSH2" and resid 7 and name hn  )( segid "fSH2" and resid 9 and name hd* ) 0.0 1.8 5.0

!Residue 150 (8)
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 10 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 10 and name hn* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 10 and name ha1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 10 and name ha2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 10 and name ha2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 10 and name ha1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hb2 )( segid "fSH2" and resid 10 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 11 and name hn* ) 0.0 1.8 5.0

!Residue 151 (9)
assign ( segid "fSH2" and resid 9 and name hn* )( segid "fSH2" and resid 12 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hb1 )( segid "fSH2" and resid 12 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hb1 )( segid "fSH2" and resid 12 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hb2 )( segid "fSH2" and resid 12 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hd* )( segid "fSH2" and resid 12 and name hd2* ) 0.0 1.8 2.7

!Residue 152 (10)
!assign ( segid "fSH2" and resid 10 and name ha1* )( segid "fSH2" and resid 12 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 10 and name ha2* )( segid "fSH2" and resid 12 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 10 and name hn   )( segid "fSH2" and resid 12 and name hd2*) 0.0 1.8 5.0

!Residue 153 (11)

!Residue 154 (12)
!assign ( segid "fSH2" and resid 12 and name hg   )( segid "fSH2" and resid 16 and name hb1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 12 and name hg   )( segid "fSH2" and resid 16 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hg   )( segid "fSH2" and resid 16 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hg   )( segid "fSH2" and resid 16 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hd1* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 3.5	
!assign ( segid "fSH2" and resid 12 and name hd1* )( segid "fSH2" and resid 16 and name hb1 ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 12 and name hd1* )( segid "fSH2" and resid 16 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hd1* )( segid "fSH2" and resid 16 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hd1* )( segid "fSH2" and resid 16 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hd2* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 5.0	

!Residue 155 (13)
!assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 16 and name hb1* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 16 and name hb2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 16 and name hb2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 16 and name hb1* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 13 and name hn* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 5.0

!Residue 156 (14)
assign ( segid "fSH2" and resid 14 and name hn* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name hn* )( segid "fSH2" and resid 17 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name ha* )( segid "fSH2" and resid 16 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name ha* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name ha* )( segid "fSH2" and resid 17 and name hb* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 14 and name hb* )( segid "fSH2" and resid 18 and name hg* ) 0.0 1.8 5.0

!Residue 157 (15)
assign ( segid "fSH2" and resid 15 and name ha* )( segid "fSH2" and resid 17 and name hn* ) 0.0 1.8 5.0

!Residue 158 (16)
assign ( segid "fSH2" and resid 16 and name hn  )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 18 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 19 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 19 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 16 and name ha* )( segid "fSH2" and resid 20 and name hn* ) 0.0 1.8 5.0

!Residue 159 (17)
assign ( segid "fSH2" and resid 17 and name hn* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 17 and name hb* )( segid "fSH2" and resid 19 and name hn* ) 0.0 1.8 5.0

!Residue 160 (18)
assign ( segid "fSH2" and resid 18 and name hb* )( segid "fSH2" and resid 22 and name hn* ) 0.0 1.8 5.0

!Residue 161 (19)
assign ( segid "fSH2" and resid 19 and name hn* )( segid "fSH2" and resid 21 and name hn* ) 0.0 1.8 5.0

!Residue 162 (20)
assign ( segid "fSH2" and resid 20 and name hn* )( segid "fSH2" and resid 22 and name hn* ) 0.0 1.8 5.0

!Residue 163 (21)
assign ( segid "fSH2" and resid 21 and name hn* )( segid "fSH2" and resid 23 and name hn* ) 0.0 1.8 5.0

!Residue 164 (22)

!Residue 165 (23)

!Residue 166 (24)
assign ( segid "fSH2" and resid 24 and name ha* )( segid "fSH2" and resid 26 and name hn* ) 0.0 1.8 5.0

!Residue 167 (25)

!Residue 168 (26)
assign ( segid "fSH2" and resid 26 and name ha  )( segid "fSH2" and resid 30 and name hg2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 26 and name hn  )( segid "fSH2" and resid 30 and name hg2* ) 0.0 1.8 5.0

!Residue 169 (27)

!Residue 170 (28)

!Residue 171 (29)

!Residue 172 (30)

!Residue 173 (31)

!Residue 174 (32)

!Residue 175 (33)

!Residue 176 (34)

!Residue 177 (35)

!Residue 178 (36)
!assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hb2* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 36 and name hb1* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 3.5

assign ( segid "fSH2" and resid 36 and name ha* )( segid "fSH2" and resid 38 and name hn* ) 0.0 1.8 5.0

!Residue 179 (37)
assign ( segid "fSH2" and resid 37 and name hn* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 37 and name hb* )( segid "fSH2" and resid 39 and name hn* ) 0.0 1.8 5.0

!Residue 180 (38)
assign ( segid "fSH2" and resid 38 and name hn* )( segid "fSH2" and resid 41 and name ha2*) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 38 and name hg2*)( segid "fSH2" and resid 40 and name hn* ) 0.0 1.8 5.0		
assign ( segid "fSH2" and resid 38 and name hg2*)( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 5.0		

!Residue 181 (39)
assign ( segid "fSH2" and resid 39 and name hn* )( segid "fSH2" and resid 42 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 39 and name hg2*)( segid "fSH2" and resid 41 and name hn* ) 0.0 1.8 5.0		
assign ( segid "fSH2" and resid 39 and name hg2*)( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 2.7

!Residue 182 (40)
assign ( segid "fSH2" and resid 40 and name hn  )( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 40 and name hb* )( segid "fSH2" and resid 42 and name hn* ) 0.0 1.8 5.0		

!Residue 183 (41)

!Residue 184 (42)

!Residue 185 (43)

!Residue 186 (44)

!Residue 187 (45)

!Residue 188 (46)

!Residue 189 (47)

!Residue 190 (48)

!Residue 191 (49)

!Residue 192 (50)
assign ( segid "fSH2" and resid 50 and name he1 )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 50 and name he3 )( segid "fSH2" and resid 52 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hh2 )( segid "fSH2" and resid 52 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hh2 )( segid "fSH2" and resid 52 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hh2 )( segid "fSH2" and resid 52 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hh2 )( segid "fSH2" and resid 52 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hz2 )( segid "fSH2" and resid 52 and name ha  ) 0.0 1.8 2.7 
assign ( segid "fSH2" and resid 50 and name hz2 )( segid "fSH2" and resid 52 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hz2 )( segid "fSH2" and resid 52 and name hb1 ) 0.0 1.8 5.0 
assign ( segid "fSH2" and resid 50 and name hz2 )( segid "fSH2" and resid 52 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hz3 )( segid "fSH2" and resid 52 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hz3 )( segid "fSH2" and resid 52 and name ha  ) 0.0 1.8 5.0

!Residue 193 (51)
assign ( segid "fSH2" and resid 51 and name hn  )( segid "fSH2" and resid 53 and name hn  ) 0.0 1.8 5.0		
assign ( segid "fSH2" and resid 51 and name hn  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 51 and name hn  )( segid "fSH2" and resid 54 and name hg* ) 0.0 1.8 3.5		
assign ( segid "fSH2" and resid 51 and name hn  )( segid "fSH2" and resid 54 and name hn  ) 0.0 1.8 5.0

!Residue 194 (52)
assign ( segid "fSH2" and resid 52 and name hn  )( segid "fSH2" and resid 54 and name hg* ) 0.0 1.8 5.0		
!assign ( segid "fSH2" and resid 52 and name ha  )( segid "fSH2" and resid 54 and name hn  ) 0.0 1.8 3.5 !olp
!assign ( segid "fSH2" and resid 52 and name ha  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 3.5 !olp

!Residue 195 (53)
assign ( segid "fSH2" and resid 53 and name hn  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 3.5		
!assign ( segid "fSH2" and resid 53 and name hn  )( segid "fSH2" and resid 55 and name ha2 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 53 and name hn  )( segid "fSH2" and resid 55 and name ha1 ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 53 and name ha  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 53 and name he* )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 5.0		

!Residue 196 (54)

!Residue 197 (55)

!Residue 198 (56)

!Residue 199 (57)

!Residue 200 (58)
assign ( segid "fSH2" and resid 58 and name hg1* )( segid "fSH2" and resid 60 and name he1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 58 and name hg2* )( segid "fSH2" and resid 60 and name he1 ) 0.0 1.8 3.5

!Residue 201 (59)

!Residue 202 (60)

!Residue 203 (61)

!Residue 204 (62)

!Residue 205 (63)

!Residue 206 (64)

!Residue 207 (65)
assign ( segid "fSH2" and resid 65 and name hg1 )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name hg2 )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0

!Residue 208 (66)
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 70 and name ha1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 70 and name ha2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name ha  )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hb* )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hg  )( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hg  )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd1*)( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 69 and name ha1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hb* )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 66 and name hd1*)( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hb* )( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 3.5

!Residue 209 (67)
assign ( segid "fSH2" and resid 67 and name hn  )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 67 and name ha  )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 67 and name hb1 )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 67 and name hb2 )( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 5.0	

!Residue 210 (68)
assign ( segid "fSH2" and resid 68 and name hb* )( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 68 and name hd21)( segid "fSH2" and resid 66 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 68 and name hd22)( segid "fSH2" and resid 66 and name hd* ) 0.0 1.8 5.0

!Residue 211 (69)

!Residue 212 (70)

!Residue 213 (71)

!Residue 214 (72)
assign ( segid "fSH2" and resid 72 and name hd* )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0		
assign ( segid "fSH2" and resid 72 and name he* )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0		
!assign ( segid "fSH2" and resid 72 and name hb1 )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb2 )( segid "fSH2" and resid 74 and name hn  ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 72 and name hd* )( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 72 and name hd* )( segid "fSH2" and resid 75 and name hg2*) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 72 and name he* )( segid "fSH2" and resid 75 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 72 and name he* )( segid "fSH2" and resid 75 and name hg2*) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 72 and name hd* )( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 5.0

!Residue 215 (73)

!Residue 216 (74)
assign ( segid "fSH2" and resid 74 and name ha  )( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 74 and name ha  )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 74 and name hg2*)( segid "fSH2" and resid 76 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 74 and name hg2*)( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 3.5

!Residue 217 (75)
assign ( segid "fSH2" and resid 75 and name hn  )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name ha  )( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name ha  )( segid "fSH2" and resid 78 and name he21) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 75 and name ha  )( segid "fSH2" and resid 78 and name he22) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 75 and name hb  )( segid "fSH2" and resid 78 and name he21) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name hb  )( segid "fSH2" and resid 78 and name he22) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name hg2*)( segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0		
assign ( segid "fSH2" and resid 75 and name hg2*)( segid "fSH2" and resid 78 and name he21) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 75 and name hg2*)( segid "fSH2" and resid 78 and name he22) 0.0 1.8 5.0

!Residue 218 (76)

!Residue 219 (77)
assign ( segid "fSH2" and resid 77 and name hb* )( segid "fSH2" and resid 79 and name hz ) 0.0 1.8 3.5

!Residue 220 (78)

!Residue 221 (79)
assign ( segid "fSH2" and resid 79 and name ha  )( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hb* )( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 5.0

!Residue 222 (80)

!Residue 223 (81)
assign ( segid "fSH2" and resid 81 and name hn  )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hn  )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hn  )( segid "fSH2" and resid 84 and name ha  ) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 81 and name hn  )( segid "fSH2" and resid 84 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name ha  )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hb  )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hb  )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 84 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 84 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 84 and name hg1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg2*)( segid "fSH2" and resid 84 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 83 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name hg1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name he21) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 81 and name hg1 )( segid "fSH2" and resid 84 and name he22) 0.0 1.8 5.0

!Residue 224 (82)
assign ( segid "fSH2" and resid 82 and name hn  )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name ha  )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 82 and name hd1*)( segid "fSH2" and resid 85 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 82 and name hd2*)( segid "fSH2" and resid 85 and name hd1*) 0.0 1.8 5.0

!Residue 225 (83)
assign ( segid "fSH2" and resid 83 and name hn  )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 83 and name ha  )( segid "fSH2" and resid 86 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 83 and name ha  )( segid "fSH2" and resid 86 and name hg1*) 0.0 1.8 5.0

!Residue 226 (84)
assign ( segid "fSH2" and resid 84 and name ha  )( segid "fSH2" and resid 87 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name ha  )( segid "fSH2" and resid 87 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 84 and name hn  )( segid "fSH2" and resid 86 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 84 and name hn  )( segid "fSH2" and resid 86 and name hg1*) 0.0 1.8 5.0

!Residue 227 (85)
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 88 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 88 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 89 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name hg* )( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 5.0		
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 89 and name hd* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 5.0 !v.w.
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 3.5 !2.7 m.c.
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 89 and name hd* ) 0.0 1.8 3.5 !2.7 m.c.
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 87 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 87 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 89 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 5.0 !v.w.
!assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 89 and name hd* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 87 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 87 and name hn  ) 0.0 1.8 5.0




!Residue 228 (86)
assign ( segid "fSH2" and resid 86 and name ha  )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 86 and name ha  )( segid "fSH2" and resid 89 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 86 and name hg2*)( segid "fSH2" and resid 88 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 86 and name hg2*)( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 86 and name hg2*)( segid "fSH2" and resid 90 and name hn  ) 0.0 1.8 5.0

!Residue 229 (87)
assign ( segid "fSH2" and resid 87 and name ha  )( segid "fSH2" and resid 89 and name hn  ) 0.0 1.8 5.0

!Residue 230 (88)

!Residue 231 (89)
assign ( segid "fSH2" and resid 89 and name ha  )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 3.5

!Residue 232 (90)
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 90 and name ha  )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 90 and name hb1 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hb2 )( segid "fSH2" and resid 92 and name hn  ) 0.0 1.8 5.0

!Residue 233 (91)

!Residue 234 (92)
assign ( segid "fSH2" and resid 92 and name ha  )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hb1 )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hb2 )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hd* )( segid "fSH2" and resid 94 and name hn  ) 0.0 1.8 5.0

!Residue 235 (93)
!assign ( segid "fSH2" and resid 93 and name ha  )( segid "fSH2" and resid 96 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 93 and name ha  )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 93 and name ha  )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid 96 and name hd1*) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0

!Residue 236 (94)
assign ( segid "fSH2" and resid 94 and name ha  )( segid "fSH2" and resid 96 and name hn  ) 0.0 1.8 5.0

!Residue 237 (95)

!Residue 238 (96)
assign ( segid "fSH2" and resid 96 and name hn  )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0	
assign ( segid "fSH2" and resid 96 and name hb* )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 96 and name hg  )( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 96 and name hg  )( segid "fSH2" and resid 99 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5	
!assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name hd2*)( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 96 and name hd1*)( segid "fSH2" and resid 100 and name hn  ) 0.0 1.8 5.0


!Residue 239 (97)

!Residue 240 (98)

!Residue 241 (99)

!Residue 242 (100)

!Residue 243 (101)

!Residue 244 (102)

!Residue 245 (103)

!Residue 246 (104)

!Residue 247 (105)

!Residue 248 (106)

!LONG RANGE NOES

!Residue 143 (1)

!Residue 144 (2)
assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 8 and name he* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 105 and name hn ) 0.0 1.8 5.0 !unsure
!assign ( segid "fSH2" and resid 2 and name hg2*)( segid "fSH2" and resid 105 and name hd2) 0.0 1.8 5.0 !unsure
assign ( segid "fSH2" and resid 2 and name hd1*)( segid "fSH2" and resid 8 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 2 and name hd1*)( segid "fSH2" and resid 8 and name he* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 2 and name hd1*)( segid "fSH2" and resid 43 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 2 and name hd1*)( segid "fSH2" and resid 82 and name hb* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 2 and name hd1*)( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 2 and name hd1*)( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5

!Residue 145 (3)
assign ( segid "fSH2" and resid 3 and name hb1 )( segid "fSH2" and resid 8 and name hn ) 0.0 1.8 5.0

!Residue 146 (4)

!Residue 147 (5)

!Residue 148 (6)
!assign ( segid "fSH2" and resid 6 and name hn  )( segid "fSH2" and resid 101 and name hg1*) 0.0 1.8 5.0 !unsure
!assign ( segid "fSH2" and resid 6 and name hb1 )( segid "fSH2" and resid 101 and name ha  ) 0.0 1.8 5.0 !unsure

!Residue 149 (7)
assign ( segid "fSH2" and resid 7 and name hn  )( segid "fSH2" and resid 101 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hn  )( segid "fSH2" and resid 101 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hn  )( segid "fSH2" and resid 101 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name ha  )( segid "fSH2" and resid 33 and name hn*  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name ha  )( segid "fSH2" and resid 102 and name hn  ) 0.0 1.8 5.0 !v.w.
!assign ( segid "fSH2" and resid 7 and name ha  )( segid "fSH2" and resid 103 and name hg2 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name ha  )( segid "fSH2" and resid 103 and name hg1 ) 0.0 1.8 5.0 !unsure
!assign ( segid "fSH2" and resid 7 and name hb1 )( segid "fSH2" and resid 33 and name hn*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hb2 )( segid "fSH2" and resid 33 and name hn*  ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 7 and name hd1 )( segid "fSH2" and resid 86 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hd1 )( segid "fSH2" and resid 86 and name hg2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name he1 )( segid "fSH2" and resid 83 and name ha   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name he1 )( segid "fSH2" and resid 86 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name he1 )( segid "fSH2" and resid 86 and name hg2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name he3 )( segid "fSH2" and resid 33 and name hb   ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 7 and name he3 )( segid "fSH2" and resid 33 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 82 and name hb*  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 82 and name hd1* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 82 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 82 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 82 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 86 and name hg2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hh2 )( segid "fSH2" and resid 82 and name hb*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz2 )( segid "fSH2" and resid 86 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 33 and name hb   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 33 and name hg2* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 82 and name hd1* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 82 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 82 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 82 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 7 and name hz3 )( segid "fSH2" and resid 86 and name hg2* ) 0.0 1.8 5.0

!Residue 150 (8)
assign ( segid "fSH2" and resid 8 and name hn* )( segid "fSH2" and resid 33 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hn* )( segid "fSH2" and resid 33 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hn  )( segid "fSH2" and resid 101 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hn  )( segid "fSH2" and resid 101 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name ha* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 8 and name hb2 )( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 34 and name hn* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 8 and name hd* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 8 and name he* )( segid "fSH2" and resid 33 and name hg2*) 0.0 1.8 3.5

!Residue 151 (9)
assign ( segid "fSH2" and resid 9 and name hn* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hn* )( segid "fSH2" and resid 33 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hb2 )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hd* )( segid "fSH2" and resid 20 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 9 and name hd* )( segid "fSH2" and resid 20 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name hd* )( segid "fSH2" and resid 33 and name hn* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 9 and name he* )( segid "fSH2" and resid 20 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 9 and name he* )( segid "fSH2" and resid 32 and name hd2*) 0.0 1.8 5.0

!Residue 152 (10)
assign ( segid "fSH2" and resid 10 and name hn* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 10 and name ha2 )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 10 and name ha1 )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0

!Residue 153 (11)
assign ( segid "fSH2" and resid 11 and name hn* )( segid "fSH2" and resid 34 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 11 and name hn* )( segid "fSH2" and resid 35 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 11 and name hn* )( segid "fSH2" and resid 35 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 11 and name ha  )( segid "fSH2" and resid 35 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 11 and name ha  )( segid "fSH2" and resid 35 and name hb1 ) 0.0 1.8 5.0

!Residue 154 (12)
assign ( segid "fSH2" and resid 12 and name hn  )( segid "fSH2" and resid 35 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hn  )( segid "fSH2" and resid 35 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hn  )( segid "fSH2" and resid 35 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hd1*)( segid "fSH2" and resid 17 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 12 and name hd2*)( segid "fSH2" and resid 17 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 12 and name hd2*)( segid "fSH2" and resid 17 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 12 and name hd2*)( segid "fSH2" and resid 17 and name hb* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 12 and name hd2*)( segid "fSH2" and resid 32 and name hd2*) 0.0 1.8 3.5

!Residue 155 (13)

!Residue 156 (14)
assign ( segid "fSH2" and resid 14 and name hn  )( segid "fSH2" and resid 37 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name hn  )( segid "fSH2" and resid 37 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name hn  )( segid "fSH2" and resid 37 and name hg* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 14 and name ha  )( segid "fSH2" and resid 60 and name he1 ) 0.0 1.8 3.5

!Residue 157 (15)

!Residue 158 (16)

!Residue 159 (17)
assign ( segid "fSH2" and resid 17 and name hn )( segid "fSH2" and resid 32 and name hd2*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 17 and name ha )( segid "fSH2" and resid 58 and name hg1*  ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 17 and name ha )( segid "fSH2" and resid 58 and name hg2*  ) 0.0 1.8 5.0 !3.5 olp
assign ( segid "fSH2" and resid 17 and name ha )( segid "fSH2" and resid 60 and name he1   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 17 and name ha )( segid "fSH2" and resid 32 and name hd2*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 17 and name hb*)( segid "fSH2" and resid 32 and name hd1*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 17 and name hb*)( segid "fSH2" and resid 32 and name hd2*  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 17 and name hb*)( segid "fSH2" and resid 58 and name hg2*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 17 and name hb*)( segid "fSH2" and resid 60 and name he1   ) 0.0 1.8 3.5

!Residue 160 (18)
assign ( segid "fSH2" and resid 18 and name hn  )( segid "fSH2" and resid 58 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hn  )( segid "fSH2" and resid 58 and name hg2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hn  )( segid "fSH2" and resid 60 and name he1  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hb* )( segid "fSH2" and resid 60 and name he1  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hg* )( segid "fSH2" and resid 58 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 18 and name hg* )( segid "fSH2" and resid 58 and name hg2* ) 0.0 1.8 5.0

!Residue 161 (19)
assign ( segid "fSH2" and resid 19 and name hn  )( segid "fSH2" and resid 58 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 19 and name hn  )( segid "fSH2" and resid 58 and name hg2* ) 0.0 1.8 5.0

!Residue 162 (20)
assign ( segid "fSH2" and resid 20 and name hn  )( segid "fSH2" and resid 32 and name hd2* ) 0.0 1.8 5.0

!Residue 163 (21)
assign ( segid "fSH2" and resid 21 and name hn   )( segid "fSH2" and resid 32 and name hd2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hn   )( segid "fSH2" and resid 58 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hn   )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name ha   )( segid "fSH2" and resid 26 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hd*  )( segid "fSH2" and resid 31 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hd*  )( segid "fSH2" and resid 32 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hd*  )( segid "fSH2" and resid 47 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hd*  )( segid "fSH2" and resid 48 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 21 and name hd*  )( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 5.0

!Residue 164 (22)
assign ( segid "fSH2" and resid 22 and name hn  )( segid "fSH2" and resid 48 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hn  )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd1*)( segid "fSH2" and resid 56 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd2*)( segid "fSH2" and resid 56 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd2*)( segid "fSH2" and resid 56 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd2*)( segid "fSH2" and resid 56 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd2*)( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 22 and name hd2*)( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 5.0

!Residue 165 (23)

!Residue 166 (24)

!Residue 167 (25)

!Residue 168 (26)

!Residue 169 (27)
assign ( segid "fSH2" and resid 27 and name hd1 )( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 5.0

!Residue 170 (28)
assign ( segid "fSH2" and resid 28 and name hn  )( segid "fSH2" and resid 50 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 28 and name hn  )( segid "fSH2" and resid 48 and name hb* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 28 and name ha  )( segid "fSH2" and resid 49 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 28 and name hb* )( segid "fSH2" and resid 30 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 28 and name hb* )( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 5.0 olp

!Residue 171 (29)
assign ( segid "fSH2" and resid 29 and name hn )( segid "fSH2" and resid 47 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 29 and name hn )( segid "fSH2" and resid 47 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 29 and name hn )( segid "fSH2" and resid 49 and name ha* ) 0.0 1.8 5.0

!Residue 172 (30)
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 47 and name ha   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 48 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 48 and name hb*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 48 and name hd*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 49 and name ha   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 101 and name hg1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 102 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hn  )( segid "fSH2" and resid 102 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hb* )( segid "fSH2" and resid 48 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hg2*)( segid "fSH2" and resid 48 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 30 and name hg1 )( segid "fSH2" and resid 102 and name hg2*) 0.0 1.8 5.0

!Residue 173 (31)
assign ( segid "fSH2" and resid 31 and name hn )( segid "fSH2" and resid 102 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name hn )( segid "fSH2" and resid 102 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 31 and name ha )( segid "fSH2" and resid 47 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 31 and name ha )( segid "fSH2" and resid 48 and name hn  ) 0.0 1.8 3.5

!Residue 174 (32)
assign ( segid "fSH2" and resid 32 and name hn  )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 32 and name hn  )( segid "fSH2" and resid 45 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 32 and name hn  )( segid "fSH2" and resid 47 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 32 and name hn  )( segid "fSH2" and resid 46 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 32 and name hn  )( segid "fSH2" and resid 46 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 32 and name hd2*)( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 5.0

!Residue 175 (33)
assign ( segid "fSH2" and resid 33 and name ha   )( segid "fSH2" and resid 45 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 33 and name ha   )( segid "fSH2" and resid 46 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 33 and name hg2* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 33 and name hg2* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 33 and name hg2* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 33 and name hg2* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5

!Residue 176 (34)
!assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 43 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 43 and name hb1 ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 44 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 44 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 44 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 45 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 34 and name hn  )( segid "fSH2" and resid 45 and name ha  ) 0.0 1.8 5.0

!Residue 177 (35)
assign ( segid "fSH2" and resid 35 and name hn  )( segid "fSH2" and resid 43 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name ha  )( segid "fSH2" and resid 44 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name ha  )( segid "fSH2" and resid 43 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name ha  )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 35 and name ha  )( segid "fSH2" and resid 43 and name hd* ) 0.0 1.8 2.7

!Residue 178 (36)
assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 42 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 44 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 42 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 43 and name ha  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 43 and name hb1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 43 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 43 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 43 and name hb1 ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 42 and name hb* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hb1 )( segid "fSH2" and resid 42 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 36 and name hb1 )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 36 and name hb2 )( segid "fSH2" and resid 42 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hb2 )( segid "fSH2" and resid 42 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 36 and name hb2 )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 36 and name hb1 )( segid "fSH2" and resid 42 and name hn  ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 36 and name hn  )( segid "fSH2" and resid 43 and name hn  ) 0.0 1.8 5.0

!Residue 179 (37)

!Residue 180 (38)
assign ( segid "fSH2" and resid 38 and name hb )( segid "fSH2" and resid 62 and name hg* ) 0.0 1.8 5.0

!Residue 181 (39)

!Residue 182 (40)

!Residue 183 (41)

!Residue 184 (42)

!Residue 185 (43)
assign ( segid "fSH2" and resid 43 and name hn  )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name hn  )( segid "fSH2" and resid 63 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name hn  )( segid "fSH2" and resid 63 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 43 and name hn  )( segid "fSH2" and resid 63 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name hn  )( segid "fSH2" and resid 64 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name hn  )( segid "fSH2" and resid 63 and name hg2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 43 and name ha  )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 43 and name hb* )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 43 and name hd* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 43 and name hd* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 43 and name hd* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 43 and name hd* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5

!Residue 186 (44)
assign ( segid "fSH2" and resid 44 and name hn  )( segid "fSH2" and resid 63 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 44 and name hn  )( segid "fSH2" and resid 63 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 44 and name ha  )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 44 and name ha  )( segid "fSH2" and resid 62 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 44 and name ha  )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 44 and name ha  )( segid "fSH2" and resid 62 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 44 and name hb2 )( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 3.5

!Residue 187 (45)
assign ( segid "fSH2" and resid 45 and name hn* )( segid "fSH2" and resid 60 and name ha   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hn* )( segid "fSH2" and resid 61 and name hn*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hn* )( segid "fSH2" and resid 62 and name ha*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hn* )( segid "fSH2" and resid 61 and name hb*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hn* )( segid "fSH2" and resid 63 and name hg1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hn* )( segid "fSH2" and resid 73 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hb* )( segid "fSH2" and resid 61 and name hn*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hg* )( segid "fSH2" and resid 61 and name hn*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd1*)( segid "fSH2" and resid 61 and name hn*  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 45 and name hd1*)( segid "fSH2" and resid 100 and name hn* ) 0.0 1.8 5.0 !rm v.w.
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 61 and name hn*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 61 and name hb1  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 61 and name hb2  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 61 and name hd*  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 61 and name he*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 73 and name hd1* ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 89 and name hd*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 100 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 45 and name hd2*)( segid "fSH2" and resid 100 and name hd2*) 0.0 1.8 5.0

!Residue 188 (46)
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 60 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 46 and name ha  )( segid "fSH2" and resid 60 and name he1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 46 and name hb1 )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 46 and name hb2 )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 5.0

!Residue 189 (47)
assign ( segid "fSH2" and resid 47 and name hn  )( segid "fSH2" and resid 60 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 47 and name hn  )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 47 and name hn  )( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hn  )( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hn  )( segid "fSH2" and resid 61 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 61 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 61 and name he* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hg2*)( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hd1*)( segid "fSH2" and resid 60 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hd1*)( segid "fSH2" and resid 61 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hd1*)( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 47 and name hd1*)( segid "fSH2" and resid 98 and name hn  ) 0.0 1.8 5.0

!Residue 190 (48)
assign ( segid "fSH2" and resid 48 and name hn  )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 48 and name ha  )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 48 and name ha  )( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 48 and name ha  )( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 5.0

!Residue 191 (49)
assign ( segid "fSH2" and resid 49 and name hn  )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 49 and name hn  )( segid "fSH2" and resid 58 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 49 and name hn  )( segid "fSH2" and resid 58 and name hg1*) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 49 and name hn  )( segid "fSH2" and resid 58 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 49 and name hn  )( segid "fSH2" and resid 58 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 49 and name hn  )( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.

!Residue 192 (50)
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name ha  )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 55 and name ha1 ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 55 and name ha2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 56 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name hd1 )( segid "fSH2" and resid 57 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name he1 )( segid "fSH2" and resid 55 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 50 and name he1 )( segid "fSH2" and resid 55 and name ha1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 50 and name he1 )( segid "fSH2" and resid 55 and name ha2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name he1 )( segid "fSH2" and resid 56 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 50 and name he3 )( segid "fSH2" and resid 56 and name ha  ) 0.0 1.8 5.0


!Residue 193 (51)
assign ( segid "fSH2" and resid 51 and name hn* )( segid "fSH2" and resid 56 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 51 and name hn* )( segid "fSH2" and resid 57 and name hn* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 51 and name hn* )( segid "fSH2" and resid 56 and name ha* ) 0.0 1.8 5.0

!Residue 194 (52)

!Residue 195 (53)

!Residue 196 (54)

!Residue 197 (55)

!Residue 198 (56)

!Residue 199 (57)

!Residue 200 (58)

!Residue 201 (59)

!Residue 202 (60)

!Residue 203 (61)
assign ( segid "fSH2" and resid 61 and name hn  )( segid "fSH2" and resid 73 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 61 and name hn  )( segid "fSH2" and resid 73 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 61 and name hb1 )( segid "fSH2" and resid 73 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 61 and name hb2 )( segid "fSH2" and resid 73 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 61 and name hb* )( segid "fSH2" and resid 73 and name hb  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 61 and name hd* )( segid "fSH2" and resid 73 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 61 and name hd* )( segid "fSH2" and resid 73 and name hg2*) 0.0 1.8 2.7
!assign ( segid "fSH2" and resid 61 and name hd* )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 61 and name he* )( segid "fSH2" and resid 96 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 61 and name hd* )( segid "fSH2" and resid 96 and name hd1*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 61 and name he* )( segid "fSH2" and resid 96 and name hd1*) 0.0 1.8 3.5

assign ( segid "fSH2" and resid 61 and name he* )( segid "fSH2" and resid 97 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 61 and name he* )( segid "fSH2" and resid 73 and name hg2*) 0.0 1.8 5.0

!Residue 204 (62)
assign ( segid "fSH2" and resid 62 and name hn* )( segid "fSH2" and resid 73 and name hg2*) 0.0 1.8 5.0

!Residue 205 (63)
assign ( segid "fSH2" and resid 63 and name hg1*)( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hg1*)( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hg2*)( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hg2*)( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hd1*)( segid "fSH2" and resid 73 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 63 and name hd1*)( segid "fSH2" and resid 73 and name hd1*) 0.0 1.8 3.5

!Residue 206 (64)
assign ( segid "fSH2" and resid 64 and name hn  )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 64 and name hn  )( segid "fSH2" and resid 71 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 64 and name hn  )( segid "fSH2" and resid 71 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 64 and name hn  )( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 64 and name hn  )( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 5.0

!Residue 207 (65)
assign ( segid "fSH2" and resid 65 and name hn )( segid "fSH2" and resid 71 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name hn )( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name hn )( segid "fSH2" and resid 71 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name ha )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 65 and name ha )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 65 and name ha )( segid "fSH2" and resid 71 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 65 and name ha )( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 65 and name ha )( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 3.5


!Residue 208 (66)
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0 !3.5 m.c.
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 71 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hn  )( segid "fSH2" and resid 71 and name ha* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name ha  )( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name ha  )( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd* )( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd* )( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd1*)( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hd1*)( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 78 and name he21) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 78 and name he22) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 66 and name hd2*)( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0

!Residue 209 (67)

!Residue 210 (68)

!Residue 211 (69)

!Residue 212 (70)
assign ( segid "fSH2" and resid 70 and name hn  )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 70 and name ha1 )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 70 and name ha2 )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 70 and name hn  )( segid "fSH2" and resid 80 and name ha  ) 0.0 1.8 5.0

!Residue 213 (71)
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 79 and name hb* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 79 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 78 and name ha  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 78 and name hb1 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 78 and name hb2 ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 80 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hn  )( segid "fSH2" and resid 81 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hb2 )( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 3.5 !2.7 m.c.
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 81 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 81 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 81 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 82 and name hg  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name hd* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 81 and name ha  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 81 and name hb  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 81 and name hg2*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 82 and name hg  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 71 and name he* )( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 3.5

!Residue 214 (72)
assign ( segid "fSH2" and resid 72 and name hn  )(segid "fSH2" and resid 78 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name ha  )(segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name ha  )(segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hb1 )(segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hb2 )(segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hb2 )(segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb2 )(segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb1 )(segid "fSH2" and resid 77 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hb1 )(segid "fSH2" and resid 78 and name hn  ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 73 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 78 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 75 and name ha  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 75 and name hb  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 78 and name hg1 ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 78 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 78 and name hg2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name hd* )(segid "fSH2" and resid 78 and name hg1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name he* )(segid "fSH2" and resid 75 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name he* )(segid "fSH2" and resid 73 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 72 and name he* )(segid "fSH2" and resid 75 and name hb  ) 0.0 1.8 5.0


!Residue 215 (73)
!assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 85 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 85 and name hd1* ) 0.0 1.8 3.5

!assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 96 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 96 and name hd1* ) 0.0 1.8 3.5

assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 89 and name hd*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 73 and name hd1*)( segid "fSH2" and resid 89 and name he*  ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 73 and name hg2*)( segid "fSH2" and resid 96 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 73 and name hg2*)( segid "fSH2" and resid 96 and name hd1* ) 0.0 1.8 3.5


!Residue 216 (74)

!Residue 217 (75)

!Residue 218 (76)

!Residue 219 (77)

!Residue 220 (78)

!Residue 221 (79)
!assign ( segid "fSH2" and resid 79 and name hn  )( segid "fSH2" and resid 85 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hn  )( segid "fSH2" and resid 85 and name hd2*) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 79 and name hb* )( segid "fSH2" and resid 84 and name hn  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hb* )( segid "fSH2" and resid 85 and name hn  ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 79 and name hz  )( segid "fSH2" and resid 88 and name ha  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hz  )( segid "fSH2" and resid 88 and name hb1 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hz  )( segid "fSH2" and resid 88 and name hb2 ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hz  )( segid "fSH2" and resid 89 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 79 and name hz  )( segid "fSH2" and resid 89 and name he* ) 0.0 1.8 5.0

!Residue 222 (80)

!Residue 223 (81)

!Residue 224 (82)

!Residue 225 (83)

!Residue 226 (84)

!Residue 227 (85)
!assign ( segid "fSH2" and resid 85 and name hd2*)( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 85 and name hd1*)( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 3.5

assign ( segid "fSH2" and resid 85 and name ha  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0

!Residue 228 (86)
assign ( segid "fSH2" and resid 86 and name hb  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 86 and name hn  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0

!Residue 229 (87)

!Residue 230 (88)
!assign ( segid "fSH2" and resid 88 and name hn  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0 !rm v.w.

!Residue 231 (89)
assign ( segid "fSH2" and resid 89 and name hn  )( segid "fSH2" and resid 100 and name hg   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name hn  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name hn  )( segid "fSH2" and resid 100 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name ha  )( segid "fSH2" and resid 100 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name ha  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name hb1 )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 89 and name hb1 )( segid "fSH2" and resid  99 and name hn   ) 0.0 1.8 5.0 !unsure
assign ( segid "fSH2" and resid 89 and name hb1 )( segid "fSH2" and resid 100 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name hb1 )( segid "fSH2" and resid 100 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name hd* )( segid "fSH2" and resid  94 and name hb*  ) 0.0 1.8 2.7
!assign ( segid "fSH2" and resid 89 and name hd* )( segid "fSH2" and resid  96 and name hd1* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 89 and name hd* )( segid "fSH2" and resid  96 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name hd* )( segid "fSH2" and resid  96 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name hd* )( segid "fSH2" and resid  96 and name hd1* ) 0.0 1.8 5.0

assign ( segid "fSH2" and resid 89 and name hd* )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid  94 and name hb*  ) 0.0 1.8 2.7
assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid  96 and name hn   ) 0.0 1.8 5.0
!assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid  96 and name hd1* ) 0.0 1.8 3.5
!assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid  96 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid  96 and name hd2* ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 89 and name he* )( segid "fSH2" and resid  96 and name hd1* ) 0.0 1.8 5.0


!Residue 232 (90)
!assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 100 and name hn   ) 0.0 1.8 5.0 !v.w.
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 100 and name hg   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 100 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hn  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hb1 )( segid "fSH2" and resid 100 and name hd1* ) 0.0 1.8 5.0 
assign ( segid "fSH2" and resid 90 and name hb2 )( segid "fSH2" and resid 100 and name hd1* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 90 and name hb2 )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0

!Residue 233 (91)
assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid  99 and name hd* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 100 and name hd1*) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 91 and name hn  )( segid "fSH2" and resid 100 and name hd2*) 0.0 1.8 5.0

!Residue 234 (92)
assign ( segid "fSH2" and resid 92 and name hn  )( segid "fSH2" and resid  99 and name hd*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hn  )( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 92 and name hn  )( segid "fSH2" and resid 100 and name hd1* ) 0.0 1.8 5.0

!Residue 235 (93)
assign ( segid "fSH2" and resid 93 and name hn  )( segid "fSH2" and resid  99 and name hd*  ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 93 and name ha  )( segid "fSH2" and resid  99 and name hn   ) 0.0 1.8 3.5
assign ( segid "fSH2" and resid 93 and name ha  )( segid "fSH2" and resid 100 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid  98 and name hn   ) 0.0 1.8 5.0
assign ( segid "fSH2" and resid 93 and name hb* )( segid "fSH2" and resid  99 and name hn   ) 0.0 1.8 5.0

!Residue 236 (94)

!Residue 237 (95)

!Residue 238 (96)

!Residue 239 (97)

!Residue 240 (98)

!Residue 241 (99)

!Residue 242 (100)

!Residue 243 (101)

!Residue 244 (102)

!Residue 245 (103)

!Residue 246 (104)

!Residue 247 (105)

!Residue 248 (106)
!The ambiguous restraints that are commented out have moved into
!the ordinary restraint list at some point during the caluclations

!NH-X intensities at 0.2 lev sh2assstp2.mat
!STRONG 2.7 (>8 contours)
!MEDIUM 3.5 (4<= contours <= 8)
!WEAK   5.0 (<4 contours)

!Residue E1  (201)

!Residue P2  (202)

!Residue Q3  (203)

!Residue pY4 (204)
assign (( segid "fSH2" and resid 204 and name he*) or ( segid "fSH2" and resid 60 and name hd2 ))
( segid "fSH2" and resid 60 and name hb1  ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 204 and name he*) or ( segid "fSH2" and resid 60 and name hd2 ))
( segid "fSH2" and resid 60 and name hb2  ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 204 and name hn) or ( segid "fSH2" and resid 205 and name hn ))
( segid "fSH2" and resid 204 and name ha) 0.0 1.8 2.7

assign (( segid "fSH2" and resid 204 and name hn) or ( segid "fSH2" and resid 205 and name hn ))
( segid "fSH2" and resid 204 and name hb1) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 204 and name hn) or ( segid "fSH2" and resid 205 and name hn ))
( segid "fSH2" and resid 204 and name hb2) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid*205 and name ha) or ( segid "fSH2" and resid 38 and name hb ))
!       (( segid "fSH2" and resid 204 and name hn) or (segid "fSH2" and resid*205 and name hn )) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 204 and name hn) or ( segid "fSH2" and resid*205 and name hn ))
!( segid "fSH2" and resid*61 and name ha) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 205 and name ha) or ( segid "fSH2" and resid*38 and name hb ))
!( segid "fSH2" and resid*204 and name hd*) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 205 and name ha) or ( segid "fSH2" and resid 38 and name hb ))
!( segid "fSH2" and resid 204 and name he*) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 204 and name hn) or ( segid "fSH2" and resid 205 and name hn ))
( segid "fSH2" and resid 204 and name hd*) 0.0 1.8 3.5

!Residue E5  (205)

!Residue E6  (206)

!Residue I7  (207)
assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid 207 and name hd1* ))
( segid "fSH2" and resid 207 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid *207 and name hd1* ))
!( segid "fSH2" and resid 61 and name hd*  ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid 207 and name hd1* ))
!( segid "fSH2" and resid 73 and name hg2* ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid 207 and name hd1* ))
( segid "fSH2" and resid 74 and name hb   ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid 207 and name hd1* ))
!( segid "fSH2" and resid 74 and name hg2* ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid *207 and name hd1* ))
!( segid "fSH2" and resid 96 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid *207 and name hd1* ))
!( segid "fSH2" and resid 97 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 207 and name hg2*) or ( segid "fSH2" and resid 207 and name hd1* ))
!( segid "fSH2" and resid 96 and name hd1* ) 0.0 1.8 3.5

!X-filtered NOESY shows CH3 207-75HN Xpk; size of contribution unknown
!therefore restrain methyls to wtithin 5 A and let stronger restraint
!including HG2 75 sort out relative contributions

assign (( segid "fSH2" and resid 207 and name hg2*) or 
        ( segid "fSH2" and resid 207 and name hd1*) or
        ( segid "fSH2" and resid 75 and name hg2* ))
        ( segid "fSH2" and resid 75 and name hn   ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 207 and name hg2*) or 
        ( segid "fSH2" and resid 207 and name hd1*))
        ( segid "fSH2" and resid 75 and name hn   ) 0.0 1.8 5.0


!Residue P8   (208)

!Residue I9   (209)
assign (( segid "fSH2" and resid 209 and name hg2*) or ( segid "fSH2" and resid 209 and name hd1* ))
( segid "fSH2" and resid 209 and name hn ) 0.0 1.8 3.5

!Residue Y10  (210)
assign (( segid "fSH2" and resid 209 and name hg2*) or ( segid "fSH2" and resid 209 and name hd1* ))
( segid "fSH2" and resid 210 and name hn ) 0.0 1.8 5.0

!Residue L11  (211)
assign (( segid "fSH2" and resid 211 and name hb*) or ( segid "fSH2" and resid 211 and name hg* ))
( segid "fSH2" and resid 211 and name hn ) 0.0 1.8 2.7

!Residue S143 (1)

!Residue I144 (2)

!Residue Q145 (3)

!Residue A146 (4)

!Residue E147 (5)
assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*)
     or ( segid "fSH2" and resid 101 and name hg1* ))
( segid "fSH2" and resid 5 and name hn ) 0.0 1.8 5.0

!Residue E148 (6)
!assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*)
!     or ( segid "fSH2" and resid 101 and name hg1* ))
!( segid "fSH2" and resid 6 and name hn ) 0.0 1.8 5.0

!Residue W149 (7)
!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 96 and name hd1* ))
!( segid "fSH2" and resid 7 and name he1) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 86 and name hg2*) or ( segid "fSH2" and resid 96 and name hd2* ))
!( segid "fSH2" and resid 7 and name he1) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 8 and name hb2*) or ( segid "fSH2" and resid 83 and name hb* ))
( segid "fSH2" and resid 7 and name hz2) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 7 and name hd1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 7 and name he1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 7 and name hz2 ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*))
( segid "fSH2" and resid 7 and name hh2 ) 0.0 1.8 2.7

!Residue Y150 (8)
!assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*)
!     or ( segid "fSH2" and resid 101 and name hg1* ))
!( segid "fSH2" and resid 8 and name hd* ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*)
!     or ( segid "fSH2" and resid 101 and name hg1* ))
!( segid "fSH2" and resid 8 and name he* ) 0.0 1.8 3.5

!Residue F151 (9)
assign (( segid "fSH2" and resid 32 and name hb*) or ( segid "fSH2" and resid 32 and name hg*))
( segid "fSH2" and resid 9 and name hn ) 0.0 1.8 5.0

!Residue G152 (10)

!Residue K153 (11)

!Residue L154 (12)
!assign (( segid "fSH2" and resid 10 and name ha2) or ( segid "fSH2" and resid 44 and name hb2))
!( segid "fSH2" and resid 12 and name hn ) 0.0 1.8 5.0
assign (( segid "fSH2" and resid 10 and name ha1) or ( segid "fSH2" and resid 44 and name hb2))
( segid "fSH2" and resid 12 and name hn ) 0.0 1.8 5.0

!Residue G155 (13)

!Residue R156 (14)
!assign (( segid "fSH2" and resid 18 and name hg2*) or ( segid "fSH2" and resid 37 and name hb* ))
!( segid "fSH2" and resid 14 and name hn) 0.0 1.8 5.0

!Residue K157 (15)

!Residue D158 (16)

!Residue A159 (17)

!Residue E160 (18)

!Residue R161 (19)
assign (( segid "fSH2" and resid 21 and name hb*) or ( segid "fSH2" and resid 22 and name hb*))
( segid "fSH2" and resid 19 and name hn ) 0.0 1.8 5.0 !3.5 olp

!Residue Q162 (20)

!Residue L163 (21)
assign (( segid "fSH2" and resid 21 and name hb*) or ( segid "fSH2" and resid 22 and name hb*))
( segid "fSH2" and resid 21 and name hn ) 0.0 1.8 2.7

!Residue L164 (22)
assign (( segid "fSH2" and resid 21 and name hb*) or ( segid "fSH2" and resid 22 and name hb*))
( segid "fSH2" and resid 22 and name hn ) 0.0 1.8 2.7

assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
( segid "fSH2" and resid 22 and name hn ) 0.0 1.8 5.0

!Residue S165 (23)
assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
( segid "fSH2" and resid 23 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 21 and name hb*) or ( segid "fSH2" and resid 22 and name hb*))
( segid "fSH2" and resid 22 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 26 and name hb*  ) or (segid "fSH2" and resid 48 and name hd*  ))
!( segid "fSH2" and resid 22 and name hn ) 0.0 1.8 5.0


!Residue F166 (24)

!Residue G167 (25)

!Residue N168 (26)
!assign (( segid "fSH2" and resid 26 and name hb*  ) or (segid "fSH2" and resid 48 and name hd*  ))
!( segid "fSH2" and resid 26 and name hn ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 21 and name ha ) or (segid "fSH2" and resid 23 and name hb* ))
!( segid "fSH2" and resid 26 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 30 and name hg2* ) or ( segid "fSH2" and resid 102 and name hg1* ))
!( segid "fSH2" and resid 26 and name hn ) 0.0 1.8 5.0


!Residue P169 (27)

!Residue R170 (28)
!assign (( segid "fSH2" and resid 45 and name hb*  ) or (segid "fSH2" and resid 48 and name hb*  ))
!( segid "fSH2" and resid 28 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
!( segid "fSH2" and resid 28 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 28 and name ha ) or (segid "fSH2" and resid 30 and name hb ))
!( segid "fSH2" and resid 28 and name hn ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 27 and name ha ) or (segid "fSH2" and resid 29 and name ha1 ))
!( segid "fSH2" and resid 28 and name hn ) 0.0 1.8 3.5


!Residue G171 (29)
!assign (( segid "fSH2" and resid 28 and name ha ) or (segid "fSH2" and resid 30 and name hb ))
!( segid "fSH2" and resid 29 and name hn ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
!( segid "fSH2" and resid 48 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 27 and name ha ) or (segid "fSH2" and resid 29 and name ha1 ))
!( segid "fSH2" and resid 29 and name hn ) 0.0 1.8 3.5

!Residue T172 (30)
!assign (( segid "fSH2" and resid 28 and name hb*  ) or (segid "fSH2" and resid 102 and name hb*  ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 30 and name hg2* ) or ( segid "fSH2" and resid 102 and name hg1* ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 27 and name hd1 ) or ( segid "fSH2" and resid 104 and name hb1 ))
!( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 27 and name hd2 ) or ( segid "fSH2" and resid 30 and name hb ))
( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 27 and name hd2 ) or ( segid "fSH2" and resid 30 and name hb ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 27 and name hb* ) or ( segid "fSH2" and resid 27 and name hg* ))
( segid "fSH2" and resid 30 and name hg1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 26 and name hb*  ) or (segid "fSH2" and resid 48 and name hd*  ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 28 and name ha ) or (segid "fSH2" and resid 30 and name hb ))
( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 27 and name ha ) or (segid "fSH2" and resid 29 and name ha1 ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*)
!     or ( segid "fSH2" and resid 101 and name hg1* ))
!( segid "fSH2" and resid 30 and name hn ) 0.0 1.8 5.0

!Residue F173 (31)
!assign (( segid "fSH2" and resid 21 and name hd*  ) or ( segid "fSH2" and resid 22 and name hd2* ))
!( segid "fSH2" and resid 31 and name ha ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 30 and name hg2* ) or ( segid "fSH2" and resid 102 and name hg1* ))
( segid "fSH2" and resid 31 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 47 and name hg2* ) or ( segid "fSH2" and resid 47 and name hd1* ))
( segid "fSH2" and resid 31 and name ha ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 27 and name hd2 ) or ( segid "fSH2" and resid 30 and name hb ))
!( segid "fSH2" and resid 31 and name hn ) 0.0 1.8 5.0

!Residue L174 (32)
!assign (( segid "fSH2" and resid 17 and name ha ) or ( segid "fSH2" and resid 104 and name hb2 ))
!( segid "fSH2" and resid 32 and name hd2* ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 32 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 9 and name hd*)or ( segid "fSH2" and resid 31 and name hd* ))
!( segid "fSH2" and resid 32 and name hn ) 0.0 1.8 5.0

!Residue I175 (33)
assign (( segid "fSH2" and resid 32 and name hb*) or ( segid "fSH2" and resid 32 and name hg*))
( segid "fSH2" and resid 33 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid  2 and name hd1*) or ( segid "fSH2" and resid 33 and name hd1*))
!( segid "fSH2" and resid 33 and name hn ) 0.0 1.8 5.0

!Residue R176 (34)
!assign (( segid "fSH2" and resid 63 and name hg12 ) or ( segid "fSH2" and resid 33 and name hg2* ))
!( segid "fSH2" and resid 34 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 7 and name hb2  ) or ( segid "fSH2" and resid 43 and name hb2 ))
!( segid "fSH2" and resid 34 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid  2 and name hd1*) or ( segid "fSH2" and resid 33 and name hd1*))
!( segid "fSH2" and resid 34 and name hn ) 0.0 1.8 5.0

!Residue E177 (35)
!assign (( segid "fSH2" and resid 8 and name hd*  ) or ( segid "fSH2" and resid 43 and name hd* ))
!( segid "fSH2" and resid 35 and name hn ) 0.0 1.8 5.0

!Residue S178 (36)
!assign (( segid "fSH2" and resid 37 and name ha ) or ( segid "fSH2" and resid 38 and name ha)
!or ( segid "fSH2" and resid 38 and name hb ))
!( segid "fSH2" and resid 36 and name hb1 ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 37 and name ha ) or ( segid "fSH2" and resid 38 and name ha)
or ( segid "fSH2" and resid 38 and name hb ))
( segid "fSH2" and resid 36 and name hb2 ) 0.0 1.8 5.0


!assign (( segid "fSH2" and resid 37 and name ha ) or ( segid "fSH2" and resid 38 and name ha )
!or  ( segid "fSH2" and resid 38 and name hb ))
!( segid "fSH2" and resid 36 and name hb2 ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 37 and name ha ) or ( segid "fSH2" and resid 38 and name ha )
or  ( segid "fSH2" and resid 38 and name hb ))
( segid "fSH2" and resid 36 and name hb1 ) 0.0 1.8 5.0


!Residue E179 (37)

!Residue T180 (38)

!Residue T181 (39)

!Residue K182 (40)

!Residue G183 (41)
assign (( segid "fSH2" and resid 40 and name ha ) or ( segid "fSH2" and resid 41 and name ha1 ))
( segid "fSH2" and resid 41 and name hn ) 0.0 1.8 2.7

!Residue A184 (42)
assign (( segid "fSH2" and resid 40 and name ha ) or ( segid "fSH2" and resid 41 and name ha1 ))
( segid "fSH2" and resid 42 and name hn ) 0.0 1.8 3.5

!Residue Y185 (43)
!assign (( segid "fSH2" and resid 41 and name ha1 ) or ( segid "fSH2" and resid 35 and name ha ))
!( segid "fSH2" and resid 43 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 36 and name hb1 ) or ( segid "fSH2" and resid 44 and name hb1 ))
!( segid "fSH2" and resid 43 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 45 and name hd1* ) or ( segid "fSH2" and resid 63 and name hd1* ))
!( segid "fSH2" and resid 43 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid  2 and name hd1*) or ( segid "fSH2" and resid 33 and name hd1*))
!( segid "fSH2" and resid 43 and name hd* ) 0.0 1.8 5.0

!Residue S186 (44)
!assign (( segid "fSH2" and resid 45 and name hd1* ) or ( segid "fSH2" and resid 63 and name hd1* ))
!( segid "fSH2" and resid 44 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 63 and name hg12 ) or ( segid "fSH2" and resid 33 and name hg2* ))
( segid "fSH2" and resid 44 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 8 and name hd*  ) or ( segid "fSH2" and resid 43 and name hd* ))
( segid "fSH2" and resid 44 and name hb1 ) 0.0 1.8 3.5

!Residue L187 (45)
!assign (( segid "fSH2" and resid 63 and name hg12 ) or ( segid "fSH2" and resid 33 and name hg2* ))
!( segid "fSH2" and resid 45 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 45 and name hd1* ) or ( segid "fSH2" and resid 63 and name hd1* ))
( segid "fSH2" and resid 45 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 45 and name hd2*) 0.0 1.8 5.0

!Residue S188 (46)
!assign (( segid "fSH2" and resid 45 and name hd1*)or ( segid "fSH2" and resid 63 and name hd1*))
!( segid "fSH2" and resid 46 and name hn ) 0.0 1.8 3.5

!Residue I189 (47)
!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 47 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 59 and name hn  )or ( segid "fSH2" and resid 60 and name hn   ))
( segid "fSH2" and resid 47 and name hn ) 0.0 1.8 5.0

!Residue R190 (48)
!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 48 and name ha ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 27 and name hd2 ) or ( segid "fSH2" and resid 30 and name hb ))
!( segid "fSH2" and resid 48 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
( segid "fSH2" and resid 48 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 26 and name hb*  ) or (segid "fSH2" and resid 48 and name hd*  ))
!( segid "fSH2" and resid 48 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 28 and name ha ) or (segid "fSH2" and resid 30 and name hb ))
( segid "fSH2" and resid 48 and name hn ) 0.0 1.8 5.0

!Residue D191 (49)
assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
( segid "fSH2" and resid 49 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
( segid "fSH2" and resid 49 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 26 and name hb*  ) or (segid "fSH2" and resid 48 and name hd*  ))
!( segid "fSH2" and resid 49 and name hn ) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 28 and name ha ) or (segid "fSH2" and resid 30 and name hb ))
!( segid "fSH2" and resid 49 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 58 and name hb* ) or ( segid "fSH2" and resid 59 and name hb* ))
( segid "fSH2" and resid 49 and name hn ) 0.0 1.8 5.0


!Residue W192 (50)

!Residue D193 (51)
assign (( segid "fSH2" and resid 51 and name ha )or ( segid "fSH2" and resid 52 and name ha ))
( segid "fSH2" and resid 52 and name hn ) 0.0 1.8 2.7

assign (( segid "fSH2" and resid 51 and name hb1 )or ( segid "fSH2" and resid 52 and name hb1 ))
( segid "fSH2" and resid 51 and name hn ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 51 and name hb2 )or ( segid "fSH2" and resid 52 and name hb2 ))
( segid "fSH2" and resid 51 and name hn ) 0.0 1.8 3.5

!Residue D194 (52)
assign (( segid "fSH2" and resid 51 and name hb1 )or ( segid "fSH2" and resid 52 and name hb1 ))
( segid "fSH2" and resid 52 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 51 and name hb2 )or ( segid "fSH2" and resid 52 and name hb2 ))
( segid "fSH2" and resid 52 and name hn ) 0.0 1.8 5.0

!Residue M195 (53)

assign (( segid "fSH2" and resid 51 and name hb1 )or ( segid "fSH2" and resid 52 and name hb1 ))
( segid "fSH2" and resid 53 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 51 and name hb2 )or ( segid "fSH2" and resid 52 and name hb2 ))
( segid "fSH2" and resid 53 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 51 and name ha )or ( segid "fSH2" and resid 52 and name ha ))
( segid "fSH2" and resid 53 and name hn ) 0.0 1.8 3.5

!Residue K196 (54)
assign (( segid "fSH2" and resid 51 and name ha )or ( segid "fSH2" and resid 52 and name ha ))
( segid "fSH2" and resid 54 and name hn ) 0.0 1.8 5.0

!Residue G197 (55)
assign (( segid "fSH2" and resid 51 and name hb1 )or ( segid "fSH2" and resid 52 and name hb1 ))
( segid "fSH2" and resid 55 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 51 and name hb2 )or ( segid "fSH2" and resid 52 and name hb2 ))
( segid "fSH2" and resid 55 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 51 and name ha )or ( segid "fSH2" and resid 52 and name ha ))
( segid "fSH2" and resid 55 and name hn ) 0.0 1.8 5.0

!Residue D198 (56)
!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 56 and name hb1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 56 and name hb2 ) 0.0 1.8 5.0

!Residue H199 (57)
!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 57 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
( segid "fSH2" and resid 57 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 58 and name hb* ) or ( segid "fSH2" and resid 59 and name hb* ))
( segid "fSH2" and resid 57 and name hn ) 0.0 1.8 5.0

!Residue V200 (58)
!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 58 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
( segid "fSH2" and resid 58 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 58 and name hb* ) or ( segid "fSH2" and resid 59 and name hb* ))
( segid "fSH2" and resid 58 and name hn ) 0.0 1.8 3.5 !m.c.

!Residue K201 (59)
!assign (( segid "fSH2" and resid 46 and name hn  ) or ( segid "fSH2" and resid 47 and name hn ))
!( segid "fSH2" and resid 59 and name hn  ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 48 and name hb* ) or ( segid "fSH2" and resid 49 and name hb2 ))
( segid "fSH2" and resid 59 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 21 and name hd*)or ( segid "fSH2" and resid 22 and name hd2*))
!( segid "fSH2" and resid 59 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 58 and name hb* ) or ( segid "fSH2" and resid 59 and name hb* ))
( segid "fSH2" and resid 59 and name hn ) 0.0 1.8 3.5 !m.c.

!Residue H202 (60)
assign (( segid "fSH2" and resid 60 and name hd2 ) or ( segid "fSH2" and resid 204 and name he* ))
( segid "fSH2" and resid 60 and name hb1 ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 60 and name hd2 ) or ( segid "fSH2" and resid 204 and name he* ))
( segid "fSH2" and resid 60 and name hb2 ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 58 and name hb* ) or ( segid "fSH2" and resid 59 and name hb* ))
( segid "fSH2" and resid 60 and name he1 ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 58 and name hb* ) or ( segid "fSH2" and resid 59 and name hb* ))
( segid "fSH2" and resid 60 and name hn ) 0.0 1.8 3.5

!Residue Y203 (61)

!Residue K204 (62)

!Residue I205 (63)
assign (( segid "fSH2" and resid 45 and name hn  ) or ( segid "fSH2" and resid 62 and name hn ))
( segid "fSH2" and resid 63 and name hn  ) 0.0 1.8 3.5

!Residue R206 (64)
!assign (( segid "fSH2" and resid 44 and name ha  ) or ( segid "fSH2" and resid 71 and name ha ))
!( segid "fSH2" and resid 64 and name hn  ) 0.0 1.8 5.0

!Residue K207 (65)

!Residue L208 (66)
!assign (( segid "fSH2" and resid 69 and name ha2 ) or ( segid "fSH2" and resid 70 and name ha2 ))
!( segid "fSH2" and resid 66 and name hn  ) 0.0 1.8 5.0

!Residue D209 (67)

!Residue N210 (68)
!assign (( segid "fSH2" and resid 69 and name ha2 ) or ( segid "fSH2" and resid 70 and name ha2 ))
!( segid "fSH2" and resid 68 and name hn  ) 0.0 1.8 5.0

!Residue G211 (69)
assign (( segid "fSH2" and resid 69 and name ha2 ) or ( segid "fSH2" and resid 70 and name ha2 ))
( segid "fSH2" and resid 69 and name hn  ) 0.0 1.8 2.7

!Residue G212 (70)
assign (( segid "fSH2" and resid 69 and name ha2 ) or ( segid "fSH2" and resid 70 and name ha2 ))
( segid "fSH2" and resid 70 and name hn  ) 0.0 1.8 3.5

!Residue Y213 (71)
!assign (( segid "fSH2" and resid 63 and name hg2*) or ( segid "fSH2" and resid 85 and name hd1*))
!( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 63 and name hg2*) or ( segid "fSH2" and resid 85 and name hd2*))
( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 5.0


assign (( segid "fSH2" and resid 69 and name ha2 ) or ( segid "fSH2" and resid 70 and name ha2 ))
( segid "fSH2" and resid 71 and name hn  ) 0.0 1.8 3.5 !2.7 unable to be satisfied

!Residue Y214 (72)
!assign (( segid "fSH2" and resid 63 and name hg2*) or ( segid "fSH2" and resid 85 and name hd1*))
!( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 66 and name hb* ) or ( segid "fSH2" and resid 66 and name hg ))
( segid "fSH2" and resid 72 and name he* ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 66 and name hb* ) or ( segid "fSH2" and resid 66 and name hg ))
( segid "fSH2" and resid 72 and name hd* ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 71 and name hb1) or ( segid "fSH2" and resid 72 and name hb2))
!( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 71 and name hb1) or ( segid "fSH2" and resid 72 and name hb1))
( segid "fSH2" and resid 72 and name hn  ) 0.0 1.8 3.5



!Residue I215 (73)
!assign (( segid "fSH2" and resid 63 and name hg2*) or ( segid "fSH2" and resid 85 and name hd1*))
!( segid "fSH2" and resid 73 and name hn  ) 0.0 1.8 5.0

!Residue T216 (74)

!Residue T217 (75)

!Residue R218 (76)

!Residue A219 (77)

!Residue Q220 (78)

!Residue F221 (79)
!assign (( segid "fSH2" and resid 71 and name hb1) or ( segid "fSH2" and resid 72 and name hb2))
!( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 71 and name hb1) or ( segid "fSH2" and resid 72 and name hb1))
( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0


assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 79 and name hb*) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 69 and name ha2 ) or ( segid "fSH2" and resid 70 and name ha2 ))
!( segid "fSH2" and resid 79 and name hn  ) 0.0 1.8 5.0

!Residue E222 (80)

!Residue T223 (81)
assign (( segid "fSH2" and resid 82 and name hn ) or ( segid "fSH2" and resid 83 and name hn))
( segid "fSH2" and resid 81 and name hg1 ) 0.0 1.8 5.0

!Residue L224 (82)
!assign (( segid "fSH2" and resid  2 and name hd1*) or ( segid "fSH2" and resid 33 and name hd1*))
!( segid "fSH2" and resid 82 and name hb* ) 0.0 1.8 5.0
!assign (( segid "fSH2" and resid  2 and name hd1*) or ( segid "fSH2" and resid 33 and name hd1*))
!( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid  8 and name he* ) or  ( segid "fSH2" and resid 43 and name he* ))
!( segid "fSH2" and resid 82 and name hd2*) 0.0 1.8 5.0
assign (( segid "fSH2" and resid  8 and name he* ) or  ( segid "fSH2" and resid 43 and name he* ))
( segid "fSH2" and resid 82 and name hd1*) 0.0 1.8 5.0

!Residue Q225 (83)
!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 83 and name ha ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 83 and name hb*) 0.0 1.8 5.0

!Residue Q226 (84)
!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 84 and name hn ) 0.0 1.8 5.0

!Residue L227 (85)
assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 85 and name hn ) 0.0 1.8 2.7

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 85 and name ha ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
!( segid "fSH2" and resid 85 and name hd1*) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
!( segid "fSH2" and resid 85 and name hd2*) 0.0 1.8 3.5

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 85 and name hn ) 0.0 1.8 5.0

!Residue V228 (86)
assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
(( segid "fSH2" and resid 86 and name hn )  or ( segid "fSH2" and resid 87 and name hn)) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 86 and name hg1*) 0.0 1.8 2.7

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 86 and name hg2*) 0.0 1.8 2.7

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 86 and name ha) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 86 and name hb) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 89 and name hd* ) or ( segid "fSH2" and resid 91 and name hn ))
( segid "fSH2" and resid 86 and name hn ) 0.0 1.8 5.0

!Residue Q229 (87)
assign (( segid "fSH2" and resid 86 and name hn )  or ( segid "fSH2" and resid 87 and name hn))
( segid "fSH2" and resid 87 and name hb1 ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 86 and name hn )  or ( segid "fSH2" and resid 87 and name hn))
( segid "fSH2" and resid 87 and name hb2 ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 89 and name hd* ) or ( segid "fSH2" and resid 91 and name hn ))
( segid "fSH2" and resid 87 and name hn ) 0.0 1.8 5.0


!Residue H230 (88)
assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
( segid "fSH2" and resid 88 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 88 and name hn) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 89 and name hd* ) or ( segid "fSH2" and resid 91 and name hn ))
( segid "fSH2" and resid 88 and name hn ) 0.0 1.8 5.0

!Residue Y231 (89)
!assign (( segid "fSH2" and resid 86 and name hd1* ) or ( segid "fSH2" and resid 100 and name hd1* ))
!( segid "fSH2" and resid 89 and name hb1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 96 and name hd2* ) or ( segid "fSH2" and resid 86 and name hg2* ))
!( segid "fSH2" and resid 89 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 89 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
( segid "fSH2" and resid 89 and name hn) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 89 and name hd* ) or ( segid "fSH2" and resid 91 and name hn ))
( segid "fSH2" and resid 89 and name hn ) 0.0 1.8 3.5

!Residue S232 (90)
!assign (( segid "fSH2" and resid 96 and name hd2* ) or ( segid "fSH2" and resid 86 and name hg2* ))
!( segid "fSH2" and resid 90 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 90 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 90 and name hb1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 90 and name hb2 ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 89 and name hd* ) or ( segid "fSH2" and resid 91 and name hn ))
( segid "fSH2" and resid 90 and name hn ) 0.0 1.8 3.5


!Residue E233 (91)
!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 91 and name hn ) 0.0 1.8 5.0

!Residue R234 (92)
!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 92 and name hn ) 0.0 1.8 5.0

!Residue A235 (93)
!assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
!( segid "fSH2" and resid 93 and name hn ) 0.0 1.8 2.7

!Residue A236 (94)
assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
( segid "fSH2" and resid 94 and name hn ) 0.0 1.8 2.7

!Residue G237 (95)
assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
( segid "fSH2" and resid 95 and name hn ) 0.0 1.8 2.7

!assign (( segid "fSH2" and resid 207 and name hg1* ) or ( segid "fSH2" and resid 209 and name hg1*  ))
!( segid "fSH2" and resid 95 and name ha1 ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 207 and name hg1* ) or ( segid "fSH2" and resid 209 and name hg1*  ))
!( segid "fSH2" and resid 95 and name ha2 ) 0.0 1.8 5.0

!Residue L238 (96)
assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
( segid "fSH2" and resid 96 and name hn ) 0.0 1.8 3.5

assign (( segid "fSH2" and resid 89 and name hd* ) or ( segid "fSH2" and resid 91 and name hn ))
( segid "fSH2" and resid 96 and name hn ) 0.0 1.8 5.0

!Residue S239 (97)
!assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
!( segid "fSH2" and resid 97 and name hn ) 0.0 1.8 5.0

!Residue S240 (98)
!assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
!( segid "fSH2" and resid 98 and name hn ) 0.0 1.8 5.0

!Residue R241 (99)
!assign (( segid "fSH2" and resid 93 and name hb* ) or ( segid "fSH2" and resid 94 and name hb*  ))
!( segid "fSH2" and resid 99 and name hn ) 0.0 1.8 3.5

!Residue L242 (100)
!assign (( segid "fSH2" and resid 45 and name hd1*) or ( segid "fSH2" and resid 47 and name hd1*))
!( segid "fSH2" and resid 100 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 100 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
!( segid "fSH2" and resid 100 and name ha ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 86 and name hg1*) or ( segid "fSH2" and resid 100 and name hd1*))
( segid "fSH2" and resid 100 and name hd2* ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 86 and name hn  ) or ( segid "fSH2" and resid 87 and name hn  ))
!( segid "fSH2" and resid 100 and name hd2*) 0.0 1.8 5.0

!Residue V243 (101)

!Residue V244 (102)
assign (( segid "fSH2" and resid 30 and name hg2* ) or ( segid "fSH2" and resid 102 and name hg1* ))
( segid "fSH2" and resid 102 and name hn ) 0.0 1.8 5.0

!assign (( segid "fSH2" and resid 9 and name hd*)or ( segid "fSH2" and resid 31 and name hd* ))
!( segid "fSH2" and resid 102 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 31 and name hd* ) or ( segid "fSH2" and resid 31 and name he* ))
( segid "fSH2" and resid 102 and name hn ) 0.0 1.8 5.0

!Residue 245 (103)

!Residue 246 (104)
!assign (( segid "fSH2" and resid 27 and name hd1 ) or ( segid "fSH2" and resid 104 and name hb1 ))
!( segid "fSH2" and resid 104 and name hn ) 0.0 1.8 5.0

assign (( segid "fSH2" and resid 103 and name hb* ) or ( segid "fSH2" and resid 103 and name hg* ))
( segid "fSH2" and resid 104 and name hn ) 0.0 1.8 2.7

!Residue 247 (105)
assign (( segid "fSH2" and resid 2 and name hd1* ) or ( segid "fSH2" and resid 33 and name hd1*)
     or ( segid "fSH2" and resid 101 and name hg1* ))
( segid "fSH2" and resid 105 and name hn ) 0.0 1.8 5.0

!Residue 248 (106)
assign (( segid "fSH2" and resid  105 and name ha ) or ( segid "fSH2" and resid 105 and name hb1 ))
( segid "fSH2" and resid 106 and name hn ) 0.0 1.8 3.5



!HYDROGEN BOND NOES

!bA

!Residue 151F (9) - Residue 175I (33) (100% unrestrained)
assign ( segid "fSH2" and resid 9 and name hn )( segid "fSH2" and resid 33 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 9 and name  n )( segid "fSH2" and resid 33 and name o ) 0.0 2.3 3.3

!AA loop

!aA

!Residue 160E (18) - Residue 156R (14)
assign ( segid "fSH2" and resid 18 and name hn )( segid "fSH2" and resid 14 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 18 and name  n )( segid "fSH2" and resid 14 and name o ) 0.0 2.3 3.3

!Residue 161R (19) - Residue 157K (15)
assign ( segid "fSH2" and resid 19 and name hn )( segid "fSH2" and resid 15 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 19 and name  n )( segid "fSH2" and resid 15 and name o ) 0.0 2.3 3.3

!Residue 162Q (20) - Residue 158D (16)
assign ( segid "fSH2" and resid 20 and name hn )( segid "fSH2" and resid 16 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 20 and name  n )( segid "fSH2" and resid 16 and name o ) 0.0 2.3 3.3

!Residue 163L (21) - Residue 159A (17)
assign ( segid "fSH2" and resid 21 and name hn )( segid "fSH2" and resid 17 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 21 and name  n )( segid "fSH2" and resid 17 and name o ) 0.0 2.3 3.3

!Residue 164L (22) - Residue 160E (18)
assign ( segid "fSH2" and resid 22 and name hn )( segid "fSH2" and resid 18 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 22 and name  n )( segid "fSH2" and resid 18 and name o ) 0.0 2.3 3.3

!Residue 165S (23) - Residue 161R (19)
assign ( segid "fSH2" and resid 23 and name hn )( segid "fSH2" and resid 19 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 23 and name  n )( segid "fSH2" and resid 19 and name o ) 0.0 2.3 3.3

!bB

!Residue 174L (32) - Residue 188S (46) (60% second round of hbonds & no other acceptor)
assign ( segid "fSH2" and resid 32 and name hn )( segid "fSH2" and resid 46 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 32 and name  n )( segid "fSH2" and resid 46 and name o ) 0.0 2.3 3.3

!Residue 176R (34) - Residue 186S (44) (70% unrestrained)
assign ( segid "fSH2" and resid 34 and name hn )( segid "fSH2" and resid 44 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 34 and name  n )( segid "fSH2" and resid 44 and name o ) 0.0 2.3 3.3

!Residue 177E (35) - Residue 152G (10) (70% unrestrained)
assign ( segid "fSH2" and resid 35 and name hn )( segid "fSH2" and resid 10 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 35 and name  n )( segid "fSH2" and resid 10 and name o ) 0.0 2.3 3.3

!Residue 178S (36) - Residue 184A (42) (100% unrestrained)
assign ( segid "fSH2" and resid 36 and name hn )( segid "fSH2" and resid 42 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 36 and name  n )( segid "fSH2" and resid 42 and name o ) 0.0 2.3 3.3

!BC loop

!bC

!Residue 187L (45) - Residue 203Y (61) (90% unrestrained)
assign ( segid "fSH2" and resid 45 and name hn )( segid "fSH2" and resid 61 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 45 and name  n )( segid "fSH2" and resid 61 and name o ) 0.0 2.3 3.3

!Residue 189I (47) - Residue 201K (59) (80% unrestrained)
assign ( segid "fSH2" and resid 47 and name hn )( segid "fSH2" and resid 59 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 47 and name  n )( segid "fSH2" and resid 59 and name o ) 0.0 2.3 3.3

!Residue 190R (48) - Residue 172T (30) (60% in third round of hbonds)
assign ( segid "fSH2" and resid 48 and name hn )( segid "fSH2" and resid 30 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 48 and name  n )( segid "fSH2" and resid 30 and name o ) 0.0 2.3 3.3

!Residue 191D (49) - Residue 199H (57) (90% unrestrained)
assign ( segid "fSH2" and resid 49 and name hn )( segid "fSH2" and resid 57 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 49 and name  n )( segid "fSH2" and resid 57 and name o ) 0.0 2.3 3.3

!CD loop

!Residue 193D (51) - Residue 197G (55) (70% unrestrained)
assign ( segid "fSH2" and resid 51 and name hn )( segid "fSH2" and resid 55 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 51 and name  n )( segid "fSH2" and resid 55 and name o ) 0.0 2.3 3.3

!bD

!Residue 201K (59) - Residue 189I (47) (100% unrestrained)
assign ( segid "fSH2" and resid 59 and name hn )( segid "fSH2" and resid 47 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 59 and name  n )( segid "fSH2" and resid 47 and name o ) 0.0 2.3 3.3

!Residue 203Y (61) - Residue 187L (45) (90% unrestrained)
assign ( segid "fSH2" and resid 61 and name hn )( segid "fSH2" and resid 45 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 61 and name  n )( segid "fSH2" and resid 45 and name o ) 0.0 2.3 3.3

!Residue 205I (63) - Residue Y185 (43) (100% unrestrained)
assign ( segid "fSH2" and resid 63 and name hn )( segid "fSH2" and resid 43 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 63 and name  n )( segid "fSH2" and resid 43 and name o ) 0.0 2.3 3.3

!Residue 206R (64) - Residue 214Y (72) (60% unrestrained)
assign ( segid "fSH2" and resid 64 and name hn )( segid "fSH2" and resid 72 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 64 and name  n )( segid "fSH2" and resid 72 and name o ) 0.0 2.3 3.3

!Residue 208L (66) - Residue 212G (70) (90% unrestrained)
assign ( segid "fSH2" and resid 66 and name hn )( segid "fSH2" and resid 70 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 66 and name  n )( segid "fSH2" and resid 70 and name o ) 0.0 2.3 3.3

!bE

!Residue 213Y (71) - Residue 221F (79) (100% unrestrained)
assign ( segid "fSH2" and resid 71 and name hn )( segid "fSH2" and resid 79 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 71 and name  n )( segid "fSH2" and resid 79 and name o ) 0.0 2.3 3.3

!Residue 214Y (72) - Residue 206R (64) (80% in second round of hbonds)
assign ( segid "fSH2" and resid 72 and name hn )( segid "fSH2" and resid 64 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 72 and name  n )( segid "fSH2" and resid 64 and name o ) 0.0 2.3 3.3

!bF

!Residue 219A (77) - Residue 216T (74) (100% unrestrained)
assign ( segid "fSH2" and resid 77 and name hn )( segid "fSH2" and resid 74 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 77 and name  n )( segid "fSH2" and resid 74 and name o ) 0.0 2.3 3.3

!Residue 221F (79) - Residue 213Y (71) (60% fourth round of hbonds)
assign ( segid "fSH2" and resid 79 and name hn )( segid "fSH2" and resid 71 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 79 and name  n )( segid "fSH2" and resid 71 and name o ) 0.0 2.3 3.3

!FB loop

!aB

!Residue 227L (85) - Residue 223T (81)
assign ( segid "fSH2" and resid 85 and name hn )( segid "fSH2" and resid 81 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 85 and name  n )( segid "fSH2" and resid 81 and name o ) 0.0 2.3 3.3

!Residue 228V (86) - Residue 224L (82)
assign ( segid "fSH2" and resid 86 and name hn )( segid "fSH2" and resid 82 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 86 and name  n )( segid "fSH2" and resid 82 and name o ) 0.0 2.3 3.3

!Residue 229E (87) - Residue 225Q (83)
assign ( segid "fSH2" and resid 87 and name hn )( segid "fSH2" and resid 83 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 87 and name  n )( segid "fSH2" and resid 83 and name o ) 0.0 2.3 3.3

!Residue 230H (88) - Residue 226Q (84)
assign ( segid "fSH2" and resid 88 and name hn )( segid "fSH2" and resid 84 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 88 and name  n )( segid "fSH2" and resid 84 and name o ) 0.0 2.3 3.3

!Residue 231E (89) - Residue 227 (85)
assign ( segid "fSH2" and resid 89 and name hn )( segid "fSH2" and resid 85 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 89 and name  n )( segid "fSH2" and resid 85 and name o ) 0.0 2.3 3.3

!Residue 232S (90) - Residue 228V (86)
assign ( segid "fSH2" and resid 90 and name hn )( segid "fSH2" and resid 86 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 90 and name  n )( segid "fSH2" and resid 86 and name o ) 0.0 2.3 3.3

!Residue 234R (92) - Residue 230H (88)
assign ( segid "fSH2" and resid 92 and name hn )( segid "fSH2" and resid 88 and name o ) 0.0 1.5 2.3
assign ( segid "fSH2" and resid 92 and name  n )( segid "fSH2" and resid 88 and name o ) 0.0 2.3 3.3

!bG
!dihedral angle restraints generated from
!fsh2_exp_dihe.txt

restraints
  dihedral

{PHI residue I144 4.5}
assign (segid "fSH2" and resid 1 and name C )(segid "fSH2" and resid 2 and name N )
       (segid "fSH2" and resid 2 and name CA)(segid "fSH2" and resid 2 and name C ) 1 -60 30 2

{PHI residue Q145 4.3}
assign (segid "fSH2" and resid 2 and name C )(segid "fSH2" and resid 3 and name N )
       (segid "fSH2" and resid 3 and name CA)(segid "fSH2" and resid 3 and name C ) 1 -60 30 2

{PHI residue R156 3.0}
assign (segid "fSH2" and resid 13 and name C )(segid "fSH2" and resid 14 and name N )
       (segid "fSH2" and resid 14 and name CA)(segid "fSH2" and resid 14 and name C ) 1 -60 30 2

{PHI residue K157 4.7}
assign (segid "fSH2" and resid 14 and name C )(segid "fSH2" and resid 15 and name N )
       (segid "fSH2" and resid 15 and name CA)(segid "fSH2" and resid 15 and name C ) 1 -60 30 2

{PHI residue D158 4.9}
assign (segid "fSH2" and resid 15 and name C )(segid "fSH2" and resid 16 and name N )
       (segid "fSH2" and resid 16 and name CA)(segid "fSH2" and resid 16 and name C ) 1 -60 30 2

{PHI residue A159 4.1}
assign (segid "fSH2" and resid 16 and name C )(segid "fSH2" and resid 17 and name N )
       (segid "fSH2" and resid 17 and name CA)(segid "fSH2" and resid 17 and name C ) 1 -60 30 2

{PHI residue E160 5.0}
assign (segid "fSH2" and resid 17 and name C )(segid "fSH2" and resid 18 and name N )
       (segid "fSH2" and resid 18 and name CA)(segid "fSH2" and resid 18 and name C ) 1 -60 40 2

{PHI residue R161 3.7}
assign (segid "fSH2" and resid 18 and name C )(segid "fSH2" and resid 19 and name N )
       (segid "fSH2" and resid 19 and name CA)(segid "fSH2" and resid 19 and name C ) 1 -60 30 2

{PHI residue Q162 3.4}
assign (segid "fSH2" and resid 19 and name C )(segid "fSH2" and resid 20 and name N )
       (segid "fSH2" and resid 20 and name CA)(segid "fSH2" and resid 20 and name C ) 1 -60 30 2

{PHI residue L163 5.0}
assign (segid "fSH2" and resid 20 and name C )(segid "fSH2" and resid 21 and name N )
       (segid "fSH2" and resid 21 and name CA)(segid "fSH2" and resid 21 and name C ) 1 -60 40 2

{PHI residue R170 4.8}
assign (segid "fSH2" and resid 27 and name C )(segid "fSH2" and resid 28 and name N )
       (segid "fSH2" and resid 28 and name CA)(segid "fSH2" and resid 28 and name C ) 1 -60 30 2

{PHI residue T172 5.4}
assign (segid "fSH2" and resid 29 and name C )(segid "fSH2" and resid 30 and name N )
       (segid "fSH2" and resid 30 and name CA)(segid "fSH2" and resid 30 and name C ) 1 -60 40 2

{PHI residue I175 8.3}
assign (segid "fSH2" and resid 32 and name C )(segid "fSH2" and resid 33 and name N )
       (segid "fSH2" and resid 33 and name CA)(segid "fSH2" and resid 33 and name C ) 1 -120 40 2

{PHI residue K182 4.2}
assign (segid "fSH2" and resid 39 and name C )(segid "fSH2" and resid 40 and name N )
       (segid "fSH2" and resid 40 and name CA)(segid "fSH2" and resid 40 and name C ) 1 -60 30 2

{PHI residue A184 8.6}
assign (segid "fSH2" and resid 41 and name C )(segid "fSH2" and resid 42 and name N )
       (segid "fSH2" and resid 42 and name CA)(segid "fSH2" and resid 42 and name C ) 1 -120 40 2

{PHI residue Y185 8.6}
assign (segid "fSH2" and resid 42 and name C )(segid "fSH2" and resid 43 and name N )
       (segid "fSH2" and resid 43 and name CA)(segid "fSH2" and resid 43 and name C ) 1 -120 40 2

{PHI residue S186 8.9}
assign (segid "fSH2" and resid 43 and name C )(segid "fSH2" and resid 44 and name N )
       (segid "fSH2" and resid 44 and name CA)(segid "fSH2" and resid 44 and name C ) 1 -120 40 2

{PHI residue D191 8.8}
assign (segid "fSH2" and resid 48 and name C )(segid "fSH2" and resid 49 and name N )
       (segid "fSH2" and resid 49 and name CA)(segid "fSH2" and resid 49 and name C ) 1 -120 40 2

{PHI residue D194 5.0}
assign (segid "fSH2" and resid 51 and name C )(segid "fSH2" and resid 52 and name N )
       (segid "fSH2" and resid 52 and name CA)(segid "fSH2" and resid 52 and name C ) 1 -60 40 2

{PHI residue M195 8.4}
assign (segid "fSH2" and resid 52 and name C )(segid "fSH2" and resid 53 and name N )
       (segid "fSH2" and resid 53 and name CA)(segid "fSH2" and resid 53 and name C ) 1 -120 40 2

{PHI residue D198 4.9}
assign (segid "fSH2" and resid 55 and name C )(segid "fSH2" and resid 56 and name N )
       (segid "fSH2" and resid 56 and name CA)(segid "fSH2" and resid 56 and name C ) 1 -60 30 2

{PHI residue V200 8.6}
assign (segid "fSH2" and resid 57 and name C )(segid "fSH2" and resid 58 and name N )
       (segid "fSH2" and resid 58 and name CA)(segid "fSH2" and resid 58 and name C ) 1 -120 40 2

{PHI residue K201 8.8}
assign (segid "fSH2" and resid 58 and name C )(segid "fSH2" and resid 59 and name N )
       (segid "fSH2" and resid 59 and name CA)(segid "fSH2" and resid 59 and name C ) 1 -120 40 2

{PHI residue H202 9.2}
assign (segid "fSH2" and resid 59 and name C )(segid "fSH2" and resid 60 and name N )
       (segid "fSH2" and resid 60 and name CA)(segid "fSH2" and resid 60 and name C ) 1 -120 40 2

{PHI residue Y203 8.7}
assign (segid "fSH2" and resid 60 and name C )(segid "fSH2" and resid 61 and name N )
       (segid "fSH2" and resid 61 and name CA)(segid "fSH2" and resid 61 and name C ) 1 -120 40 2

{PHI residue I205 9.4}
assign (segid "fSH2" and resid 62 and name C )(segid "fSH2" and resid 63 and name N )
       (segid "fSH2" and resid 63 and name CA)(segid "fSH2" and resid 63 and name C ) 1 -120 40 2

{PHI residue K207 8.0}
assign (segid "fSH2" and resid 64 and name C )(segid "fSH2" and resid 65 and name N )
       (segid "fSH2" and resid 65 and name CA)(segid "fSH2" and resid 65 and name C ) 1 -120 40 2

{PHI residue D209 2.9}
assign (segid "fSH2" and resid 66 and name C )(segid "fSH2" and resid 67 and name N )
       (segid "fSH2" and resid 67 and name CA)(segid "fSH2" and resid 67 and name C ) 1 -60 30 2

{PHI residue Q220 8.0}
assign (segid "fSH2" and resid 77 and name C )(segid "fSH2" and resid 78 and name N )
       (segid "fSH2" and resid 78 and name CA)(segid "fSH2" and resid 78 and name C ) 1 -120 40 2

{PHI residue F221 9.3}
assign (segid "fSH2" and resid 78 and name C )(segid "fSH2" and resid 79 and name N )
       (segid "fSH2" and resid 79 and name CA)(segid "fSH2" and resid 79 and name C ) 1 -120 40 2

{PHI residue T223 8.2}
assign (segid "fSH2" and resid 80 and name C )(segid "fSH2" and resid 81 and name N )
       (segid "fSH2" and resid 81 and name CA)(segid "fSH2" and resid 81 and name C ) 1 -120 40 2

{PHI residue Q225 3.7}
assign (segid "fSH2" and resid 82 and name C )(segid "fSH2" and resid 83 and name N )
       (segid "fSH2" and resid 83 and name CA)(segid "fSH2" and resid 83 and name C ) 1 -60 30 2

{PHI residue L227 4.7}
assign (segid "fSH2" and resid 84 and name C )(segid "fSH2" and resid 85 and name N )
       (segid "fSH2" and resid 85 and name CA)(segid "fSH2" and resid 85 and name C ) 1 -60 30 2

{PHI residue H230 4.4}
assign (segid "fSH2" and resid 87 and name C )(segid "fSH2" and resid 88 and name N )
       (segid "fSH2" and resid 88 and name CA)(segid "fSH2" and resid 88 and name C ) 1 -60 30 2

{PHI residue S232 5.4}
assign (segid "fSH2" and resid 89 and name C )(segid "fSH2" and resid 90 and name N )
       (segid "fSH2" and resid 90 and name CA)(segid "fSH2" and resid 90 and name C ) 1 -60 40 2

{PHI residue A235 2.9}
assign (segid "fSH2" and resid 92 and name C )(segid "fSH2" and resid 93 and name N )
       (segid "fSH2" and resid 93 and name CA)(segid "fSH2" and resid 93 and name C ) 1 -60 30 2

{PHI residue L238 9.9}
assign (segid "fSH2" and resid 95 and name C )(segid "fSH2" and resid 96 and name N )
       (segid "fSH2" and resid 96 and name CA)(segid "fSH2" and resid 96 and name C ) 1 -120 40 2

{PHI residue S239 5.0}
assign (segid "fSH2" and resid 96 and name C )(segid "fSH2" and resid 97 and name N )
       (segid "fSH2" and resid 97 and name CA)(segid "fSH2" and resid 97 and name C ) 1 -60 40 2

{PHI residue H247 4.8}
assign (segid "fSH2" and resid 104 and name C )(segid "fSH2" and resid 105 and name N )
       (segid "fSH2" and resid 105 and name CA)(segid "fSH2" and resid 105 and name C ) 1 -60 30 2

end


	  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    SER   1          2HT       SER   1  -4.641  -9.900 -23.316
    2   2H    SER   1          1HT       SER   1  -5.350  -9.774 -24.854
    3   3H    SER   1          3HT       SER   1  -3.745 -10.302 -24.702
    4    HA   SER   1           HA       SER   1  -3.073  -8.144 -23.865
    5   1HB   SER   1          2HB       SER   1  -3.253  -6.949 -25.950
    6   2HB   SER   1          1HB       SER   1  -3.141  -8.664 -26.344
    7    HG   SER   1           HG       SER   1  -5.045  -6.981 -27.012
    8    H    ILE   2           H        ILE   2  -4.615  -7.855 -21.973
    9    HA   ILE   2           HA       ILE   2  -7.181  -6.827 -22.029
   10    HB   ILE   2           HB       ILE   2  -6.223  -5.261 -20.082
   11   1HG1  ILE   2          2HG1      ILE   2  -4.119  -7.428 -20.226
   12   2HG1  ILE   2          1HG1      ILE   2  -3.849  -5.829 -20.919
   13   1HG2  ILE   2          2HG2      ILE   2  -7.134  -7.988 -20.312
   14   2HG2  ILE   2          1HG2      ILE   2  -5.945  -7.867 -19.016
   15   3HG2  ILE   2          3HG2      ILE   2  -7.385  -6.848 -18.990
   16   1HD1  ILE   2          2HD1      ILE   2  -4.915  -5.898 -18.144
   17   2HD1  ILE   2          1HD1      ILE   2  -3.249  -6.432 -18.354
   18   3HD1  ILE   2          3HD1      ILE   2  -3.725  -4.813 -18.867
   19    H    GLN   3           H        GLN   3  -4.877  -4.303 -21.251
   20    HA   GLN   3           HA       GLN   3  -6.272  -2.528 -23.153
   21   1HB   GLN   3          2HB       GLN   3  -5.903  -1.614 -20.951
   22   2HB   GLN   3          1HB       GLN   3  -4.186  -2.008 -21.018
   23   1HG   GLN   3          2HG       GLN   3  -3.836   0.049 -21.875
   24   2HG   GLN   3          1HG       GLN   3  -4.683  -0.482 -23.328
   25   1HE2  GLN   3          2HE2      GLN   3  -6.410   2.529 -21.786
   26   2HE2  GLN   3          1HE2      GLN   3  -4.792   2.238 -22.210
   27    H    ALA   4           H        ALA   4  -2.906  -1.927 -22.465
   28    HA   ALA   4           HA       ALA   4  -1.870  -3.164 -24.869
   29   1HB   ALA   4          1HB       ALA   4  -2.871  -0.375 -24.935
   30   2HB   ALA   4          3HB       ALA   4  -1.299  -0.654 -25.684
   31   3HB   ALA   4          2HB       ALA   4  -2.714  -1.544 -26.247
   32    H    GLU   5           H        GLU   5  -1.418  -0.409 -22.649
   33    HA   GLU   5           HA       GLU   5   0.856  -1.331 -21.340
   34   1HB   GLU   5          2HB       GLU   5   2.642   0.001 -22.667
   35   2HB   GLU   5          1HB       GLU   5   2.134  -1.562 -23.307
   36   1HG   GLU   5          2HG       GLU   5   0.349   0.491 -24.260
   37   2HG   GLU   5          1HG       GLU   5   2.015   0.953 -24.609
   38    H    GLU   6           H        GLU   6  -1.410   0.517 -21.063
   39    HA   GLU   6           HA       GLU   6  -0.008   3.094 -20.545
   40   1HB   GLU   6          2HB       GLU   6  -2.981   2.528 -20.389
   41   2HB   GLU   6          1HB       GLU   6  -2.195   4.106 -20.429
   42   1HG   GLU   6          2HG       GLU   6  -1.762   2.148 -22.674
   43   2HG   GLU   6          1HG       GLU   6  -3.217   3.146 -22.639
   44    H    TRP   7           H        TRP   7  -2.277   0.835 -19.001
   45    HA   TRP   7           HA       TRP   7  -1.161   1.686 -16.367
   46   1HB   TRP   7          2HB       TRP   7  -3.382   0.885 -15.434
   47   2HB   TRP   7          1HB       TRP   7  -3.480   2.331 -16.435
   48    HD1  TRP   7           HD1      TRP   7  -4.975   2.238 -18.520
   49    HE1  TRP   7           HE1      TRP   7  -6.379   0.405 -19.667
   50    HE3  TRP   7           HE3      TRP   7  -3.399  -1.863 -15.906
   51    HZ2  TRP   7           HZ2      TRP   7  -6.779  -2.416 -19.505
   52    HZ3  TRP   7           HZ3      TRP   7  -4.311  -4.107 -16.428
   53    HH2  TRP   7           HH2      TRP   7  -5.997  -4.388 -18.221
   54    H    TYR   8           H        TYR   8  -0.917  -0.673 -18.569
   55    HA   TYR   8           HA       TYR   8  -0.266  -2.692 -16.534
   56   1HB   TYR   8          2HB       TYR   8  -2.339  -3.590 -16.902
   57   2HB   TYR   8          1HB       TYR   8  -2.494  -2.867 -18.496
   58    HD1  TYR   8           HD1      TYR   8  -1.181  -5.723 -16.581
   59    HD2  TYR   8           HD2      TYR   8  -1.588  -3.960 -20.480
   60    HE1  TYR   8           HE1      TYR   8  -0.498  -7.861 -17.624
   61    HE2  TYR   8           HE2      TYR   8  -0.917  -6.108 -21.522
   62    HH   TYR   8           HH       TYR   8  -0.873  -8.484 -20.965
   63    H    PHE   9           H        PHE   9   1.611  -3.650 -17.032
   64    HA   PHE   9           HA       PHE   9   2.714  -3.205 -19.758
   65   1HB   PHE   9          2HB       PHE   9   3.908  -3.611 -17.036
   66   2HB   PHE   9          1HB       PHE   9   4.861  -4.023 -18.461
   67    HD1  PHE   9           HD1      PHE   9   2.307  -1.345 -18.502
   68    HD2  PHE   9           HD2      PHE   9   6.501  -2.233 -18.127
   69    HE1  PHE   9           HE1      PHE   9   2.848   1.048 -18.833
   70    HE2  PHE   9           HE2      PHE   9   7.033   0.163 -18.459
   71    HZ   PHE   9           HZ       PHE   9   5.209   1.803 -18.813
   72    H    GLY  10           H        GLY  10   2.128  -5.750 -17.351
   73   1HA   GLY  10          2HA       GLY  10   1.363  -7.861 -18.777
   74   2HA   GLY  10          1HA       GLY  10   3.053  -7.802 -19.276
   75    H    LYS  11           H        LYS  11   4.357  -9.070 -18.083
   76    HA   LYS  11           HA       LYS  11   3.513  -9.765 -15.311
   77   1HB   LYS  11          2HB       LYS  11   5.601 -11.206 -16.954
   78   2HB   LYS  11          1HB       LYS  11   4.715 -11.805 -15.551
   79   1HG   LYS  11          2HG       LYS  11   2.988 -12.492 -16.837
   80   2HG   LYS  11          1HG       LYS  11   2.911 -10.940 -17.673
   81   1HD   LYS  11          2HD       LYS  11   3.976 -11.790 -19.470
   82   2HD   LYS  11          1HD       LYS  11   5.283 -12.414 -18.463
   83   1HE   LYS  11          2HE       LYS  11   4.306 -14.495 -18.245
   84   2HE   LYS  11          1HE       LYS  11   2.668 -13.858 -18.397
   85   1HZ   LYS  11          3HZ       LYS  11   3.309 -13.344 -20.779
   86   2HZ   LYS  11          2HZ       LYS  11   4.647 -14.362 -20.536
   87   3HZ   LYS  11          1HZ       LYS  11   3.070 -14.977 -20.390
   88    H    LEU  12           H        LEU  12   4.401  -7.541 -14.877
   89    HA   LEU  12           HA       LEU  12   7.379  -7.496 -14.776
   90   1HB   LEU  12          2HB       LEU  12   6.082  -5.631 -15.912
   91   2HB   LEU  12          1HB       LEU  12   5.473  -5.193 -14.317
   92    HG   LEU  12           HG       LEU  12   7.737  -4.826 -13.507
   93   1HD1  LEU  12          3HD1      LEU  12   8.381  -6.381 -15.884
   94   2HD1  LEU  12          2HD1      LEU  12   9.331  -4.897 -15.810
   95   3HD1  LEU  12          1HD1      LEU  12   9.380  -6.041 -14.470
   96   1HD2  LEU  12          3HD2      LEU  12   6.738  -3.462 -15.944
   97   2HD2  LEU  12          2HD2      LEU  12   7.130  -2.797 -14.357
   98   3HD2  LEU  12          1HD2      LEU  12   8.417  -3.148 -15.510
   99    H    GLY  13           H        GLY  13   8.304  -6.395 -12.795
  100   1HA   GLY  13          2HA       GLY  13   6.787  -7.270 -10.372
  101   2HA   GLY  13          1HA       GLY  13   8.547  -7.216 -10.472
  102    H    ARG  14           H        ARG  14   8.251  -5.838  -8.468
  103    HA   ARG  14           HA       ARG  14   7.182  -3.130  -8.936
  104   1HB   ARG  14          2HB       ARG  14   8.721  -3.837  -6.470
  105   2HB   ARG  14          1HB       ARG  14   7.274  -2.843  -6.641
  106   1HG   ARG  14          2HG       ARG  14   6.241  -4.696  -5.788
  107   2HG   ARG  14          1HG       ARG  14   6.303  -5.240  -7.465
  108   1HD   ARG  14          2HD       ARG  14   7.337  -7.055  -6.512
  109   2HD   ARG  14          1HD       ARG  14   8.758  -6.021  -6.661
  110    HE   ARG  14           HE       ARG  14   7.490  -5.460  -4.168
  111   1HH1  ARG  14          2HH1      ARG  14   9.693  -7.490  -5.819
  112   2HH1  ARG  14          1HH1      ARG  14  10.165  -8.373  -4.406
  113   1HH2  ARG  14          1HH2      ARG  14   7.882  -6.788  -2.332
  114   2HH2  ARG  14          2HH2      ARG  14   9.139  -7.976  -2.431
  115    H    LYS  15           H        LYS  15  10.214  -4.726  -9.206
  116    HA   LYS  15           HA       LYS  15  11.876  -2.445  -8.653
  117   1HB   LYS  15          2HB       LYS  15  12.498  -4.992  -8.704
  118   2HB   LYS  15          1HB       LYS  15  12.727  -4.710 -10.430
  119   1HG   LYS  15          2HG       LYS  15  14.083  -2.591  -9.491
  120   2HG   LYS  15          1HG       LYS  15  14.289  -3.670  -8.111
  121   1HD   LYS  15          2HD       LYS  15  15.791  -4.925  -9.234
  122   2HD   LYS  15          1HD       LYS  15  14.696  -5.099 -10.605
  123   1HE   LYS  15          2HE       LYS  15  16.781  -3.956 -11.278
  124   2HE   LYS  15          1HE       LYS  15  15.390  -2.883 -11.443
  125   1HZ   LYS  15          1HZ       LYS  15  17.111  -2.947  -9.031
  126   2HZ   LYS  15          3HZ       LYS  15  17.380  -1.892 -10.331
  127   3HZ   LYS  15          2HZ       LYS  15  15.939  -1.788  -9.439
  128    H    ASP  16           H        ASP  16  10.567  -3.963 -11.571
  129    HA   ASP  16           HA       ASP  16  11.773  -1.968 -13.269
  130   1HB   ASP  16          2HB       ASP  16  11.131  -4.429 -13.844
  131   2HB   ASP  16          1HB       ASP  16   9.527  -3.755 -14.092
  132    H    ALA  17           H        ALA  17   8.535  -2.757 -12.090
  133    HA   ALA  17           HA       ALA  17   6.990  -0.852 -13.367
  134   1HB   ALA  17          3HB       ALA  17   6.306  -2.522 -11.529
  135   2HB   ALA  17          2HB       ALA  17   6.755  -1.251 -10.390
  136   3HB   ALA  17          1HB       ALA  17   5.469  -0.971 -11.565
  137    H    GLU  18           H        GLU  18   8.971  -0.314 -10.451
  138    HA   GLU  18           HA       GLU  18   8.422   2.530 -10.394
  139   1HB   GLU  18          2HB       GLU  18  10.333   2.631  -8.811
  140   2HB   GLU  18          1HB       GLU  18   9.198   1.351  -8.380
  141   1HG   GLU  18          2HG       GLU  18  11.242   0.232  -8.236
  142   2HG   GLU  18          1HG       GLU  18  10.747  -0.142  -9.886
  143    H    ARG  19           H        ARG  19  10.890   0.483 -11.886
  144    HA   ARG  19           HA       ARG  19  12.629   2.619 -12.718
  145   1HB   ARG  19          2HB       ARG  19  12.586  -0.193 -12.922
  146   2HB   ARG  19          1HB       ARG  19  12.633   0.408 -14.579
  147   1HG   ARG  19          2HG       ARG  19  14.437   1.720 -12.595
  148   2HG   ARG  19          1HG       ARG  19  14.864   0.093 -13.127
  149   1HD   ARG  19          2HD       ARG  19  14.066   2.071 -15.218
  150   2HD   ARG  19          1HD       ARG  19  15.657   2.257 -14.482
  151    HE   ARG  19           HE       ARG  19  16.165  -0.060 -15.251
  152   1HH1  ARG  19          1HH2      ARG  19  14.368  -1.723 -16.137
  153   2HH1  ARG  19          2HH2      ARG  19  13.846  -1.257 -17.721
  154   1HH2  ARG  19          2HH1      ARG  19  15.080   1.974 -17.464
  155   2HH2  ARG  19          1HH1      ARG  19  14.249   0.837 -18.473
  156    H    GLN  20           H        GLN  20  10.809   0.602 -15.011
  157    HA   GLN  20           HA       GLN  20  10.747   2.262 -17.184
  158   1HB   GLN  20          2HB       GLN  20   8.729   0.341 -16.087
  159   2HB   GLN  20          1HB       GLN  20   8.267   1.348 -17.458
  160   1HG   GLN  20          2HG       GLN  20  10.833  -0.250 -17.421
  161   2HG   GLN  20          1HG       GLN  20   9.317  -0.916 -18.028
  162   1HE2  GLN  20          2HE2      GLN  20  11.477   1.348 -20.482
  163   2HE2  GLN  20          1HE2      GLN  20  12.083   0.590 -19.090
  164    H    LEU  21           H        LEU  21   8.557   2.524 -14.380
  165    HA   LEU  21           HA       LEU  21   6.941   4.629 -15.388
  166   1HB   LEU  21          2HB       LEU  21   7.604   3.545 -12.711
  167   2HB   LEU  21          1HB       LEU  21   7.012   5.205 -12.736
  168    HG   LEU  21           HG       LEU  21   4.991   4.561 -13.853
  169   1HD1  LEU  21          3HD1      LEU  21   6.377   1.893 -14.213
  170   2HD1  LEU  21          2HD1      LEU  21   4.651   2.126 -14.489
  171   3HD1  LEU  21          1HD1      LEU  21   5.827   2.996 -15.474
  172   1HD2  LEU  21          3HD2      LEU  21   5.833   2.771 -11.586
  173   2HD2  LEU  21          2HD2      LEU  21   4.675   4.101 -11.576
  174   3HD2  LEU  21          1HD2      LEU  21   4.247   2.565 -12.328
  175    H    LEU  22           H        LEU  22   9.824   4.856 -13.295
  176    HA   LEU  22           HA       LEU  22   9.994   7.750 -13.820
  177   1HB   LEU  22          2HB       LEU  22  12.013   6.061 -12.332
  178   2HB   LEU  22          1HB       LEU  22  11.718   7.791 -12.172
  179    HG   LEU  22           HG       LEU  22   9.946   5.511 -11.271
  180   1HD1  LEU  22          2HD1      LEU  22  11.270   7.871  -9.911
  181   2HD1  LEU  22          1HD1      LEU  22  10.070   6.845  -9.125
  182   3HD1  LEU  22          3HD1      LEU  22  11.609   6.160  -9.648
  183   1HD2  LEU  22          3HD2      LEU  22   9.287   8.376 -11.876
  184   2HD2  LEU  22          2HD2      LEU  22   8.326   6.927 -12.165
  185   3HD2  LEU  22          1HD2      LEU  22   8.479   7.571 -10.531
  186    H    SER  23           H        SER  23  10.637   5.294 -15.741
  187    HA   SER  23           HA       SER  23  13.043   6.625 -16.894
  188   1HB   SER  23          2HB       SER  23  12.893   3.944 -15.801
  189   2HB   SER  23          1HB       SER  23  13.281   3.891 -17.520
  190    HG   SER  23           HG       SER  23  15.115   4.899 -17.165
  191    H    PHE  24           H        PHE  24  10.053   6.491 -17.479
  192    HA   PHE  24           HA       PHE  24  10.265   5.404 -20.258
  193   1HB   PHE  24          2HB       PHE  24   8.570   4.237 -18.916
  194   2HB   PHE  24          1HB       PHE  24   7.807   5.776 -18.519
  195    HD1  PHE  24           HD1      PHE  24   9.294   5.126 -21.828
  196    HD2  PHE  24           HD2      PHE  24   5.661   5.195 -19.535
  197    HE1  PHE  24           HE1      PHE  24   7.970   5.010 -23.921
  198    HE2  PHE  24           HE2      PHE  24   4.338   5.079 -21.629
  199    HZ   PHE  24           HZ       PHE  24   5.492   4.986 -23.822
  200    H    GLY  25           H        GLY  25   9.421   8.156 -18.260
  201   1HA   GLY  25          2HA       GLY  25   9.670  10.417 -19.154
  202   2HA   GLY  25          1HA       GLY  25   9.236   9.793 -20.745
  203    H    ASN  26           H        ASN  26   7.278   8.412 -18.374
  204    HA   ASN  26           HA       ASN  26   5.006  10.081 -19.247
  205   1HB   ASN  26          2HB       ASN  26   5.360   7.377 -18.341
  206   2HB   ASN  26          1HB       ASN  26   4.195   8.183 -17.289
  207   1HD2  ASN  26          2HD2      ASN  26   3.275   7.617 -21.251
  208   2HD2  ASN  26          1HD2      ASN  26   4.886   7.475 -20.737
  209    HA   PRO  27           HA       PRO  27   5.035  12.504 -15.570
  210   1HB   PRO  27          2HB       PRO  27   2.466  13.465 -15.759
  211   2HB   PRO  27          1HB       PRO  27   3.808  14.054 -16.752
  212   1HG   PRO  27          2HG       PRO  27   1.539  12.266 -17.512
  213   2HG   PRO  27          1HG       PRO  27   2.491  13.359 -18.529
  214   1HD   PRO  27          2HD       PRO  27   2.796  10.543 -18.360
  215   2HD   PRO  27          1HD       PRO  27   3.936  11.674 -19.120
  216    H    ARG  28           H        ARG  28   3.727  12.739 -13.494
  217    HA   ARG  28           HA       ARG  28   3.240  10.307 -12.216
  218   1HB   ARG  28          2HB       ARG  28   1.751  11.687 -10.652
  219   2HB   ARG  28          1HB       ARG  28   3.404  12.264 -10.861
  220   1HG   ARG  28          2HG       ARG  28   2.749  14.111 -12.071
  221   2HG   ARG  28          1HG       ARG  28   1.358  13.286 -12.774
  222   1HD   ARG  28          2HD       ARG  28   0.628  13.303 -10.160
  223   2HD   ARG  28          1HD       ARG  28   1.580  14.785 -10.223
  224    HE   ARG  28           HE       ARG  28  -0.490  14.420 -12.311
  225   1HH1  ARG  28          2HH1      ARG  28   1.153  16.780 -10.791
  226   2HH1  ARG  28          1HH1      ARG  28  -0.213  17.684 -10.228
  227   1HH2  ARG  28          1HH2      ARG  28  -2.506  15.194 -10.987
  228   2HH2  ARG  28          2HH2      ARG  28  -2.285  16.786 -10.340
  229    H    GLY  29           H        GLY  29   0.906   9.759 -11.271
  230   1HA   GLY  29          2HA       GLY  29  -1.339   9.159 -11.697
  231   2HA   GLY  29          1HA       GLY  29  -1.312  10.217 -13.107
  232    H    THR  30           H        THR  30   1.357   8.184 -13.195
  233    HA   THR  30           HA       THR  30   0.126   6.589 -15.343
  234    HB   THR  30           HB       THR  30   2.956   6.424 -14.268
  235    HG1  THR  30           HG1      THR  30   1.675   8.247 -15.941
  236   1HG2  THR  30          3HG2      THR  30   2.059   4.584 -15.757
  237   2HG2  THR  30          2HG2      THR  30   1.860   5.801 -17.019
  238   3HG2  THR  30          1HG2      THR  30   3.468   5.432 -16.395
  239    H    PHE  31           H        PHE  31  -1.340   5.352 -13.962
  240    HA   PHE  31           HA       PHE  31  -0.220   3.613 -11.901
  241   1HB   PHE  31          2HB       PHE  31  -2.961   3.712 -13.189
  242   2HB   PHE  31          1HB       PHE  31  -2.535   2.676 -11.827
  243    HD1  PHE  31           HD1      PHE  31  -2.593   6.253 -12.921
  244    HD2  PHE  31           HD2      PHE  31  -2.601   3.502  -9.621
  245    HE1  PHE  31           HE1      PHE  31  -3.003   8.132 -11.356
  246    HE2  PHE  31           HE2      PHE  31  -3.010   5.382  -8.055
  247    HZ   PHE  31           HZ       PHE  31  -3.211   7.697  -8.923
  248    H    LEU  32           H        LEU  32   1.332   2.388 -13.070
  249    HA   LEU  32           HA       LEU  32   0.589   0.823 -15.410
  250   1HB   LEU  32          2HB       LEU  32   2.859   1.330 -15.420
  251   2HB   LEU  32          1HB       LEU  32   3.008   1.172 -13.674
  252    HG   LEU  32           HG       LEU  32   2.474  -1.238 -15.413
  253   1HD1  LEU  32          1HD1      LEU  32   4.662   0.299 -15.852
  254   2HD1  LEU  32          3HD1      LEU  32   5.249  -0.676 -14.505
  255   3HD1  LEU  32          2HD1      LEU  32   4.686  -1.459 -15.982
  256   1HD2  LEU  32          2HD2      LEU  32   2.600  -0.816 -12.656
  257   2HD2  LEU  32          1HD2      LEU  32   2.709  -2.376 -13.471
  258   3HD2  LEU  32          3HD2      LEU  32   4.178  -1.493 -13.056
  259    H    ILE  33           H        ILE  33   0.663  -1.588 -15.388
  260    HA   ILE  33           HA       ILE  33  -0.113  -2.724 -12.734
  261    HB   ILE  33           HB       ILE  33  -1.472  -2.995 -15.398
  262   1HG1  ILE  33          2HG1      ILE  33  -2.316  -2.713 -12.515
  263   2HG1  ILE  33          1HG1      ILE  33  -2.538  -1.560 -13.829
  264   1HG2  ILE  33          3HG2      ILE  33  -0.763  -5.307 -14.793
  265   2HG2  ILE  33          2HG2      ILE  33  -1.590  -5.121 -13.247
  266   3HG2  ILE  33          1HG2      ILE  33  -2.513  -5.097 -14.748
  267   1HD1  ILE  33          1HD1      ILE  33  -3.728  -3.999 -14.664
  268   2HD1  ILE  33          3HD1      ILE  33  -4.280  -3.693 -13.019
  269   3HD1  ILE  33          2HD1      ILE  33  -4.537  -2.482 -14.275
  270    H    ARG  34           H        ARG  34   0.212  -5.209 -12.796
  271    HA   ARG  34           HA       ARG  34   1.902  -6.465 -14.687
  272   1HB   ARG  34          2HB       ARG  34   4.086  -6.345 -13.463
  273   2HB   ARG  34          1HB       ARG  34   3.579  -4.792 -14.126
  274   1HG   ARG  34          2HG       ARG  34   2.698  -4.114 -11.945
  275   2HG   ARG  34          1HG       ARG  34   3.099  -5.693 -11.270
  276   1HD   ARG  34          2HD       ARG  34   5.501  -5.265 -11.814
  277   2HD   ARG  34          1HD       ARG  34   5.056  -3.645 -12.350
  278    HE   ARG  34           HE       ARG  34   5.380  -3.173 -10.048
  279   1HH1  ARG  34          2HH1      ARG  34   4.613  -6.425 -10.092
  280   2HH1  ARG  34          1HH1      ARG  34   3.672  -6.411  -8.638
  281   1HH2  ARG  34          1HH2      ARG  34   3.676  -2.955  -8.355
  282   2HH2  ARG  34          2HH2      ARG  34   3.142  -4.447  -7.653
  283    H    GLU  35           H        GLU  35   2.594  -8.562 -13.969
  284    HA   GLU  35           HA       GLU  35   0.887  -9.745 -11.993
  285   1HB   GLU  35          2HB       GLU  35   3.128 -10.636 -13.735
  286   2HB   GLU  35          1HB       GLU  35   2.727 -11.649 -12.354
  287   1HG   GLU  35          2HG       GLU  35   0.293 -11.463 -13.120
  288   2HG   GLU  35          1HG       GLU  35   0.932 -10.795 -14.625
  289    H    SER  36           H        SER  36   1.202 -10.024  -9.841
  290    HA   SER  36           HA       SER  36   3.524  -8.879  -8.527
  291   1HB   SER  36          2HB       SER  36   1.221 -10.551  -7.474
  292   2HB   SER  36          1HB       SER  36   2.437  -9.780  -6.467
  293    HG   SER  36           HG       SER  36   0.365  -8.623  -6.918
  294    H    GLU  37           H        GLU  37   5.389  -9.962  -8.039
  295    HA   GLU  37           HA       GLU  37   5.509 -12.872  -8.573
  296   1HB   GLU  37          2HB       GLU  37   7.588 -10.794  -7.879
  297   2HB   GLU  37          1HB       GLU  37   7.958 -12.510  -8.027
  298   1HG   GLU  37          2HG       GLU  37   6.409 -11.629 -10.305
  299   2HG   GLU  37          1HG       GLU  37   7.837 -10.611 -10.115
  300    H    THR  38           H        THR  38   4.250 -11.349  -6.157
  301    HA   THR  38           HA       THR  38   5.811 -12.374  -3.896
  302    HB   THR  38           HB       THR  38   4.319 -10.223  -4.018
  303    HG1  THR  38           HG1      THR  38   4.152 -12.022  -1.836
  304   1HG2  THR  38          2HG2      THR  38   2.277 -11.397  -4.769
  305   2HG2  THR  38          1HG2      THR  38   2.263 -12.313  -3.262
  306   3HG2  THR  38          3HG2      THR  38   2.021 -10.567  -3.233
  307    H    THR  39           H        THR  39   2.781 -13.105  -5.546
  308    HA   THR  39           HA       THR  39   2.610 -15.621  -3.930
  309    HB   THR  39           HB       THR  39   0.676 -13.892  -3.979
  310    HG1  THR  39           HG1      THR  39  -0.793 -15.597  -3.887
  311   1HG2  THR  39          2HG2      THR  39   0.954 -14.117  -6.685
  312   2HG2  THR  39          1HG2      THR  39  -0.353 -15.262  -6.382
  313   3HG2  THR  39          3HG2      THR  39  -0.523 -13.580  -5.884
  314    H    LYS  40           H        LYS  40   1.106 -17.229  -5.504
  315    HA   LYS  40           HA       LYS  40   2.822 -18.443  -7.289
  316   1HB   LYS  40          2HB       LYS  40  -0.114 -18.224  -7.928
  317   2HB   LYS  40          1HB       LYS  40   0.957 -19.604  -8.169
  318   1HG   LYS  40          2HG       LYS  40   1.221 -19.575  -5.589
  319   2HG   LYS  40          1HG       LYS  40  -0.216 -18.552  -5.600
  320   1HD   LYS  40          2HD       LYS  40  -0.261 -21.092  -7.189
  321   2HD   LYS  40          1HD       LYS  40  -0.434 -21.196  -5.437
  322   1HE   LYS  40          2HE       LYS  40  -2.178 -19.227  -5.847
  323   2HE   LYS  40          1HE       LYS  40  -2.255 -19.945  -7.455
  324   1HZ   LYS  40          2HZ       LYS  40  -2.321 -22.058  -5.694
  325   2HZ   LYS  40          1HZ       LYS  40  -3.356 -20.892  -5.017
  326   3HZ   LYS  40          3HZ       LYS  40  -3.622 -21.444  -6.599
  327    H    GLY  41           H        GLY  41   0.670 -15.727  -7.875
  328   1HA   GLY  41          2HA       GLY  41   2.156 -14.337  -9.703
  329   2HA   GLY  41          1HA       GLY  41   1.342 -15.543 -10.703
  330    H    ALA  42           H        ALA  42   0.659 -13.094  -8.220
  331    HA   ALA  42           HA       ALA  42  -2.145 -12.847  -9.081
  332   1HB   ALA  42          2HB       ALA  42  -0.479 -11.973  -6.822
  333   2HB   ALA  42          1HB       ALA  42  -1.589 -10.724  -7.387
  334   3HB   ALA  42          3HB       ALA  42  -2.214 -12.292  -6.874
  335    H    TYR  43           H        TYR  43  -2.381 -10.017  -8.875
  336    HA   TYR  43           HA       TYR  43  -0.704  -9.200 -11.198
  337   1HB   TYR  43          2HB       TYR  43  -3.551  -9.241 -10.975
  338   2HB   TYR  43          1HB       TYR  43  -3.012  -7.563 -11.088
  339    HD1  TYR  43           HD1      TYR  43  -0.638  -7.590 -12.688
  340    HD2  TYR  43           HD2      TYR  43  -4.188 -10.000 -13.093
  341    HE1  TYR  43           HE1      TYR  43  -0.151  -7.937 -15.105
  342    HE2  TYR  43           HE2      TYR  43  -3.690 -10.343 -15.493
  343    HH   TYR  43           HH       TYR  43  -2.388  -9.767 -17.193
  344    H    SER  44           H        SER  44  -1.156  -6.524 -11.278
  345    HA   SER  44           HA       SER  44  -0.920  -5.372  -8.604
  346   1HB   SER  44          2HB       SER  44   1.470  -5.357 -10.419
  347   2HB   SER  44          1HB       SER  44   1.361  -4.739  -8.760
  348    HG   SER  44           HG       SER  44   1.881  -6.653  -8.144
  349    H    LEU  45           H        LEU  45  -0.504  -3.025  -8.681
  350    HA   LEU  45           HA       LEU  45  -0.950  -1.791 -11.351
  351   1HB   LEU  45          2HB       LEU  45  -3.189  -1.952 -10.382
  352   2HB   LEU  45          1HB       LEU  45  -2.622  -1.180  -8.900
  353    HG   LEU  45           HG       LEU  45  -1.919   0.800 -10.296
  354   1HD1  LEU  45          2HD1      LEU  45  -1.826  -0.542 -12.431
  355   2HD1  LEU  45          1HD1      LEU  45  -3.589  -0.539 -12.436
  356   3HD1  LEU  45          3HD1      LEU  45  -2.704   0.980 -12.569
  357   1HD2  LEU  45          2HD2      LEU  45  -4.757  -0.112 -10.025
  358   2HD2  LEU  45          1HD2      LEU  45  -3.922   1.205  -9.202
  359   3HD2  LEU  45          3HD2      LEU  45  -4.417   1.392 -10.885
  360    H    SER  46           H        SER  46   1.336  -1.294 -10.967
  361    HA   SER  46           HA       SER  46   2.247   0.351  -8.813
  362   1HB   SER  46          2HB       SER  46   3.478   0.641 -11.513
  363   2HB   SER  46          1HB       SER  46   4.252   0.406  -9.945
  364    HG   SER  46           HG       SER  46   3.495  -1.756  -9.995
  365    H    ILE  47           H        ILE  47   2.810   2.684  -8.999
  366    HA   ILE  47           HA       ILE  47   1.308   4.173 -11.065
  367    HB   ILE  47           HB       ILE  47  -0.068   5.368  -9.583
  368   1HG1  ILE  47          2HG1      ILE  47   1.589   4.283  -7.280
  369   2HG1  ILE  47          1HG1      ILE  47   1.749   5.904  -7.956
  370   1HG2  ILE  47          1HG2      ILE  47  -0.698   2.950  -9.805
  371   2HG2  ILE  47          3HG2      ILE  47   0.156   2.633  -8.293
  372   3HG2  ILE  47          2HG2      ILE  47  -1.261   3.684  -8.303
  373   1HD1  ILE  47          1HD1      ILE  47  -0.807   4.775  -6.778
  374   2HD1  ILE  47          3HD1      ILE  47   0.297   5.856  -5.927
  375   3HD1  ILE  47          2HD1      ILE  47  -0.561   6.422  -7.360
  376    H    ARG  48           H        ARG  48   2.468   5.903 -11.735
  377    HA   ARG  48           HA       ARG  48   4.973   6.557 -10.337
  378   1HB   ARG  48          2HB       ARG  48   4.303   6.543 -12.974
  379   2HB   ARG  48          1HB       ARG  48   4.067   8.250 -12.598
  380   1HG   ARG  48          2HG       ARG  48   6.548   6.930 -11.582
  381   2HG   ARG  48          1HG       ARG  48   6.460   7.298 -13.305
  382   1HD   ARG  48          2HD       ARG  48   5.631   9.431 -11.383
  383   2HD   ARG  48          1HD       ARG  48   7.355   9.094 -11.541
  384    HE   ARG  48           HE       ARG  48   5.824   9.553 -14.039
  385   1HH1  ARG  48          2HH1      ARG  48   8.743   9.645 -14.154
  386   2HH1  ARG  48          1HH1      ARG  48   9.100  11.335 -14.015
  387   1HH2  ARG  48          1HH2      ARG  48   5.972  12.163 -12.768
  388   2HH2  ARG  48          2HH2      ARG  48   7.531  12.760 -13.231
  389    H    ASP  49           H        ASP  49   5.103   8.173  -8.827
  390    HA   ASP  49           HA       ASP  49   3.063  10.347  -8.979
  391   1HB   ASP  49          2HB       ASP  49   2.397   8.696  -7.249
  392   2HB   ASP  49          1HB       ASP  49   3.944   8.946  -6.439
  393    H    TRP  50           H        TRP  50   5.483  10.900 -10.022
  394    HA   TRP  50           HA       TRP  50   7.536  11.734  -8.224
  395   1HB   TRP  50          2HB       TRP  50   8.146  11.709 -10.516
  396   2HB   TRP  50          1HB       TRP  50   6.707  12.605 -10.997
  397    HD1  TRP  50           HD1      TRP  50  10.264  13.096  -9.908
  398    HE1  TRP  50           HE1      TRP  50  10.785  15.617  -9.762
  399    HE3  TRP  50           HE3      TRP  50   5.587  14.943 -10.430
  400    HZ2  TRP  50           HZ2      TRP  50   9.373  18.111  -9.907
  401    HZ3  TRP  50           HZ3      TRP  50   5.172  17.389 -10.436
  402    HH2  TRP  50           HH2      TRP  50   7.060  18.976 -10.178
  403    H    ASP  51           H        ASP  51   8.034  14.137  -7.796
  404    HA   ASP  51           HA       ASP  51   5.633  15.843  -7.565
  405   1HB   ASP  51          2HB       ASP  51   6.616  14.292  -5.374
  406   2HB   ASP  51          1HB       ASP  51   6.977  15.987  -5.045
  407    H    ASP  52           H        ASP  52   6.208  18.086  -7.078
  408    HA   ASP  52           HA       ASP  52   8.845  18.789  -8.161
  409   1HB   ASP  52          2HB       ASP  52   8.019  21.024  -8.268
  410   2HB   ASP  52          1HB       ASP  52   6.653  19.996  -8.694
  411    H    MET  53           H        MET  53   8.800  17.487  -5.503
  412    HA   MET  53           HA       MET  53  10.528  19.370  -4.167
  413   1HB   MET  53          2HB       MET  53   9.099  19.136  -1.989
  414   2HB   MET  53          1HB       MET  53   8.647  20.347  -3.186
  415   1HG   MET  53          2HG       MET  53   6.616  19.382  -3.322
  416   2HG   MET  53          1HG       MET  53   7.382  17.937  -3.977
  417   1HE   MET  53          3HE       MET  53   8.276  16.294  -3.035
  418   2HE   MET  53          2HE       MET  53   8.509  15.915  -1.330
  419   3HE   MET  53          1HE       MET  53   7.043  15.384  -2.150
  420    H    LYS  54           H        LYS  54  10.901  16.735  -5.196
  421    HA   LYS  54           HA       LYS  54  12.237  15.513  -3.038
  422   1HB   LYS  54          2HB       LYS  54  10.810  13.593  -2.543
  423   2HB   LYS  54          1HB       LYS  54   9.934  15.084  -2.204
  424   1HG   LYS  54          2HG       LYS  54   8.353  14.571  -3.727
  425   2HG   LYS  54          1HG       LYS  54   9.571  14.304  -4.972
  426   1HD   LYS  54          2HD       LYS  54   8.636  12.175  -4.790
  427   2HD   LYS  54          1HD       LYS  54   9.984  12.054  -3.660
  428   1HE   LYS  54          2HE       LYS  54   7.686  13.186  -2.327
  429   2HE   LYS  54          1HE       LYS  54   7.241  11.663  -3.098
  430   1HZ   LYS  54          1HZ       LYS  54   9.747  11.829  -1.575
  431   2HZ   LYS  54          3HZ       LYS  54   8.281  11.667  -0.737
  432   3HZ   LYS  54          2HZ       LYS  54   8.749  10.486  -1.865
  433    H    GLY  55           H        GLY  55  10.716  15.153  -6.192
  434   1HA   GLY  55          2HA       GLY  55  12.283  14.389  -7.979
  435   2HA   GLY  55          1HA       GLY  55  12.800  13.161  -6.835
  436    H    ASP  56           H        ASP  56  12.109  11.748  -8.749
  437    HA   ASP  56           HA       ASP  56   9.186  11.485  -9.035
  438   1HB   ASP  56          2HB       ASP  56   9.954   9.540 -10.572
  439   2HB   ASP  56          1HB       ASP  56  10.299  11.185 -11.095
  440    H    HIS  57           H        HIS  57   8.259   9.217  -8.816
  441    HA   HIS  57           HA       HIS  57   9.666   7.330  -7.106
  442   1HB   HIS  57          2HB       HIS  57   7.593   9.189  -5.984
  443   2HB   HIS  57          1HB       HIS  57   7.682   7.537  -5.377
  444    HD1  HIS  57           HD1      HIS  57   8.559  10.252  -3.831
  445    HD2  HIS  57           HD2      HIS  57  11.091   7.432  -5.568
  446    HE1  HIS  57           HE1      HIS  57  10.799  10.491  -2.674
  447    H    VAL  58           H        VAL  58   7.808   5.665  -6.321
  448    HA   VAL  58           HA       VAL  58   5.591   5.461  -8.202
  449    HB   VAL  58           HB       VAL  58   8.160   4.060  -8.631
  450   1HG1  VAL  58          1HG1      VAL  58   5.544   2.600  -8.504
  451   2HG1  VAL  58          3HG1      VAL  58   6.667   2.193  -9.803
  452   3HG1  VAL  58          2HG1      VAL  58   7.166   2.023  -8.120
  453   1HG2  VAL  58          3HG2      VAL  58   5.769   4.883 -10.272
  454   2HG2  VAL  58          2HG2      VAL  58   7.387   5.587 -10.278
  455   3HG2  VAL  58          1HG2      VAL  58   7.122   3.978 -10.956
  456    H    LYS  59           H        LYS  59   3.994   4.695  -6.969
  457    HA   LYS  59           HA       LYS  59   4.630   2.917  -4.666
  458   1HB   LYS  59          2HB       LYS  59   2.320   4.702  -5.394
  459   2HB   LYS  59          1HB       LYS  59   2.051   3.349  -4.294
  460   1HG   LYS  59          2HG       LYS  59   3.986   4.198  -2.912
  461   2HG   LYS  59          1HG       LYS  59   4.016   5.630  -3.941
  462   1HD   LYS  59          2HD       LYS  59   1.740   6.197  -3.304
  463   2HD   LYS  59          1HD       LYS  59   1.581   4.695  -2.395
  464   1HE   LYS  59          2HE       LYS  59   3.738   5.609  -1.151
  465   2HE   LYS  59          1HE       LYS  59   3.137   7.166  -1.722
  466   1HZ   LYS  59          1HZ       LYS  59   1.100   5.479  -0.592
  467   2HZ   LYS  59          3HZ       LYS  59   2.310   5.902   0.518
  468   3HZ   LYS  59          2HZ       LYS  59   1.443   7.116  -0.295
  469    H    HIS  60           H        HIS  60   2.333   1.405  -4.480
  470    HA   HIS  60           HA       HIS  60   1.673   0.348  -7.127
  471   1HB   HIS  60          2HB       HIS  60   2.958  -1.613  -5.258
  472   2HB   HIS  60          1HB       HIS  60   2.688  -1.755  -6.991
  473    HD1  HIS  60           HD1      HIS  60   4.515  -0.948  -8.527
  474    HD2  HIS  60           HD2      HIS  60   5.122   0.266  -4.586
  475    HE1  HIS  60           HE1      HIS  60   6.824   0.088  -8.447
  476    H    TYR  61           H        TYR  61  -0.054  -1.074  -7.126
  477    HA   TYR  61           HA       TYR  61  -1.404  -1.459  -4.485
  478   1HB   TYR  61          2HB       TYR  61  -2.466  -0.424  -7.089
  479   2HB   TYR  61          1HB       TYR  61  -3.536  -1.428  -6.108
  480    HD1  TYR  61           HD1      TYR  61  -3.890  -0.786  -3.657
  481    HD2  TYR  61           HD2      TYR  61  -2.048   1.836  -6.519
  482    HE1  TYR  61           HE1      TYR  61  -4.326   1.147  -2.166
  483    HE2  TYR  61           HE2      TYR  61  -2.484   3.768  -5.028
  484    HH   TYR  61           HH       TYR  61  -2.890   3.807  -2.141
  485    H    LYS  62           H        LYS  62  -0.689  -3.588  -4.260
  486    HA   LYS  62           HA       LYS  62  -0.438  -5.569  -6.194
  487   1HB   LYS  62          2HB       LYS  62   0.257  -6.053  -3.958
  488   2HB   LYS  62          1HB       LYS  62  -1.356  -5.762  -3.315
  489   1HG   LYS  62          2HG       LYS  62  -1.212  -7.827  -5.421
  490   2HG   LYS  62          1HG       LYS  62  -0.357  -8.230  -3.931
  491   1HD   LYS  62          2HD       LYS  62  -3.263  -7.391  -4.169
  492   2HD   LYS  62          1HD       LYS  62  -2.669  -8.998  -3.759
  493   1HE   LYS  62          2HE       LYS  62  -1.387  -7.260  -1.960
  494   2HE   LYS  62          1HE       LYS  62  -3.058  -6.700  -2.033
  495   1HZ   LYS  62          2HZ       LYS  62  -3.496  -9.280  -1.889
  496   2HZ   LYS  62          1HZ       LYS  62  -1.990  -9.253  -1.102
  497   3HZ   LYS  62          3HZ       LYS  62  -3.280  -8.332  -0.497
  498    H    ILE  63           H        ILE  63  -1.878  -6.298  -7.655
  499    HA   ILE  63           HA       ILE  63  -4.766  -5.938  -7.142
  500    HB   ILE  63           HB       ILE  63  -3.134  -6.717  -9.541
  501   1HG1  ILE  63          2HG1      ILE  63  -4.918  -4.391  -8.805
  502   2HG1  ILE  63          1HG1      ILE  63  -3.179  -4.356  -9.104
  503   1HG2  ILE  63          2HG2      ILE  63  -5.848  -7.468  -8.948
  504   2HG2  ILE  63          1HG2      ILE  63  -5.852  -6.294 -10.262
  505   3HG2  ILE  63          3HG2      ILE  63  -4.920  -7.783 -10.414
  506   1HD1  ILE  63          2HD1      ILE  63  -4.136  -5.509 -11.403
  507   2HD1  ILE  63          1HD1      ILE  63  -5.413  -4.358 -11.012
  508   3HD1  ILE  63          3HD1      ILE  63  -3.754  -3.796 -11.224
  509    H    ARG  64           H        ARG  64  -6.142  -7.636  -6.708
  510    HA   ARG  64           HA       ARG  64  -5.062 -10.397  -7.036
  511   1HB   ARG  64          2HB       ARG  64  -5.660  -9.051  -4.539
  512   2HB   ARG  64          1HB       ARG  64  -6.708 -10.453  -4.751
  513   1HG   ARG  64          2HG       ARG  64  -4.439 -10.874  -3.619
  514   2HG   ARG  64          1HG       ARG  64  -4.867 -11.938  -4.958
  515   1HD   ARG  64          2HD       ARG  64  -3.371 -10.895  -6.432
  516   2HD   ARG  64          1HD       ARG  64  -3.312  -9.414  -5.477
  517    HE   ARG  64           HE       ARG  64  -1.361 -10.430  -4.611
  518   1HH1  ARG  64          2HH1      ARG  64  -3.412 -12.939  -5.587
  519   2HH1  ARG  64          1HH1      ARG  64  -2.862 -14.071  -4.397
  520   1HH2  ARG  64          1HH2      ARG  64  -0.882 -11.763  -2.732
  521   2HH2  ARG  64          2HH2      ARG  64  -1.430 -13.405  -2.781
  522    H    LYS  65           H        LYS  65  -6.656 -11.921  -7.618
  523    HA   LYS  65           HA       LYS  65  -9.324 -10.716  -8.182
  524   1HB   LYS  65          2HB       LYS  65  -8.565 -11.279 -10.306
  525   2HB   LYS  65          1HB       LYS  65  -7.593 -12.622  -9.717
  526   1HG   LYS  65          2HG       LYS  65  -9.834 -13.816  -9.216
  527   2HG   LYS  65          1HG       LYS  65 -10.592 -12.563 -10.189
  528   1HD   LYS  65          2HD       LYS  65 -10.060 -13.745 -12.025
  529   2HD   LYS  65          1HD       LYS  65  -8.359 -13.441 -11.674
  530   1HE   LYS  65          2HE       LYS  65  -8.594 -15.821 -11.799
  531   2HE   LYS  65          1HE       LYS  65  -8.467 -15.434 -10.083
  532   1HZ   LYS  65          3HZ       LYS  65 -11.145 -15.432 -11.214
  533   2HZ   LYS  65          2HZ       LYS  65 -10.391 -16.949 -11.085
  534   3HZ   LYS  65          1HZ       LYS  65 -10.605 -15.983  -9.704
  535    H    LEU  66           H        LEU  66 -11.001 -11.571  -7.070
  536    HA   LEU  66           HA       LEU  66 -10.547 -14.003  -5.468
  537   1HB   LEU  66          2HB       LEU  66 -12.942 -12.161  -5.737
  538   2HB   LEU  66          1HB       LEU  66 -12.923 -13.589  -4.711
  539    HG   LEU  66           HG       LEU  66 -12.309 -12.008  -3.162
  540   1HD1  LEU  66          1HD1      LEU  66 -10.359 -13.662  -3.637
  541   2HD1  LEU  66          3HD1      LEU  66  -9.556 -12.267  -4.359
  542   3HD1  LEU  66          2HD1      LEU  66 -10.020 -12.234  -2.658
  543   1HD2  LEU  66          1HD2      LEU  66 -10.891 -10.549  -5.401
  544   2HD2  LEU  66          3HD2      LEU  66 -12.452 -10.125  -4.701
  545   3HD2  LEU  66          2HD2      LEU  66 -10.985  -9.985  -3.732
  546    H    ASP  67           H        ASP  67 -11.365 -16.004  -6.037
  547    HA   ASP  67           HA       ASP  67 -12.401 -16.364  -8.726
  548   1HB   ASP  67          2HB       ASP  67 -11.593 -18.038  -6.469
  549   2HB   ASP  67          1HB       ASP  67 -13.012 -18.670  -7.296
  550    H    ASN  68           H        ASN  68 -13.686 -15.571  -5.690
  551    HA   ASN  68           HA       ASN  68 -16.397 -16.557  -6.161
  552   1HB   ASN  68          2HB       ASN  68 -15.355 -14.567  -4.128
  553   2HB   ASN  68          1HB       ASN  68 -16.897 -15.425  -4.061
  554   1HD2  ASN  68          2HD2      ASN  68 -13.472 -17.325  -2.909
  555   2HD2  ASN  68          1HD2      ASN  68 -13.411 -15.774  -3.595
  556    H    GLY  69           H        GLY  69 -14.547 -13.926  -7.254
  557   1HA   GLY  69          2HA       GLY  69 -17.022 -12.624  -8.137
  558   2HA   GLY  69          1HA       GLY  69 -15.987 -11.647  -7.110
  559    H    GLY  70           H        GLY  70 -13.965 -10.933  -7.955
  560   1HA   GLY  70          2HA       GLY  70 -13.175 -11.717 -10.648
  561   2HA   GLY  70          1HA       GLY  70 -13.866 -10.114 -10.569
  562    H    TYR  71           H        TYR  71 -12.500  -8.498 -10.189
  563    HA   TYR  71           HA       TYR  71  -9.834  -9.191  -9.013
  564   1HB   TYR  71          2HB       TYR  71 -10.616  -7.228 -11.163
  565   2HB   TYR  71          1HB       TYR  71  -9.087  -7.087 -10.296
  566    HD1  TYR  71           HD1      TYR  71 -11.163  -9.709 -11.996
  567    HD2  TYR  71           HD2      TYR  71  -7.232  -8.180 -11.182
  568    HE1  TYR  71           HE1      TYR  71 -10.183 -11.450 -13.467
  569    HE2  TYR  71           HE2      TYR  71  -6.250  -9.924 -12.649
  570    HH   TYR  71           HH       TYR  71  -8.150 -12.559 -13.895
  571    H    TYR  72           H        TYR  72  -8.754  -7.191  -8.005
  572    HA   TYR  72           HA       TYR  72 -10.313  -4.975  -7.103
  573   1HB   TYR  72          2HB       TYR  72 -11.043  -5.605  -4.935
  574   2HB   TYR  72          1HB       TYR  72 -11.514  -6.953  -5.967
  575    HD1  TYR  72           HD1      TYR  72  -9.983  -8.988  -6.098
  576    HD2  TYR  72           HD2      TYR  72  -9.525  -5.914  -3.142
  577    HE1  TYR  72           HE1      TYR  72  -8.590 -10.510  -4.731
  578    HE2  TYR  72           HE2      TYR  72  -8.136  -7.426  -1.770
  579    HH   TYR  72           HH       TYR  72  -8.083 -10.554  -1.972
  580    H    ILE  73           H        ILE  73  -8.777  -3.500  -6.474
  581    HA   ILE  73           HA       ILE  73  -6.112  -4.470  -5.637
  582    HB   ILE  73           HB       ILE  73  -7.276  -1.782  -6.350
  583   1HG1  ILE  73          2HG1      ILE  73  -4.672  -3.156  -7.056
  584   2HG1  ILE  73          1HG1      ILE  73  -6.142  -3.231  -8.027
  585   1HG2  ILE  73          2HG2      ILE  73  -6.160  -1.433  -4.165
  586   2HG2  ILE  73          1HG2      ILE  73  -4.689  -2.152  -4.823
  587   3HG2  ILE  73          3HG2      ILE  73  -5.300  -0.633  -5.483
  588   1HD1  ILE  73          1HD1      ILE  73  -4.793  -0.634  -7.247
  589   2HD1  ILE  73          3HD1      ILE  73  -4.483  -1.470  -8.769
  590   3HD1  ILE  73          2HD1      ILE  73  -6.096  -0.852  -8.415
  591    H    THR  74           H        THR  74  -9.072  -3.204  -4.405
  592    HA   THR  74           HA       THR  74  -8.119  -3.658  -1.635
  593    HB   THR  74           HB       THR  74  -8.211  -1.431  -1.241
  594    HG1  THR  74           HG1      THR  74 -10.462  -0.627  -1.153
  595   1HG2  THR  74          1HG2      THR  74  -9.816  -1.170  -3.797
  596   2HG2  THR  74          3HG2      THR  74  -9.252   0.191  -2.828
  597   3HG2  THR  74          2HG2      THR  74  -8.086  -0.875  -3.611
  598    H    THR  75           H        THR  75  -9.730  -4.590  -0.344
  599    HA   THR  75           HA       THR  75 -11.739  -6.092  -1.716
  600    HB   THR  75           HB       THR  75 -12.510  -6.723   0.551
  601    HG1  THR  75           HG1      THR  75 -10.868  -4.535   1.190
  602   1HG2  THR  75          2HG2      THR  75  -9.916  -7.023  -0.595
  603   2HG2  THR  75          1HG2      THR  75  -9.725  -6.896   1.156
  604   3HG2  THR  75          3HG2      THR  75 -10.772  -8.140   0.471
  605    H    ARG  76           H        ARG  76 -11.814  -2.832  -1.009
  606    HA   ARG  76           HA       ARG  76 -14.684  -2.716  -0.392
  607   1HB   ARG  76          2HB       ARG  76 -12.607  -0.561  -0.867
  608   2HB   ARG  76          1HB       ARG  76 -14.295  -0.233  -0.481
  609   1HG   ARG  76          2HG       ARG  76 -14.095  -1.027   1.692
  610   2HG   ARG  76          1HG       ARG  76 -12.761  -2.107   1.284
  611   1HD   ARG  76          2HD       ARG  76 -11.701  -0.384   2.489
  612   2HD   ARG  76          1HD       ARG  76 -11.436   0.083   0.810
  613    HE   ARG  76           HE       ARG  76 -13.800   1.356   1.462
  614   1HH1  ARG  76          2HH1      ARG  76 -11.647   0.931   3.932
  615   2HH1  ARG  76          1HH1      ARG  76 -11.252   2.605   4.146
  616   1HH2  ARG  76          1HH2      ARG  76 -12.867   3.628   1.253
  617   2HH2  ARG  76          2HH2      ARG  76 -11.943   4.131   2.630
  618    H    ALA  77           H        ALA  77 -12.868  -3.103  -3.209
  619    HA   ALA  77           HA       ALA  77 -15.216  -2.430  -4.836
  620   1HB   ALA  77          3HB       ALA  77 -12.646  -0.857  -5.081
  621   2HB   ALA  77          2HB       ALA  77 -13.898  -0.878  -6.326
  622   3HB   ALA  77          1HB       ALA  77 -14.255  -0.229  -4.724
  623    H    GLN  78           H        GLN  78 -15.208  -4.495  -5.722
  624    HA   GLN  78           HA       GLN  78 -12.754  -5.374  -7.137
  625   1HB   GLN  78          2HB       GLN  78 -15.149  -7.119  -6.635
  626   2HB   GLN  78          1HB       GLN  78 -13.460  -7.575  -6.823
  627   1HG   GLN  78          2HG       GLN  78 -13.102  -6.156  -4.651
  628   2HG   GLN  78          1HG       GLN  78 -14.838  -6.369  -4.435
  629   1HE2  GLN  78          2HE2      GLN  78 -12.693  -9.242  -2.988
  630   2HE2  GLN  78          1HE2      GLN  78 -12.378  -7.575  -2.989
  631    H    PHE  79           H        PHE  79 -13.471  -6.789  -9.182
  632    HA   PHE  79           HA       PHE  79 -15.843  -5.671 -10.540
  633   1HB   PHE  79          2HB       PHE  79 -12.990  -5.243 -11.457
  634   2HB   PHE  79          1HB       PHE  79 -14.364  -5.122 -12.555
  635    HD1  PHE  79           HD1      PHE  79 -13.031  -3.825  -9.332
  636    HD2  PHE  79           HD2      PHE  79 -15.666  -3.157 -12.650
  637    HE1  PHE  79           HE1      PHE  79 -13.501  -1.555  -8.492
  638    HE2  PHE  79           HE2      PHE  79 -16.136  -0.867 -11.814
  639    HZ   PHE  79           HZ       PHE  79 -15.054  -0.064  -9.727
  640    H    GLU  80           H        GLU  80 -15.067  -6.680 -13.099
  641    HA   GLU  80           HA       GLU  80 -15.148  -9.569 -12.426
  642   1HB   GLU  80          2HB       GLU  80 -16.111  -9.794 -14.736
  643   2HB   GLU  80          1HB       GLU  80 -17.073  -8.782 -13.658
  644   1HG   GLU  80          2HG       GLU  80 -15.136  -7.114 -14.921
  645   2HG   GLU  80          1HG       GLU  80 -15.927  -8.071 -16.173
  646    H    THR  81           H        THR  81 -13.305  -7.185 -14.258
  647    HA   THR  81           HA       THR  81 -11.231  -9.256 -14.684
  648    HB   THR  81           HB       THR  81 -11.984  -9.623 -16.811
  649    HG1  THR  81           HG1      THR  81 -11.363  -7.106 -17.709
  650   1HG2  THR  81          3HG2      THR  81 -14.069  -8.334 -16.247
  651   2HG2  THR  81          2HG2      THR  81 -13.250  -6.892 -16.851
  652   3HG2  THR  81          1HG2      THR  81 -13.590  -8.238 -17.942
  653    H    LEU  82           H        LEU  82  -9.380  -7.989 -16.100
  654    HA   LEU  82           HA       LEU  82  -8.617  -5.752 -14.381
  655   1HB   LEU  82          2HB       LEU  82  -7.270  -7.217 -16.650
  656   2HB   LEU  82          1HB       LEU  82  -6.583  -5.737 -15.985
  657    HG   LEU  82           HG       LEU  82  -7.132  -8.330 -14.515
  658   1HD1  LEU  82          1HD1      LEU  82  -4.731  -6.880 -15.522
  659   2HD1  LEU  82          3HD1      LEU  82  -4.594  -7.655 -13.943
  660   3HD1  LEU  82          2HD1      LEU  82  -5.017  -8.614 -15.362
  661   1HD2  LEU  82          2HD2      LEU  82  -6.447  -5.572 -13.484
  662   2HD2  LEU  82          1HD2      LEU  82  -7.768  -6.624 -12.973
  663   3HD2  LEU  82          3HD2      LEU  82  -6.103  -7.032 -12.557
  664    H    GLN  83           H        GLN  83  -9.767  -6.247 -17.656
  665    HA   GLN  83           HA       GLN  83  -9.293  -3.519 -18.504
  666   1HB   GLN  83          2HB       GLN  83 -10.405  -5.956 -19.645
  667   2HB   GLN  83          1HB       GLN  83 -11.372  -4.543 -20.070
  668   1HG   GLN  83          2HG       GLN  83  -8.784  -3.621 -20.382
  669   2HG   GLN  83          1HG       GLN  83  -8.669  -5.289 -20.943
  670   1HE2  GLN  83          2HE2      GLN  83 -10.319  -2.595 -23.370
  671   2HE2  GLN  83          1HE2      GLN  83  -9.342  -2.207 -22.039
  672    H    GLN  84           H        GLN  84 -11.972  -5.297 -17.059
  673    HA   GLN  84           HA       GLN  84 -13.916  -3.187 -17.330
  674   1HB   GLN  84          2HB       GLN  84 -13.736  -5.661 -15.628
  675   2HB   GLN  84          1HB       GLN  84 -15.057  -4.520 -15.437
  676   1HG   GLN  84          2HG       GLN  84 -15.274  -6.563 -17.123
  677   2HG   GLN  84          1HG       GLN  84 -15.966  -4.994 -17.514
  678   1HE2  GLN  84          2HE2      GLN  84 -13.578  -4.284 -20.086
  679   2HE2  GLN  84          1HE2      GLN  84 -14.667  -3.573 -18.996
  680    H    LEU  85           H        LEU  85 -11.619  -4.090 -14.793
  681    HA   LEU  85           HA       LEU  85 -12.615  -1.981 -13.004
  682   1HB   LEU  85          2HB       LEU  85 -11.230  -2.866 -11.397
  683   2HB   LEU  85          1HB       LEU  85 -11.338  -4.276 -12.448
  684    HG   LEU  85           HG       LEU  85  -9.282  -2.874 -13.604
  685   1HD1  LEU  85          1HD1      LEU  85  -9.577  -1.468 -11.342
  686   2HD1  LEU  85          3HD1      LEU  85  -8.557  -2.765 -10.718
  687   3HD1  LEU  85          2HD1      LEU  85  -7.992  -1.766 -12.057
  688   1HD2  LEU  85          3HD2      LEU  85  -9.581  -5.317 -12.844
  689   2HD2  LEU  85          2HD2      LEU  85  -7.951  -4.647 -12.894
  690   3HD2  LEU  85          1HD2      LEU  85  -8.797  -4.794 -11.353
  691    H    VAL  86           H        VAL  86 -10.079  -2.291 -15.412
  692    HA   VAL  86           HA       VAL  86  -8.799   0.160 -14.570
  693    HB   VAL  86           HB       VAL  86  -7.700   0.119 -16.791
  694   1HG1  VAL  86          1HG1      VAL  86  -7.737  -2.107 -14.889
  695   2HG1  VAL  86          3HG1      VAL  86  -7.199  -2.597 -16.496
  696   3HG1  VAL  86          2HG1      VAL  86  -6.361  -1.301 -15.644
  697   1HG2  VAL  86          2HG2      VAL  86  -9.579  -2.198 -17.278
  698   2HG2  VAL  86          1HG2      VAL  86  -9.646  -0.636 -18.086
  699   3HG2  VAL  86          3HG2      VAL  86  -8.276  -1.714 -18.359
  700    H    GLN  87           H        GLN  87 -11.619  -0.783 -16.195
  701    HA   GLN  87           HA       GLN  87 -12.103   1.622 -17.714
  702   1HB   GLN  87          2HB       GLN  87 -13.145  -0.611 -18.173
  703   2HB   GLN  87          1HB       GLN  87 -14.075  -0.428 -16.696
  704   1HG   GLN  87          2HG       GLN  87 -15.460   0.319 -18.530
  705   2HG   GLN  87          1HG       GLN  87 -14.969   1.732 -17.595
  706   1HE2  GLN  87          2HE2      GLN  87 -14.012   1.561 -21.484
  707   2HE2  GLN  87          1HE2      GLN  87 -15.131   0.515 -20.752
  708    H    HIS  88           H        HIS  88 -13.144   0.340 -14.599
  709    HA   HIS  88           HA       HIS  88 -14.810   2.619 -13.967
  710   1HB   HIS  88          2HB       HIS  88 -14.897   0.151 -13.088
  711   2HB   HIS  88          1HB       HIS  88 -13.719   0.728 -11.917
  712    HD1  HIS  88           HD1      HIS  88 -17.314   0.698 -12.640
  713    HD2  HIS  88           HD2      HIS  88 -14.732   3.027 -10.340
  714    HE1  HIS  88           HE1      HIS  88 -18.770   2.014 -11.038
  715    H    TYR  89           H        TYR  89 -11.592   1.524 -13.188
  716    HA   TYR  89           HA       TYR  89 -11.006   3.559 -11.253
  717   1HB   TYR  89          2HB       TYR  89  -9.296   1.698 -12.898
  718   2HB   TYR  89          1HB       TYR  89  -8.585   2.884 -11.814
  719    HD1  TYR  89           HD1      TYR  89 -11.573   0.633 -11.596
  720    HD2  TYR  89           HD2      TYR  89  -7.848   1.853  -9.850
  721    HE1  TYR  89           HE1      TYR  89 -11.944  -0.923  -9.732
  722    HE2  TYR  89           HE2      TYR  89  -8.226   0.283  -7.965
  723    HH   TYR  89           HH       TYR  89 -11.011  -0.926  -7.116
  724    H    SER  90           H        SER  90 -10.963   3.443 -14.727
  725    HA   SER  90           HA       SER  90  -9.166   5.618 -15.171
  726   1HB   SER  90          2HB       SER  90 -10.527   3.812 -16.776
  727   2HB   SER  90          1HB       SER  90 -11.283   5.357 -17.166
  728    HG   SER  90           HG       SER  90  -9.033   4.485 -18.081
  729    H    GLU  91           H        GLU  91 -12.689   5.410 -14.872
  730    HA   GLU  91           HA       GLU  91 -12.916   8.347 -15.058
  731   1HB   GLU  91          2HB       GLU  91 -15.132   6.385 -14.439
  732   2HB   GLU  91          1HB       GLU  91 -15.276   8.007 -15.117
  733   1HG   GLU  91          2HG       GLU  91 -13.680   6.939 -16.987
  734   2HG   GLU  91          1HG       GLU  91 -14.468   5.457 -16.442
  735    H    ARG  92           H        ARG  92 -12.231   6.098 -12.657
  736    HA   ARG  92           HA       ARG  92 -12.835   8.120 -10.580
  737   1HB   ARG  92          2HB       ARG  92 -13.734   5.331  -9.975
  738   2HB   ARG  92          1HB       ARG  92 -14.317   6.861  -9.322
  739   1HG   ARG  92          2HG       ARG  92 -15.347   7.376 -11.532
  740   2HG   ARG  92          1HG       ARG  92 -14.825   5.798 -12.118
  741   1HD   ARG  92          2HD       ARG  92 -16.698   4.895 -11.254
  742   2HD   ARG  92          1HD       ARG  92 -16.147   5.357  -9.644
  743    HE   ARG  92           HE       ARG  92 -18.288   6.610 -11.068
  744   1HH1  ARG  92          2HH1      ARG  92 -16.089   6.877  -8.505
  745   2HH1  ARG  92          1HH1      ARG  92 -16.447   8.536  -8.157
  746   1HH2  ARG  92          1HH2      ARG  92 -18.513   8.943 -10.912
  747   2HH2  ARG  92          2HH2      ARG  92 -17.820   9.705  -9.521
  748    H    ALA  93           H        ALA  93 -11.589   7.783  -8.645
  749    HA   ALA  93           HA       ALA  93  -9.042   6.540  -9.064
  750   1HB   ALA  93          3HB       ALA  93 -10.378   7.387  -6.476
  751   2HB   ALA  93          2HB       ALA  93  -8.674   6.958  -6.640
  752   3HB   ALA  93          1HB       ALA  93  -9.309   8.382  -7.466
  753    H    ALA  94           H        ALA  94 -12.069   5.384  -7.785
  754    HA   ALA  94           HA       ALA  94 -12.716   3.139  -7.440
  755   1HB   ALA  94          3HB       ALA  94 -10.302   2.827  -8.807
  756   2HB   ALA  94          2HB       ALA  94 -10.071   1.917  -7.314
  757   3HB   ALA  94          1HB       ALA  94 -11.428   1.540  -8.375
  758    H    GLY  95           H        GLY  95 -10.573   5.022  -5.652
  759   1HA   GLY  95          2HA       GLY  95 -10.993   5.052  -3.206
  760   2HA   GLY  95          1HA       GLY  95 -11.059   3.294  -3.272
  761    H    LEU  96           H        LEU  96  -8.625   3.700  -5.299
  762    HA   LEU  96           HA       LEU  96  -6.627   3.330  -3.183
  763   1HB   LEU  96          2HB       LEU  96  -5.098   2.903  -5.113
  764   2HB   LEU  96          1HB       LEU  96  -6.541   1.894  -5.148
  765    HG   LEU  96           HG       LEU  96  -7.015   4.424  -6.502
  766   1HD1  LEU  96          2HD1      LEU  96  -4.674   2.718  -7.364
  767   2HD1  LEU  96          1HD1      LEU  96  -5.523   3.805  -8.464
  768   3HD1  LEU  96          3HD1      LEU  96  -4.689   4.454  -7.052
  769   1HD2  LEU  96          1HD2      LEU  96  -8.359   2.361  -6.730
  770   2HD2  LEU  96          3HD2      LEU  96  -7.724   2.887  -8.288
  771   3HD2  LEU  96          2HD2      LEU  96  -6.969   1.539  -7.437
  772    H    SER  97           H        SER  97  -4.386   4.474  -4.512
  773    HA   SER  97           HA       SER  97  -4.371   7.094  -3.473
  774   1HB   SER  97          2HB       SER  97  -2.400   5.591  -4.284
  775   2HB   SER  97          1HB       SER  97  -2.695   6.330  -5.856
  776    HG   SER  97           HG       SER  97  -1.151   7.404  -4.381
  777    H    SER  98           H        SER  98  -5.727   5.876  -6.420
  778    HA   SER  98           HA       SER  98  -7.230   8.110  -7.061
  779   1HB   SER  98          2HB       SER  98  -4.406   8.560  -7.617
  780   2HB   SER  98          1HB       SER  98  -5.391   8.728  -9.069
  781    HG   SER  98           HG       SER  98  -5.119  10.624  -7.592
  782    H    ARG  99           H        ARG  99  -7.128   8.304  -9.779
  783    HA   ARG  99           HA       ARG  99  -8.362   5.897 -10.659
  784   1HB   ARG  99          2HB       ARG  99  -7.074   8.016 -12.402
  785   2HB   ARG  99          1HB       ARG  99  -8.366   6.909 -12.862
  786   1HG   ARG  99          2HG       ARG  99  -9.652   7.962 -10.848
  787   2HG   ARG  99          1HG       ARG  99  -8.480   9.270 -11.000
  788   1HD   ARG  99          2HD       ARG  99  -9.305   8.755 -13.626
  789   2HD   ARG  99          1HD       ARG  99 -10.783   8.663 -12.671
  790    HE   ARG  99           HE       ARG  99  -9.832  10.963 -11.718
  791   1HH1  ARG  99          2HH1      ARG  99  -7.831  10.980 -14.021
  792   2HH1  ARG  99          1HH1      ARG  99  -8.657  11.973 -15.174
  793   1HH2  ARG  99          1HH2      ARG  99 -11.733  11.706 -13.596
  794   2HH2  ARG  99          2HH2      ARG  99 -10.866  12.384 -14.934
  795    H    LEU 100           H        LEU 100  -7.015   5.695 -13.261
  796    HA   LEU 100           HA       LEU 100  -4.573   4.210 -12.403
  797   1HB   LEU 100          2HB       LEU 100  -5.223   2.958 -14.700
  798   2HB   LEU 100          1HB       LEU 100  -5.871   2.459 -13.140
  799    HG   LEU 100           HG       LEU 100  -7.801   4.071 -13.572
  800   1HD1  LEU 100          1HD1      LEU 100  -6.209   4.352 -16.056
  801   2HD1  LEU 100          3HD1      LEU 100  -7.953   4.199 -16.277
  802   3HD1  LEU 100          2HD1      LEU 100  -7.300   5.501 -15.282
  803   1HD2  LEU 100          2HD2      LEU 100  -7.571   1.468 -14.112
  804   2HD2  LEU 100          1HD2      LEU 100  -9.017   2.385 -14.524
  805   3HD2  LEU 100          3HD2      LEU 100  -7.804   2.054 -15.759
  806    H    VAL 101           H        VAL 101  -3.585   3.686 -15.026
  807    HA   VAL 101           HA       VAL 101  -2.017   5.886 -15.611
  808    HB   VAL 101           HB       VAL 101  -1.924   3.583 -16.701
  809   1HG1  VAL 101          2HG1      VAL 101  -4.398   3.824 -17.436
  810   2HG1  VAL 101          1HG1      VAL 101  -3.764   4.808 -18.755
  811   3HG1  VAL 101          3HG1      VAL 101  -3.267   3.124 -18.593
  812   1HG2  VAL 101          3HG2      VAL 101  -1.683   6.118 -18.342
  813   2HG2  VAL 101          2HG2      VAL 101  -0.405   5.292 -17.450
  814   3HG2  VAL 101          1HG2      VAL 101  -1.091   4.552 -18.899
  815    H    VAL 102           H        VAL 102  -2.432   7.919 -16.308
  816    HA   VAL 102           HA       VAL 102  -5.051   8.886 -16.827
  817    HB   VAL 102           HB       VAL 102  -2.339  10.007 -17.593
  818   1HG1  VAL 102          2HG1      VAL 102  -4.370  10.826 -18.957
  819   2HG1  VAL 102          1HG1      VAL 102  -4.930  11.553 -17.450
  820   3HG1  VAL 102          3HG1      VAL 102  -3.393  12.055 -18.155
  821   1HG2  VAL 102          2HG2      VAL 102  -3.263   9.648 -15.116
  822   2HG2  VAL 102          1HG2      VAL 102  -2.368  11.103 -15.557
  823   3HG2  VAL 102          3HG2      VAL 102  -4.131  11.139 -15.484
  824    HA   PRO 103           HA       PRO 103  -5.603   7.589 -21.009
  825   1HB   PRO 103          2HB       PRO 103  -7.744   9.216 -21.588
  826   2HB   PRO 103          1HB       PRO 103  -7.867   7.740 -20.619
  827   1HG   PRO 103          2HG       PRO 103  -7.922  10.593 -19.732
  828   2HG   PRO 103          1HG       PRO 103  -8.655   9.171 -18.974
  829   1HD   PRO 103          2HD       PRO 103  -6.256  10.439 -18.161
  830   2HD   PRO 103          1HD       PRO 103  -6.817   8.840 -17.635
  831    H    SER 104           H        SER 104  -5.627  11.095 -20.316
  832    HA   SER 104           HA       SER 104  -4.466  11.564 -23.027
  833   1HB   SER 104          2HB       SER 104  -5.018  14.041 -21.826
  834   2HB   SER 104          1HB       SER 104  -5.973  13.243 -23.076
  835    HG   SER 104           HG       SER 104  -7.181  12.247 -21.474
  836    H    HIS 105           H        HIS 105  -2.651  10.483 -21.330
  837    HA   HIS 105           HA       HIS 105  -1.230  12.003 -19.508
  838   1HB   HIS 105          2HB       HIS 105   0.775  10.794 -20.193
  839   2HB   HIS 105          1HB       HIS 105  -0.605   9.699 -20.258
  840    HD1  HIS 105           HD1      HIS 105   2.219  10.565 -22.200
  841    HD2  HIS 105           HD2      HIS 105  -1.790   9.904 -23.132
  842    HE1  HIS 105           HE1      HIS 105   2.133  10.069 -24.682
  843    H    LYS 106           HN       LYS 106  -1.153  12.317 -23.045
  844    HA   LYS 106           HA       LYS 106   0.934  14.059 -23.469
  845   1HB   LYS 106          2HB       LYS 106  -1.364  13.333 -24.886
  846   2HB   LYS 106          1HB       LYS 106  -1.455  15.091 -24.775
  847   1HG   LYS 106          2HG       LYS 106   1.151  13.792 -25.515
  848   2HG   LYS 106          1HG       LYS 106  -0.103  13.975 -26.741
  849   1HD   LYS 106          2HD       LYS 106   0.382  16.163 -26.968
  850   2HD   LYS 106          1HD       LYS 106   0.149  16.427 -25.241
  851   1HE   LYS 106          2HE       LYS 106   2.372  16.750 -25.061
  852   2HE   LYS 106          1HE       LYS 106   2.598  15.050 -25.474
  853   1HZ   LYS 106          1HZ       LYS 106   2.334  15.865 -27.873
  854   2HZ   LYS 106          3HZ       LYS 106   2.660  17.406 -27.247
  855   3HZ   LYS 106          2HZ       LYS 106   3.807  16.164 -27.082
  856   1H    GLU 201          2HT       GLU 201   2.593   1.695   5.321
  857   2H    GLU 201          1HT       GLU 201   1.205   2.115   6.206
  858   3H    GLU 201          3HT       GLU 201   2.691   1.923   7.002
  859    HA   GLU 201           HA       GLU 201   1.935  -0.117   7.479
  860   1HB   GLU 201          2HB       GLU 201   0.109  -1.186   6.247
  861   2HB   GLU 201          1HB       GLU 201  -0.317   0.487   6.604
  862   1HG   GLU 201          2HG       GLU 201   1.128   0.130   4.060
  863   2HG   GLU 201          1HG       GLU 201  -0.455  -0.649   4.109
  864    HA   PRO 202           HA       PRO 202   4.771  -2.376   5.000
  865   1HB   PRO 202          2HB       PRO 202   4.230  -4.897   5.954
  866   2HB   PRO 202          1HB       PRO 202   5.145  -3.680   6.864
  867   1HG   PRO 202          2HG       PRO 202   2.340  -4.611   7.270
  868   2HG   PRO 202          1HG       PRO 202   3.475  -3.925   8.443
  869   1HD   PRO 202          2HD       PRO 202   1.337  -2.544   7.204
  870   2HD   PRO 202          1HD       PRO 202   2.671  -1.803   8.113
  871    H    GLN 203           H        GLN 203   4.767  -4.470   3.556
  872    HA   GLN 203           HA       GLN 203   3.885  -5.540   1.663
  873   1HB   GLN 203          2HB       GLN 203   1.326  -5.286   3.273
  874   2HB   GLN 203          1HB       GLN 203   1.535  -6.313   1.855
  875   1HG   GLN 203          2HG       GLN 203   3.068  -6.528   4.462
  876   2HG   GLN 203          1HG       GLN 203   1.839  -7.650   3.879
  877   1HE2  GLN 203          2HE2      GLN 203   5.544  -8.444   2.854
  878   2HE2  GLN 203          1HE2      GLN 203   5.037  -7.628   4.253
  879   1HN   PTR 204          1HN       PTR 204   1.686  -5.240   0.141
  880    HA   PTR 204           HA       PTR 204   2.034  -2.686  -1.089
  881   1HB   PTR 204          1HB       PTR 204  -0.266  -3.362  -2.172
  882    HD1  PTR 204           HD1      PTR 204   2.058  -6.239  -1.872
  883    HD2  PTR 204           HD2      PTR 204   1.042  -2.689  -4.073
  884    HE1  PTR 204           HE1      PTR 204   3.642  -6.897  -3.661
  885    HE2  PTR 204           HE2      PTR 204   2.625  -3.355  -5.865
  886    H    GLU 205           H        GLU 205   0.722  -0.815  -1.023
  887    HA   GLU 205           HA       GLU 205  -0.459  -0.147   1.480
  888   1HB   GLU 205          2HB       GLU 205  -1.429   1.810   0.217
  889   2HB   GLU 205          1HB       GLU 205   0.310   1.611   0.004
  890   1HG   GLU 205          2HG       GLU 205  -1.001   0.020  -1.973
  891   2HG   GLU 205          1HG       GLU 205  -1.719   1.631  -2.008
  892    H    GLU 206           H        GLU 206  -2.685   0.059   2.073
  893    HA   GLU 206           HA       GLU 206  -4.619  -1.313   0.259
  894   1HB   GLU 206          2HB       GLU 206  -3.828  -2.019   3.029
  895   2HB   GLU 206          1HB       GLU 206  -5.561  -2.035   2.702
  896   1HG   GLU 206          2HG       GLU 206  -5.124  -3.477   0.705
  897   2HG   GLU 206          1HG       GLU 206  -3.423  -3.544   1.171
  898    H    ILE 207           H        ILE 207  -6.571  -0.264   0.107
  899    HA   ILE 207           HA       ILE 207  -6.888   2.386   0.992
  900    HB   ILE 207           HB       ILE 207  -8.783   0.286  -0.008
  901   1HG1  ILE 207          2HG1      ILE 207  -9.164   2.238  -1.656
  902   2HG1  ILE 207          1HG1      ILE 207  -7.765   2.987  -0.884
  903   1HG2  ILE 207          3HG2      ILE 207  -9.615   3.005   1.055
  904   2HG2  ILE 207          2HG2      ILE 207 -10.648   1.911   0.134
  905   3HG2  ILE 207          1HG2      ILE 207 -10.080   1.446   1.737
  906   1HD1  ILE 207          3HD1      ILE 207  -7.310   0.175  -1.561
  907   2HD1  ILE 207          2HD1      ILE 207  -7.663   1.169  -2.974
  908   3HD1  ILE 207          1HD1      ILE 207  -6.317   1.588  -1.915
  909    HA   PRO 208           HA       PRO 208  -9.348   0.738   4.744
  910   1HB   PRO 208          2HB       PRO 208  -9.197  -1.953   5.278
  911   2HB   PRO 208          1HB       PRO 208 -10.454  -1.226   4.263
  912   1HG   PRO 208          2HG       PRO 208  -8.086  -2.838   3.446
  913   2HG   PRO 208          1HG       PRO 208  -9.636  -2.624   2.618
  914   1HD   PRO 208          2HD       PRO 208  -7.205  -1.334   1.958
  915   2HD   PRO 208          1HD       PRO 208  -8.817  -0.906   1.351
  916    H    ILE 209           H        ILE 209  -8.568   0.471   6.943
  917    HA   ILE 209           HA       ILE 209  -6.021  -0.781   7.514
  918    HB   ILE 209           HB       ILE 209  -5.208   1.242   6.347
  919   1HG1  ILE 209          2HG1      ILE 209  -3.777   2.102   8.195
  920   2HG1  ILE 209          1HG1      ILE 209  -4.815   1.276   9.358
  921   1HG2  ILE 209          2HG2      ILE 209  -7.156   2.683   6.824
  922   2HG2  ILE 209          1HG2      ILE 209  -6.715   2.715   8.531
  923   3HG2  ILE 209          3HG2      ILE 209  -5.657   3.460   7.333
  924   1HD1  ILE 209          3HD1      ILE 209  -3.566  -0.247   7.080
  925   2HD1  ILE 209          2HD1      ILE 209  -2.651   0.068   8.555
  926   3HD1  ILE 209          1HD1      ILE 209  -4.151  -0.857   8.627
  927    H    TYR 210           H        TYR 210  -8.506   1.540   8.476
  928    HA   TYR 210           HA       TYR 210  -7.965   1.606  11.263
  929   1HB   TYR 210          2HB       TYR 210 -10.301   2.164   9.525
  930   2HB   TYR 210          1HB       TYR 210 -10.677   1.796  11.208
  931    HD1  TYR 210           HD1      TYR 210  -9.723   3.172  13.044
  932    HD2  TYR 210           HD2      TYR 210  -9.146   4.190   8.911
  933    HE1  TYR 210           HE1      TYR 210  -9.016   5.455  13.706
  934    HE2  TYR 210           HE2      TYR 210  -8.439   6.474   9.573
  935    HH   TYR 210           HH       TYR 210  -8.608   7.996  11.384
  936    H    LEU 211           HN       LEU 211 -10.069   0.641  12.675
  937    HA   LEU 211           HA       LEU 211  -9.535  -2.225  12.696
  938   1HB   LEU 211          2HB       LEU 211 -10.848  -0.259  14.439
  939   2HB   LEU 211          1HB       LEU 211 -11.663  -1.824  14.413
  940    HG   LEU 211           HG       LEU 211  -9.936  -1.786  16.166
  941   1HD1  LEU 211          1HD1      LEU 211  -9.972  -3.618  13.892
  942   2HD1  LEU 211          3HD1      LEU 211  -8.403  -3.594  14.698
  943   3HD1  LEU 211          2HD1      LEU 211  -9.860  -3.977  15.615
  944   1HD2  LEU 211          3HD2      LEU 211  -8.520  -0.250  14.334
  945   2HD2  LEU 211          2HD2      LEU 211  -7.880  -0.900  15.843
  946   3HD2  LEU 211          1HD2      LEU 211  -7.652  -1.786  14.335
   
  No H/Q in entry =         946
  Start of MODEL    2
    1   1H    SER   1          1HT       SER   1  -4.489  -8.400 -23.901
    2   2H    SER   1          3HT       SER   1  -4.759  -9.679 -22.821
    3   3H    SER   1          2HT       SER   1  -4.563  -9.997 -24.479
    4    HA   SER   1           HA       SER   1  -6.633  -9.161 -25.040
    5   1HB   SER   1          2HB       SER   1  -6.602 -11.286 -23.575
    6   2HB   SER   1          1HB       SER   1  -7.166 -10.243 -22.270
    7    HG   SER   1           HG       SER   1  -8.410 -10.436 -24.807
    8    H    ILE   2           H        ILE   2  -5.411  -7.905 -22.018
    9    HA   ILE   2           HA       ILE   2  -7.699  -6.057 -21.736
   10    HB   ILE   2           HB       ILE   2  -6.208  -5.201 -19.777
   11   1HG1  ILE   2          2HG1      ILE   2  -4.930  -7.911 -20.234
   12   2HG1  ILE   2          1HG1      ILE   2  -4.160  -6.392 -20.694
   13   1HG2  ILE   2          3HG2      ILE   2  -7.788  -7.685 -20.075
   14   2HG2  ILE   2          2HG2      ILE   2  -6.772  -7.607 -18.636
   15   3HG2  ILE   2          1HG2      ILE   2  -7.981  -6.357 -18.930
   16   1HD1  ILE   2          1HD1      ILE   2  -5.219  -6.607 -17.911
   17   2HD1  ILE   2          3HD1      ILE   2  -3.756  -7.514 -18.291
   18   3HD1  ILE   2          2HD1      ILE   2  -3.790  -5.763 -18.505
   19    H    GLN   3           H        GLN   3  -6.475  -3.732 -20.877
   20    HA   GLN   3           HA       GLN   3  -5.457  -2.675 -23.425
   21   1HB   GLN   3          2HB       GLN   3  -7.025  -1.619 -21.408
   22   2HB   GLN   3          1HB       GLN   3  -5.459  -0.859 -21.118
   23   1HG   GLN   3          2HG       GLN   3  -5.412   0.143 -23.244
   24   2HG   GLN   3          1HG       GLN   3  -6.602  -0.979 -23.903
   25   1HE2  GLN   3          2HE2      GLN   3  -7.856   2.320 -21.827
   26   2HE2  GLN   3          1HE2      GLN   3  -6.215   1.883 -21.821
   27    H    ALA   4           H        ALA   4  -3.545  -4.349 -22.731
   28    HA   ALA   4           HA       ALA   4  -1.592  -3.349 -20.864
   29   1HB   ALA   4          3HB       ALA   4  -1.788  -5.730 -21.798
   30   2HB   ALA   4          2HB       ALA   4  -1.001  -5.111 -23.249
   31   3HB   ALA   4          1HB       ALA   4  -0.159  -5.062 -21.700
   32    H    GLU   5           H        GLU   5  -0.506  -1.492 -21.147
   33    HA   GLU   5           HA       GLU   5   1.391  -0.712 -22.824
   34   1HB   GLU   5          2HB       GLU   5  -1.168  -0.640 -24.342
   35   2HB   GLU   5          1HB       GLU   5  -0.068   0.723 -24.568
   36   1HG   GLU   5          2HG       GLU   5   1.636  -0.623 -25.417
   37   2HG   GLU   5          1HG       GLU   5   1.016  -2.069 -24.617
   38    H    GLU   6           H        GLU   6  -1.330   0.162 -20.974
   39    HA   GLU   6           HA       GLU   6  -0.209   2.914 -20.687
   40   1HB   GLU   6          2HB       GLU   6  -3.145   2.358 -20.354
   41   2HB   GLU   6          1HB       GLU   6  -2.342   3.893 -20.683
   42   1HG   GLU   6          2HG       GLU   6  -2.299   1.586 -22.641
   43   2HG   GLU   6          1HG       GLU   6  -3.556   2.823 -22.662
   44    H    TRP   7           H        TRP   7  -2.535   0.710 -19.109
   45    HA   TRP   7           HA       TRP   7  -1.341   1.529 -16.505
   46   1HB   TRP   7          2HB       TRP   7  -3.543   0.756 -15.534
   47   2HB   TRP   7          1HB       TRP   7  -3.664   2.164 -16.587
   48    HD1  TRP   7           HD1      TRP   7  -5.096   1.958 -18.731
   49    HE1  TRP   7           HE1      TRP   7  -6.524   0.078 -19.768
   50    HE3  TRP   7           HE3      TRP   7  -3.653  -1.969 -15.803
   51    HZ2  TRP   7           HZ2      TRP   7  -6.991  -2.713 -19.406
   52    HZ3  TRP   7           HZ3      TRP   7  -4.607  -4.228 -16.174
   53    HH2  TRP   7           HH2      TRP   7  -6.272  -4.604 -17.970
   54    H    TYR   8           H        TYR   8  -1.101  -0.897 -18.646
   55    HA   TYR   8           HA       TYR   8  -0.402  -2.841 -16.540
   56   1HB   TYR   8          2HB       TYR   8  -2.597  -3.575 -16.863
   57   2HB   TYR   8          1HB       TYR   8  -2.572  -3.239 -18.590
   58    HD1  TYR   8           HD1      TYR   8  -0.689  -4.665 -19.917
   59    HD2  TYR   8           HD2      TYR   8  -2.468  -5.746 -16.162
   60    HE1  TYR   8           HE1      TYR   8  -0.122  -7.044 -20.328
   61    HE2  TYR   8           HE2      TYR   8  -1.902  -8.114 -16.577
   62    HH   TYR   8           HH       TYR   8  -0.102  -9.357 -17.990
   63    H    PHE   9           H        PHE   9   1.478  -3.774 -17.057
   64    HA   PHE   9           HA       PHE   9   2.510  -3.374 -19.808
   65   1HB   PHE   9          2HB       PHE   9   3.742  -3.717 -17.099
   66   2HB   PHE   9          1HB       PHE   9   4.691  -4.134 -18.524
   67    HD1  PHE   9           HD1      PHE   9   2.068  -1.517 -18.594
   68    HD2  PHE   9           HD2      PHE   9   6.290  -2.291 -18.231
   69    HE1  PHE   9           HE1      PHE   9   2.548   0.882 -18.971
   70    HE2  PHE   9           HE2      PHE   9   6.756   0.112 -18.610
   71    HZ   PHE   9           HZ       PHE   9   4.888   1.697 -18.979
   72    H    GLY  10           H        GLY  10   1.825  -5.937 -17.463
   73   1HA   GLY  10          2HA       GLY  10   1.219  -8.065 -18.893
   74   2HA   GLY  10          1HA       GLY  10   2.896  -7.928 -19.396
   75    H    LYS  11           H        LYS  11   4.214  -9.201 -18.285
   76    HA   LYS  11           HA       LYS  11   3.484 -10.020 -15.513
   77   1HB   LYS  11          2HB       LYS  11   5.662 -11.324 -17.122
   78   2HB   LYS  11          1HB       LYS  11   4.604 -12.034 -15.904
   79   1HG   LYS  11          2HG       LYS  11   2.847 -11.147 -17.878
   80   2HG   LYS  11          1HG       LYS  11   4.210 -11.801 -18.788
   81   1HD   LYS  11          2HD       LYS  11   3.265 -13.412 -16.470
   82   2HD   LYS  11          1HD       LYS  11   2.201 -13.353 -17.874
   83   1HE   LYS  11          2HE       LYS  11   3.505 -14.999 -18.726
   84   2HE   LYS  11          1HE       LYS  11   4.696 -13.730 -19.012
   85   1HZ   LYS  11          2HZ       LYS  11   4.541 -15.006 -16.368
   86   2HZ   LYS  11          1HZ       LYS  11   5.336 -15.811 -17.636
   87   3HZ   LYS  11          3HZ       LYS  11   5.872 -14.282 -17.137
   88    H    LEU  12           H        LEU  12   4.283  -7.782 -15.016
   89    HA   LEU  12           HA       LEU  12   7.266  -7.622 -15.000
   90   1HB   LEU  12          2HB       LEU  12   5.896  -5.793 -16.100
   91   2HB   LEU  12          1HB       LEU  12   5.292  -5.386 -14.497
   92    HG   LEU  12           HG       LEU  12   7.550  -4.948 -13.709
   93   1HD1  LEU  12          2HD1      LEU  12   8.224  -6.461 -16.094
   94   2HD1  LEU  12          1HD1      LEU  12   9.090  -4.924 -16.060
   95   3HD1  LEU  12          3HD1      LEU  12   9.243  -6.050 -14.712
   96   1HD2  LEU  12          3HD2      LEU  12   6.452  -3.595 -16.108
   97   2HD2  LEU  12          2HD2      LEU  12   6.844  -2.934 -14.519
   98   3HD2  LEU  12          1HD2      LEU  12   8.126  -3.215 -15.699
   99    H    GLY  13           H        GLY  13   8.199  -6.496 -13.033
  100   1HA   GLY  13          2HA       GLY  13   6.768  -7.442 -10.584
  101   2HA   GLY  13          1HA       GLY  13   8.523  -7.346 -10.728
  102    H    ARG  14           H        ARG  14   8.394  -5.989  -8.757
  103    HA   ARG  14           HA       ARG  14   7.179  -3.315  -9.080
  104   1HB   ARG  14          2HB       ARG  14   8.145  -3.014  -6.730
  105   2HB   ARG  14          1HB       ARG  14   6.893  -4.243  -6.906
  106   1HG   ARG  14          2HG       ARG  14   8.319  -5.889  -6.306
  107   2HG   ARG  14          1HG       ARG  14   9.541  -5.328  -7.448
  108   1HD   ARG  14          2HD       ARG  14  10.039  -5.253  -4.863
  109   2HD   ARG  14          1HD       ARG  14  10.540  -3.910  -5.891
  110    HE   ARG  14           HE       ARG  14   7.865  -3.537  -4.811
  111   1HH1  ARG  14          2HH1      ARG  14  10.656  -1.926  -5.201
  112   2HH1  ARG  14          1HH1      ARG  14  10.766  -1.263  -3.605
  113   1HH2  ARG  14          1HH2      ARG  14   8.249  -3.268  -2.314
  114   2HH2  ARG  14          2HH2      ARG  14   9.403  -2.023  -1.970
  115    H    LYS  15           H        LYS  15  10.273  -4.819  -9.409
  116    HA   LYS  15           HA       LYS  15  11.872  -2.486  -8.959
  117   1HB   LYS  15          2HB       LYS  15  12.413  -5.159  -9.271
  118   2HB   LYS  15          1HB       LYS  15  12.950  -4.499 -10.816
  119   1HG   LYS  15          2HG       LYS  15  13.779  -2.788  -8.623
  120   2HG   LYS  15          1HG       LYS  15  14.355  -4.438  -8.380
  121   1HD   LYS  15          2HD       LYS  15  14.813  -4.016 -11.079
  122   2HD   LYS  15          1HD       LYS  15  15.183  -2.446 -10.369
  123   1HE   LYS  15          2HE       LYS  15  16.577  -3.719  -8.640
  124   2HE   LYS  15          1HE       LYS  15  16.403  -5.128  -9.685
  125   1HZ   LYS  15          1HZ       LYS  15  17.152  -3.294 -11.454
  126   2HZ   LYS  15          3HZ       LYS  15  17.955  -2.707 -10.081
  127   3HZ   LYS  15          2HZ       LYS  15  18.249  -4.290 -10.622
  128    H    ASP  16           H        ASP  16  10.390  -3.988 -11.789
  129    HA   ASP  16           HA       ASP  16  11.554  -2.027 -13.561
  130   1HB   ASP  16          2HB       ASP  16  10.879  -4.466 -14.119
  131   2HB   ASP  16          1HB       ASP  16   9.254  -3.811 -14.241
  132    H    ALA  17           H        ALA  17   8.330  -2.796 -12.313
  133    HA   ALA  17           HA       ALA  17   6.790  -0.838 -13.503
  134   1HB   ALA  17          2HB       ALA  17   6.749  -2.135 -10.836
  135   2HB   ALA  17          1HB       ALA  17   5.799  -0.659 -11.000
  136   3HB   ALA  17          3HB       ALA  17   5.481  -2.032 -12.059
  137    H    GLU  18           H        GLU  18   8.911  -0.399 -10.684
  138    HA   GLU  18           HA       GLU  18   8.367   2.442 -10.493
  139   1HB   GLU  18          2HB       GLU  18  10.341   2.479  -8.988
  140   2HB   GLU  18          1HB       GLU  18   9.224   1.183  -8.558
  141   1HG   GLU  18          2HG       GLU  18  11.262   0.050  -8.548
  142   2HG   GLU  18          1HG       GLU  18  10.711  -0.242 -10.197
  143    H    ARG  19           H        ARG  19  10.820   0.449 -12.102
  144    HA   ARG  19           HA       ARG  19  12.488   2.628 -12.955
  145   1HB   ARG  19          2HB       ARG  19  12.436  -0.197 -13.257
  146   2HB   ARG  19          1HB       ARG  19  12.514   0.495 -14.878
  147   1HG   ARG  19          2HG       ARG  19  14.357   1.207 -12.574
  148   2HG   ARG  19          1HG       ARG  19  14.778   0.162 -13.931
  149   1HD   ARG  19          2HD       ARG  19  13.886   2.318 -15.292
  150   2HD   ARG  19          1HD       ARG  19  14.474   3.120 -13.836
  151    HE   ARG  19           HE       ARG  19  16.522   1.369 -14.597
  152   1HH1  ARG  19          2HH1      ARG  19  16.219   4.531 -14.632
  153   2HH1  ARG  19          1HH1      ARG  19  16.875   4.845 -16.204
  154   1HH2  ARG  19          1HH2      ARG  19  16.745   1.529 -17.211
  155   2HH2  ARG  19          2HH2      ARG  19  17.172   3.145 -17.665
  156    H    GLN  20           H        GLN  20  10.579   0.630 -15.195
  157    HA   GLN  20           HA       GLN  20  10.441   2.323 -17.347
  158   1HB   GLN  20          2HB       GLN  20   8.997   0.053 -16.495
  159   2HB   GLN  20          1HB       GLN  20   7.783   1.261 -16.916
  160   1HG   GLN  20          2HG       GLN  20   8.257   1.108 -19.123
  161   2HG   GLN  20          1HG       GLN  20   9.995   1.175 -18.832
  162   1HE2  GLN  20          2HE2      GLN  20  10.318  -2.258 -19.501
  163   2HE2  GLN  20          1HE2      GLN  20  10.982  -0.699 -19.588
  164    H    LEU  21           H        LEU  21   8.188   2.452 -14.560
  165    HA   LEU  21           HA       LEU  21   6.556   4.554 -15.416
  166   1HB   LEU  21          2HB       LEU  21   7.427   3.523 -12.783
  167   2HB   LEU  21          1HB       LEU  21   6.825   5.179 -12.784
  168    HG   LEU  21           HG       LEU  21   4.727   4.513 -13.728
  169   1HD1  LEU  21          2HD1      LEU  21   5.753   2.866 -15.335
  170   2HD1  LEU  21          1HD1      LEU  21   5.853   1.712 -14.006
  171   3HD1  LEU  21          3HD1      LEU  21   4.280   2.283 -14.561
  172   1HD2  LEU  21          3HD2      LEU  21   5.784   2.859 -11.474
  173   2HD2  LEU  21          2HD2      LEU  21   4.475   4.041 -11.480
  174   3HD2  LEU  21          1HD2      LEU  21   4.209   2.429 -12.142
  175    H    LEU  22           H        LEU  22   9.321   5.071 -13.220
  176    HA   LEU  22           HA       LEU  22   9.504   7.842 -13.476
  177   1HB   LEU  22          2HB       LEU  22  11.807   5.878 -13.269
  178   2HB   LEU  22          1HB       LEU  22  11.908   7.603 -12.919
  179    HG   LEU  22           HG       LEU  22  10.340   5.487 -11.434
  180   1HD1  LEU  22          2HD1      LEU  22  12.853   6.354 -11.026
  181   2HD1  LEU  22          1HD1      LEU  22  11.983   7.599 -10.129
  182   3HD1  LEU  22          3HD1      LEU  22  11.787   5.901  -9.696
  183   1HD2  LEU  22          2HD2      LEU  22   9.828   8.398 -11.718
  184   2HD2  LEU  22          1HD2      LEU  22   8.712   7.094 -11.319
  185   3HD2  LEU  22          3HD2      LEU  22   9.775   7.757 -10.076
  186    H    SER  23           H        SER  23  10.362   5.398 -15.812
  187    HA   SER  23           HA       SER  23  12.069   7.016 -17.463
  188   1HB   SER  23          2HB       SER  23  10.258   4.809 -18.459
  189   2HB   SER  23          1HB       SER  23  11.815   5.315 -19.115
  190    HG   SER  23           HG       SER  23  12.832   4.253 -17.592
  191    H    PHE  24           H        PHE  24  11.550   8.463 -19.092
  192    HA   PHE  24           HA       PHE  24   9.228   9.964 -19.079
  193   1HB   PHE  24          2HB       PHE  24   9.724  10.458 -21.519
  194   2HB   PHE  24          1HB       PHE  24  11.088  10.685 -20.424
  195    HD1  PHE  24           HD1      PHE  24   9.644   8.557 -23.063
  196    HD2  PHE  24           HD2      PHE  24  12.976   9.135 -20.413
  197    HE1  PHE  24           HE1      PHE  24  10.963   6.907 -24.361
  198    HE2  PHE  24           HE2      PHE  24  14.295   7.484 -21.711
  199    HZ   PHE  24           HZ       PHE  24  13.288   6.371 -23.686
  200    H    GLY  25           H        GLY  25   7.140   9.342 -19.314
  201   1HA   GLY  25          2HA       GLY  25   5.724   8.422 -21.358
  202   2HA   GLY  25          1HA       GLY  25   6.538   6.919 -20.922
  203    H    ASN  26           H        ASN  26   6.373   8.195 -18.024
  204    HA   ASN  26           HA       ASN  26   3.495   7.767 -17.497
  205   1HB   ASN  26          2HB       ASN  26   5.555   6.165 -15.973
  206   2HB   ASN  26          1HB       ASN  26   3.803   5.963 -15.974
  207   1HD2  ASN  26          2HD2      ASN  26   3.764   4.014 -18.938
  208   2HD2  ASN  26          1HD2      ASN  26   2.832   4.832 -17.780
  209    HA   PRO  27           HA       PRO  27   5.386  10.996 -14.850
  210   1HB   PRO  27          2HB       PRO  27   3.406  12.841 -15.337
  211   2HB   PRO  27          1HB       PRO  27   4.851  12.665 -16.344
  212   1HG   PRO  27          2HG       PRO  27   2.044  11.807 -16.905
  213   2HG   PRO  27          1HG       PRO  27   3.330  12.239 -18.041
  214   1HD   PRO  27          2HD       PRO  27   2.500   9.608 -17.379
  215   2HD   PRO  27          1HD       PRO  27   3.981  10.046 -18.255
  216    H    ARG  28           H        ARG  28   3.501  12.611 -13.477
  217    HA   ARG  28           HA       ARG  28   2.546  10.760 -11.477
  218   1HB   ARG  28          2HB       ARG  28   3.174  13.359 -11.371
  219   2HB   ARG  28          1HB       ARG  28   1.437  13.528 -11.627
  220   1HG   ARG  28          2HG       ARG  28   1.764  11.482  -9.696
  221   2HG   ARG  28          1HG       ARG  28   2.839  12.796  -9.217
  222   1HD   ARG  28          2HD       ARG  28   0.571  14.162  -9.961
  223   2HD   ARG  28          1HD       ARG  28  -0.105  12.695  -9.253
  224    HE   ARG  28           HE       ARG  28   1.780  13.473  -7.398
  225   1HH1  ARG  28          2HH1      ARG  28  -1.264  14.439  -8.567
  226   2HH1  ARG  28          1HH1      ARG  28  -1.423  15.786  -7.491
  227   1HH2  ARG  28          1HH2      ARG  28   1.777  15.467  -6.194
  228   2HH2  ARG  28          2HH2      ARG  28   0.299  16.369  -6.147
  229    H    GLY  29           H        GLY  29   0.459   9.990 -11.132
  230   1HA   GLY  29          2HA       GLY  29  -1.926   9.936 -11.486
  231   2HA   GLY  29          1HA       GLY  29  -1.711  10.952 -12.911
  232    H    THR  30           H        THR  30   0.668   8.667 -13.077
  233    HA   THR  30           HA       THR  30  -0.953   7.037 -14.962
  234    HB   THR  30           HB       THR  30   2.035   6.839 -14.599
  235    HG1  THR  30           HG1      THR  30   0.511   8.885 -15.703
  236   1HG2  THR  30          3HG2      THR  30   0.070   6.329 -16.840
  237   2HG2  THR  30          2HG2      THR  30   1.816   6.369 -17.092
  238   3HG2  THR  30          1HG2      THR  30   1.107   5.157 -16.024
  239    H    PHE  31           H        PHE  31  -1.481   4.945 -14.466
  240    HA   PHE  31           HA       PHE  31  -0.092   3.714 -12.119
  241   1HB   PHE  31          2HB       PHE  31  -2.989   3.386 -12.936
  242   2HB   PHE  31          1HB       PHE  31  -2.212   2.608 -11.560
  243    HD1  PHE  31           HD1      PHE  31  -2.578   6.052 -13.019
  244    HD2  PHE  31           HD2      PHE  31  -2.458   3.624  -9.479
  245    HE1  PHE  31           HE1      PHE  31  -3.007   8.058 -11.627
  246    HE2  PHE  31           HE2      PHE  31  -2.887   5.628  -8.088
  247    HZ   PHE  31           HZ       PHE  31  -3.160   7.846  -9.161
  248    H    LEU  32           H        LEU  32   1.259   2.266 -13.071
  249    HA   LEU  32           HA       LEU  32   0.469   0.751 -15.455
  250   1HB   LEU  32          2HB       LEU  32   2.751   1.244 -15.483
  251   2HB   LEU  32          1HB       LEU  32   2.923   1.029 -13.745
  252    HG   LEU  32           HG       LEU  32   2.296  -1.319 -15.533
  253   1HD1  LEU  32          1HD1      LEU  32   4.475   0.151 -16.064
  254   2HD1  LEU  32          3HD1      LEU  32   5.108  -0.767 -14.696
  255   3HD1  LEU  32          2HD1      LEU  32   4.506  -1.611 -16.123
  256   1HD2  LEU  32          1HD2      LEU  32   2.486  -0.994 -12.780
  257   2HD2  LEU  32          3HD2      LEU  32   2.612  -2.528 -13.638
  258   3HD2  LEU  32          2HD2      LEU  32   4.069  -1.630 -13.219
  259    H    ILE  33           H        ILE  33   0.506  -1.666 -15.422
  260    HA   ILE  33           HA       ILE  33  -0.185  -2.792 -12.743
  261    HB   ILE  33           HB       ILE  33  -1.683  -3.061 -15.343
  262   1HG1  ILE  33          2HG1      ILE  33  -2.396  -2.618 -12.439
  263   2HG1  ILE  33          1HG1      ILE  33  -2.576  -1.479 -13.772
  264   1HG2  ILE  33          1HG2      ILE  33  -1.101  -5.367 -14.683
  265   2HG2  ILE  33          3HG2      ILE  33  -1.758  -5.065 -13.076
  266   3HG2  ILE  33          2HG2      ILE  33  -2.822  -5.052 -14.477
  267   1HD1  ILE  33          3HD1      ILE  33  -3.950  -3.896 -14.463
  268   2HD1  ILE  33          2HD1      ILE  33  -4.461  -3.412 -12.847
  269   3HD1  ILE  33          1HD1      ILE  33  -4.630  -2.291 -14.198
  270    H    ARG  34           H        ARG  34   0.064  -5.303 -12.859
  271    HA   ARG  34           HA       ARG  34   1.613  -6.568 -14.860
  272   1HB   ARG  34          2HB       ARG  34   3.868  -6.473 -13.642
  273   2HB   ARG  34          1HB       ARG  34   3.383  -5.016 -14.512
  274   1HG   ARG  34          2HG       ARG  34   2.604  -3.982 -12.462
  275   2HG   ARG  34          1HG       ARG  34   2.871  -5.474 -11.560
  276   1HD   ARG  34          2HD       ARG  34   5.321  -5.295 -12.229
  277   2HD   ARG  34          1HD       ARG  34   4.955  -3.667 -12.803
  278    HE   ARG  34           HE       ARG  34   4.737  -2.962 -10.542
  279   1HH1  ARG  34          2HH1      ARG  34   4.478  -6.378 -10.804
  280   2HH1  ARG  34          1HH1      ARG  34   4.862  -6.674  -9.142
  281   1HH2  ARG  34          1HH2      ARG  34   5.430  -3.334  -8.403
  282   2HH2  ARG  34          2HH2      ARG  34   5.400  -4.951  -7.782
  283    H    GLU  35           H        GLU  35   2.578  -8.602 -14.096
  284    HA   GLU  35           HA       GLU  35   0.938  -9.849 -12.072
  285   1HB   GLU  35          2HB       GLU  35   1.785 -11.811 -12.910
  286   2HB   GLU  35          1HB       GLU  35   2.209 -10.768 -14.252
  287   1HG   GLU  35          2HG       GLU  35   4.471 -10.514 -13.413
  288   2HG   GLU  35          1HG       GLU  35   4.067 -11.394 -11.939
  289    H    SER  36           H        SER  36   1.357 -10.018  -9.891
  290    HA   SER  36           HA       SER  36   3.823  -8.870  -8.822
  291   1HB   SER  36          2HB       SER  36   1.510 -10.277  -7.451
  292   2HB   SER  36          1HB       SER  36   2.825  -9.450  -6.630
  293    HG   SER  36           HG       SER  36   2.090  -7.546  -7.269
  294    H    GLU  37           H        GLU  37   5.637 -10.043  -8.439
  295    HA   GLU  37           HA       GLU  37   5.509 -12.993  -8.628
  296   1HB   GLU  37          2HB       GLU  37   7.828 -11.081  -8.270
  297   2HB   GLU  37          1HB       GLU  37   7.987 -12.826  -8.453
  298   1HG   GLU  37          2HG       GLU  37   6.318 -11.982 -10.567
  299   2HG   GLU  37          1HG       GLU  37   7.636 -10.811 -10.501
  300    H    THR  38           H        THR  38   4.621 -11.076  -6.311
  301    HA   THR  38           HA       THR  38   6.300 -11.904  -4.079
  302    HB   THR  38           HB       THR  38   4.834  -9.761  -4.321
  303    HG1  THR  38           HG1      THR  38   5.947 -10.335  -2.432
  304   1HG2  THR  38          3HG2      THR  38   2.791 -11.746  -3.293
  305   2HG2  THR  38          2HG2      THR  38   2.578  -9.996  -3.337
  306   3HG2  THR  38          1HG2      THR  38   2.728 -10.904  -4.841
  307    H    THR  39           H        THR  39   3.115 -12.747  -5.358
  308    HA   THR  39           HA       THR  39   3.098 -15.084  -3.478
  309    HB   THR  39           HB       THR  39   1.154 -13.338  -3.573
  310    HG1  THR  39           HG1      THR  39   0.469 -14.944  -2.432
  311   1HG2  THR  39          3HG2      THR  39   1.136 -13.879  -6.210
  312   2HG2  THR  39          2HG2      THR  39  -0.018 -15.096  -5.662
  313   3HG2  THR  39          1HG2      THR  39  -0.311 -13.390  -5.330
  314    H    LYS  40           H        LYS  40   1.466 -16.843  -4.737
  315    HA   LYS  40           HA       LYS  40   3.028 -18.264  -6.508
  316   1HB   LYS  40          2HB       LYS  40   0.061 -18.076  -6.981
  317   2HB   LYS  40          1HB       LYS  40   1.102 -19.491  -7.112
  318   1HG   LYS  40          2HG       LYS  40   0.135 -18.105  -4.609
  319   2HG   LYS  40          1HG       LYS  40  -0.111 -19.784  -5.084
  320   1HD   LYS  40          2HD       LYS  40   2.683 -19.401  -5.074
  321   2HD   LYS  40          1HD       LYS  40   2.090 -18.618  -3.609
  322   1HE   LYS  40          2HE       LYS  40   1.913 -20.654  -2.661
  323   2HE   LYS  40          1HE       LYS  40   0.653 -21.041  -3.833
  324   1HZ   LYS  40          3HZ       LYS  40   3.403 -21.218  -4.768
  325   2HZ   LYS  40          2HZ       LYS  40   2.912 -22.399  -3.652
  326   3HZ   LYS  40          1HZ       LYS  40   2.072 -22.210  -5.116
  327    H    GLY  41           H        GLY  41   0.839 -15.612  -7.233
  328   1HA   GLY  41          2HA       GLY  41   2.198 -14.429  -9.292
  329   2HA   GLY  41          1HA       GLY  41   1.313 -15.726 -10.102
  330    H    ALA  42           H        ALA  42   0.814 -13.039  -7.834
  331    HA   ALA  42           HA       ALA  42  -2.045 -12.851  -8.539
  332   1HB   ALA  42          2HB       ALA  42  -0.283 -11.891  -6.416
  333   2HB   ALA  42          1HB       ALA  42  -1.321 -10.610  -7.038
  334   3HB   ALA  42          3HB       ALA  42  -2.036 -12.091  -6.400
  335    H    TYR  43           H        TYR  43  -2.300 -10.042  -8.496
  336    HA   TYR  43           HA       TYR  43  -0.735  -9.333 -10.932
  337   1HB   TYR  43          2HB       TYR  43  -3.584  -9.295 -10.487
  338   2HB   TYR  43          1HB       TYR  43  -2.997  -7.668 -10.840
  339    HD1  TYR  43           HD1      TYR  43  -0.843  -7.875 -12.617
  340    HD2  TYR  43           HD2      TYR  43  -4.333 -10.380 -12.417
  341    HE1  TYR  43           HE1      TYR  43  -0.530  -8.520 -15.000
  342    HE2  TYR  43           HE2      TYR  43  -4.015 -11.024 -14.789
  343    HH   TYR  43           HH       TYR  43  -1.613 -11.019 -16.385
  344    H    SER  44           H        SER  44  -1.127  -6.650 -11.068
  345    HA   SER  44           HA       SER  44  -0.717  -5.459  -8.414
  346   1HB   SER  44          2HB       SER  44   1.469  -6.309  -8.671
  347   2HB   SER  44          1HB       SER  44   1.489  -5.897 -10.387
  348    HG   SER  44           HG       SER  44   1.724  -3.791  -9.904
  349    H    LEU  45           H        LEU  45  -0.140  -3.133  -8.629
  350    HA   LEU  45           HA       LEU  45  -0.798  -1.915 -11.241
  351   1HB   LEU  45          2HB       LEU  45  -2.989  -2.204 -10.089
  352   2HB   LEU  45          1HB       LEU  45  -2.382  -1.219  -8.756
  353    HG   LEU  45           HG       LEU  45  -2.127  -0.146 -11.532
  354   1HD1  LEU  45          2HD1      LEU  45  -4.539  -1.105 -10.936
  355   2HD1  LEU  45          1HD1      LEU  45  -4.651   0.410 -10.042
  356   3HD1  LEU  45          3HD1      LEU  45  -4.348   0.432 -11.780
  357   1HD2  LEU  45          1HD2      LEU  45  -2.288   0.847  -8.731
  358   2HD2  LEU  45          3HD2      LEU  45  -1.231   1.356 -10.048
  359   3HD2  LEU  45          2HD2      LEU  45  -2.911   1.900 -10.001
  360    H    SER  46           H        SER  46   1.411  -1.176 -11.082
  361    HA   SER  46           HA       SER  46   2.294   0.427  -8.848
  362   1HB   SER  46          2HB       SER  46   3.983  -0.635 -10.187
  363   2HB   SER  46          1HB       SER  46   3.384   0.144 -11.647
  364    HG   SER  46           HG       SER  46   5.207   1.206 -10.735
  365    H    ILE  47           H        ILE  47   2.990   2.701  -9.190
  366    HA   ILE  47           HA       ILE  47   1.403   4.243 -11.140
  367    HB   ILE  47           HB       ILE  47   0.080   5.436  -9.628
  368   1HG1  ILE  47          2HG1      ILE  47   1.921   4.447  -7.423
  369   2HG1  ILE  47          1HG1      ILE  47   1.869   6.085  -8.075
  370   1HG2  ILE  47          1HG2      ILE  47   0.389   2.673  -8.417
  371   2HG2  ILE  47          3HG2      ILE  47  -0.974   3.758  -8.137
  372   3HG2  ILE  47          2HG2      ILE  47  -0.679   3.110  -9.751
  373   1HD1  ILE  47          3HD1      ILE  47  -0.588   4.781  -6.903
  374   2HD1  ILE  47          2HD1      ILE  47   0.570   5.642  -5.888
  375   3HD1  ILE  47          1HD1      ILE  47  -0.282   6.495  -7.175
  376    H    ARG  48           H        ARG  48   2.757   5.763 -11.931
  377    HA   ARG  48           HA       ARG  48   5.234   6.423 -10.521
  378   1HB   ARG  48          2HB       ARG  48   4.678   6.291 -13.137
  379   2HB   ARG  48          1HB       ARG  48   4.321   8.001 -12.888
  380   1HG   ARG  48          2HG       ARG  48   6.826   7.024 -11.641
  381   2HG   ARG  48          1HG       ARG  48   6.816   7.052 -13.405
  382   1HD   ARG  48          2HD       ARG  48   5.637   9.471 -12.721
  383   2HD   ARG  48          1HD       ARG  48   6.905   9.281 -11.510
  384    HE   ARG  48           HE       ARG  48   7.951   8.679 -14.117
  385   1HH1  ARG  48          2HH1      ARG  48   7.617  11.005 -11.662
  386   2HH1  ARG  48          1HH1      ARG  48   8.300  12.302 -12.583
  387   1HH2  ARG  48          1HH2      ARG  48   8.522  10.460 -15.512
  388   2HH2  ARG  48          2HH2      ARG  48   8.812  11.994 -14.762
  389    H    ASP  49           H        ASP  49   5.258   7.937  -8.926
  390    HA   ASP  49           HA       ASP  49   3.489  10.319  -9.258
  391   1HB   ASP  49          2HB       ASP  49   2.380   8.962  -7.616
  392   2HB   ASP  49          1HB       ASP  49   3.895   8.639  -6.773
  393    H    TRP  50           H        TRP  50   4.945  11.933  -9.594
  394    HA   TRP  50           HA       TRP  50   7.427  11.993  -7.926
  395   1HB   TRP  50          2HB       TRP  50   8.065  12.146 -10.201
  396   2HB   TRP  50          1HB       TRP  50   6.689  13.165 -10.610
  397    HD1  TRP  50           HD1      TRP  50  10.258  13.354  -9.587
  398    HE1  TRP  50           HE1      TRP  50  10.926  15.808  -9.148
  399    HE3  TRP  50           HE3      TRP  50   5.674  15.475  -9.633
  400    HZ2  TRP  50           HZ2      TRP  50   9.644  18.364  -8.902
  401    HZ3  TRP  50           HZ3      TRP  50   5.391  17.919  -9.306
  402    HH2  TRP  50           HH2      TRP  50   7.373  19.367  -8.943
  403    H    ASP  51           H        ASP  51   8.042  14.204  -7.123
  404    HA   ASP  51           HA       ASP  51   5.754  16.068  -6.796
  405   1HB   ASP  51          2HB       ASP  51   6.565  14.242  -4.780
  406   2HB   ASP  51          1HB       ASP  51   7.123  15.837  -4.276
  407    H    ASP  52           H        ASP  52   6.459  18.204  -6.023
  408    HA   ASP  52           HA       ASP  52   9.121  18.884  -7.065
  409   1HB   ASP  52          2HB       ASP  52   8.422  21.155  -6.901
  410   2HB   ASP  52          1HB       ASP  52   6.982  20.266  -7.393
  411    H    MET  53           H        MET  53   9.143  17.258  -4.644
  412    HA   MET  53           HA       MET  53  10.905  18.925  -3.080
  413   1HB   MET  53          2HB       MET  53   9.535  18.382  -0.928
  414   2HB   MET  53          1HB       MET  53   9.034  19.739  -1.935
  415   1HG   MET  53          2HG       MET  53   7.009  18.770  -2.123
  416   2HG   MET  53          1HG       MET  53   7.768  17.462  -3.027
  417   1HE   MET  53          3HE       MET  53   8.464  15.623  -2.506
  418   2HE   MET  53          2HE       MET  53   8.697  14.839  -0.945
  419   3HE   MET  53          1HE       MET  53   7.137  14.725  -1.755
  420    H    LYS  54           H        LYS  54  11.154  16.419  -4.507
  421    HA   LYS  54           HA       LYS  54  12.626  14.923  -2.629
  422   1HB   LYS  54          2HB       LYS  54  11.199  12.983  -2.241
  423   2HB   LYS  54          1HB       LYS  54  10.372  14.433  -1.675
  424   1HG   LYS  54          2HG       LYS  54   9.170  14.546  -3.866
  425   2HG   LYS  54          1HG       LYS  54   9.928  13.020  -4.322
  426   1HD   LYS  54          2HD       LYS  54   8.533  13.097  -1.690
  427   2HD   LYS  54          1HD       LYS  54   7.518  13.121  -3.132
  428   1HE   LYS  54          2HE       LYS  54   8.259  11.024  -3.847
  429   2HE   LYS  54          1HE       LYS  54   9.764  11.135  -2.933
  430   1HZ   LYS  54          3HZ       LYS  54   7.909  11.274  -0.994
  431   2HZ   LYS  54          2HZ       LYS  54   7.160  10.218  -2.094
  432   3HZ   LYS  54          1HZ       LYS  54   8.696   9.848  -1.470
  433    H    GLY  55           H        GLY  55  10.841  14.977  -5.657
  434   1HA   GLY  55          2HA       GLY  55  12.190  14.403  -7.666
  435   2HA   GLY  55          1HA       GLY  55  12.822  13.062  -6.723
  436    H    ASP  56           H        ASP  56  11.947  11.825  -8.657
  437    HA   ASP  56           HA       ASP  56   9.013  11.598  -8.743
  438   1HB   ASP  56          2HB       ASP  56   9.635   9.761 -10.458
  439   2HB   ASP  56          1HB       ASP  56  10.006  11.428 -10.886
  440    H    HIS  57           H        HIS  57   8.034   9.366  -8.543
  441    HA   HIS  57           HA       HIS  57   9.571   7.398  -7.000
  442   1HB   HIS  57          2HB       HIS  57   7.631   9.245  -5.760
  443   2HB   HIS  57          1HB       HIS  57   7.365   7.545  -5.385
  444    HD1  HIS  57           HD1      HIS  57   8.202   8.760  -2.948
  445    HD2  HIS  57           HD2      HIS  57  11.074   7.876  -5.837
  446    HE1  HIS  57           HE1      HIS  57  10.431   8.696  -1.747
  447    H    VAL  58           H        VAL  58   7.608   5.733  -6.198
  448    HA   VAL  58           HA       VAL  58   5.534   5.473  -8.218
  449    HB   VAL  58           HB       VAL  58   8.129   4.125  -8.481
  450   1HG1  VAL  58          3HG1      VAL  58   5.592   2.528  -8.330
  451   2HG1  VAL  58          2HG1      VAL  58   6.779   2.106  -9.565
  452   3HG1  VAL  58          1HG1      VAL  58   7.230   2.071  -7.861
  453   1HG2  VAL  58          3HG2      VAL  58   5.738   4.658 -10.243
  454   2HG2  VAL  58          2HG2      VAL  58   7.269   5.533 -10.211
  455   3HG2  VAL  58          1HG2      VAL  58   7.212   3.876 -10.820
  456    H    LYS  59           H        LYS  59   3.861   4.827  -7.000
  457    HA   LYS  59           HA       LYS  59   4.359   3.015  -4.683
  458   1HB   LYS  59          2HB       LYS  59   2.899   5.331  -4.793
  459   2HB   LYS  59          1HB       LYS  59   1.646   4.127  -5.100
  460   1HG   LYS  59          2HG       LYS  59   1.681   4.289  -2.747
  461   2HG   LYS  59          1HG       LYS  59   2.671   2.865  -3.072
  462   1HD   LYS  59          2HD       LYS  59   4.167   3.945  -1.716
  463   2HD   LYS  59          1HD       LYS  59   4.570   4.797  -3.207
  464   1HE   LYS  59          2HE       LYS  59   2.529   6.338  -2.438
  465   2HE   LYS  59          1HE       LYS  59   2.996   5.738  -0.847
  466   1HZ   LYS  59          3HZ       LYS  59   5.310   6.436  -2.269
  467   2HZ   LYS  59          2HZ       LYS  59   4.221   7.737  -2.357
  468   3HZ   LYS  59          1HZ       LYS  59   4.700   7.126  -0.845
  469    H    HIS  60           H        HIS  60   3.327   0.963  -4.652
  470    HA   HIS  60           HA       HIS  60   1.872   0.313  -7.176
  471   1HB   HIS  60          2HB       HIS  60   3.252  -1.801  -5.582
  472   2HB   HIS  60          1HB       HIS  60   2.933  -1.741  -7.313
  473    HD1  HIS  60           HD1      HIS  60   4.936  -1.216  -8.684
  474    HD2  HIS  60           HD2      HIS  60   5.242   0.416  -4.860
  475    HE1  HIS  60           HE1      HIS  60   7.203  -0.093  -8.565
  476    H    TYR  61           H        TYR  61   0.122  -1.077  -7.092
  477    HA   TYR  61           HA       TYR  61  -0.983  -1.571  -4.352
  478   1HB   TYR  61          2HB       TYR  61  -2.557  -1.032  -6.893
  479   2HB   TYR  61          1HB       TYR  61  -3.222  -1.219  -5.268
  480    HD1  TYR  61           HD1      TYR  61  -0.858   0.292  -3.903
  481    HD2  TYR  61           HD2      TYR  61  -3.428   1.228  -7.214
  482    HE1  TYR  61           HE1      TYR  61  -0.504   2.712  -3.493
  483    HE2  TYR  61           HE2      TYR  61  -3.074   3.647  -6.805
  484    HH   TYR  61           HH       TYR  61  -0.734   4.787  -4.435
  485    H    LYS  62           H        LYS  62  -0.588  -3.742  -4.074
  486    HA   LYS  62           HA       LYS  62  -0.363  -5.673  -6.122
  487   1HB   LYS  62          2HB       LYS  62   0.185  -5.828  -3.578
  488   2HB   LYS  62          1HB       LYS  62  -1.457  -6.387  -3.407
  489   1HG   LYS  62          2HG       LYS  62  -1.006  -8.166  -5.079
  490   2HG   LYS  62          1HG       LYS  62   0.663  -7.607  -5.196
  491   1HD   LYS  62          2HD       LYS  62   0.259  -9.580  -3.622
  492   2HD   LYS  62          1HD       LYS  62   1.126  -8.208  -2.931
  493   1HE   LYS  62          2HE       LYS  62  -0.737  -7.493  -1.693
  494   2HE   LYS  62          1HE       LYS  62  -1.874  -8.365  -2.721
  495   1HZ   LYS  62          3HZ       LYS  62  -0.480 -10.400  -1.841
  496   2HZ   LYS  62          2HZ       LYS  62  -0.204  -9.351  -0.534
  497   3HZ   LYS  62          1HZ       LYS  62  -1.792  -9.777  -0.965
  498    H    ILE  63           H        ILE  63  -1.869  -6.386  -7.496
  499    HA   ILE  63           HA       ILE  63  -4.721  -5.940  -6.941
  500    HB   ILE  63           HB       ILE  63  -3.075  -6.719  -9.310
  501   1HG1  ILE  63          2HG1      ILE  63  -5.199  -4.664  -8.672
  502   2HG1  ILE  63          1HG1      ILE  63  -3.486  -4.379  -8.990
  503   1HG2  ILE  63          1HG2      ILE  63  -4.922  -8.377  -9.262
  504   2HG2  ILE  63          3HG2      ILE  63  -6.088  -7.061  -9.120
  505   3HG2  ILE  63          2HG2      ILE  63  -5.123  -7.231 -10.587
  506   1HD1  ILE  63          2HD1      ILE  63  -4.401  -5.814 -11.211
  507   2HD1  ILE  63          1HD1      ILE  63  -5.681  -4.651 -10.868
  508   3HD1  ILE  63          3HD1      ILE  63  -4.035  -4.089 -11.155
  509    H    ARG  64           H        ARG  64  -6.147  -7.540  -6.414
  510    HA   ARG  64           HA       ARG  64  -5.213 -10.364  -6.517
  511   1HB   ARG  64          2HB       ARG  64  -6.798  -9.149  -4.235
  512   2HB   ARG  64          1HB       ARG  64  -6.174 -10.795  -4.326
  513   1HG   ARG  64          2HG       ARG  64  -4.554  -8.237  -4.161
  514   2HG   ARG  64          1HG       ARG  64  -4.678  -9.494  -2.930
  515   1HD   ARG  64          2HD       ARG  64  -3.904 -10.795  -5.321
  516   2HD   ARG  64          1HD       ARG  64  -2.897  -9.354  -5.191
  517    HE   ARG  64           HE       ARG  64  -2.280 -10.186  -2.883
  518   1HH1  ARG  64          2HH1      ARG  64  -4.363 -12.374  -4.365
  519   2HH1  ARG  64          1HH1      ARG  64  -3.388 -13.773  -4.062
  520   1HH2  ARG  64          1HH2      ARG  64  -0.688 -11.959  -2.862
  521   2HH2  ARG  64          2HH2      ARG  64  -1.307 -13.538  -3.212
  522    H    LYS  65           H        LYS  65  -6.819 -11.801  -7.180
  523    HA   LYS  65           HA       LYS  65  -9.437 -10.528  -7.855
  524   1HB   LYS  65          2HB       LYS  65  -8.235 -11.194  -9.859
  525   2HB   LYS  65          1HB       LYS  65  -7.953 -12.805  -9.201
  526   1HG   LYS  65          2HG       LYS  65 -10.543 -12.948  -9.027
  527   2HG   LYS  65          1HG       LYS  65 -10.545 -11.585 -10.144
  528   1HD   LYS  65          2HD       LYS  65  -8.889 -13.055 -11.538
  529   2HD   LYS  65          1HD       LYS  65  -9.539 -14.386 -10.583
  530   1HE   LYS  65          2HE       LYS  65 -11.747 -14.024 -11.388
  531   2HE   LYS  65          1HE       LYS  65 -11.338 -12.429 -12.020
  532   1HZ   LYS  65          3HZ       LYS  65  -9.728 -13.637 -13.516
  533   2HZ   LYS  65          2HZ       LYS  65 -10.512 -15.074 -13.060
  534   3HZ   LYS  65          1HZ       LYS  65 -11.374 -13.850 -13.864
  535    H    LEU  66           H        LEU  66 -11.315 -11.604  -7.290
  536    HA   LEU  66           HA       LEU  66 -11.071 -13.576  -5.145
  537   1HB   LEU  66          2HB       LEU  66 -13.414 -12.277  -6.541
  538   2HB   LEU  66          1HB       LEU  66 -13.639 -13.569  -5.367
  539    HG   LEU  66           HG       LEU  66 -13.847 -11.629  -4.065
  540   1HD1  LEU  66          2HD1      LEU  66 -11.837 -13.293  -3.473
  541   2HD1  LEU  66          1HD1      LEU  66 -10.891 -11.825  -3.735
  542   3HD1  LEU  66          3HD1      LEU  66 -12.162 -11.850  -2.512
  543   1HD2  LEU  66          3HD2      LEU  66 -11.474 -10.511  -5.580
  544   2HD2  LEU  66          2HD2      LEU  66 -13.158 -10.034  -5.795
  545   3HD2  LEU  66          1HD2      LEU  66 -12.331  -9.687  -4.278
  546    H    ASP  67           H        ASP  67 -11.706 -15.749  -5.248
  547    HA   ASP  67           HA       ASP  67 -11.399 -17.020  -7.836
  548   1HB   ASP  67          2HB       ASP  67 -11.647 -17.835  -5.045
  549   2HB   ASP  67          1HB       ASP  67 -12.571 -18.883  -6.118
  550    H    ASN  68           H        ASN  68 -13.960 -15.632  -6.062
  551    HA   ASN  68           HA       ASN  68 -16.090 -17.137  -7.436
  552   1HB   ASN  68          2HB       ASN  68 -16.214 -14.661  -5.683
  553   2HB   ASN  68          1HB       ASN  68 -17.601 -15.608  -6.223
  554   1HD2  ASN  68          2HD2      ASN  68 -15.446 -16.859  -3.031
  555   2HD2  ASN  68          1HD2      ASN  68 -15.095 -15.402  -3.828
  556    H    GLY  69           H        GLY  69 -14.015 -14.593  -8.148
  557   1HA   GLY  69          2HA       GLY  69 -14.028 -13.586 -10.357
  558   2HA   GLY  69          1HA       GLY  69 -15.780 -13.729 -10.349
  559    H    GLY  70           H        GLY  70 -13.073 -11.939  -8.960
  560   1HA   GLY  70          2HA       GLY  70 -14.659  -9.539  -8.842
  561   2HA   GLY  70          1HA       GLY  70 -14.288 -10.173  -7.250
  562    H    TYR  71           H        TYR  71 -12.881  -8.803 -10.193
  563    HA   TYR  71           HA       TYR  71 -10.141  -8.891  -9.184
  564   1HB   TYR  71          2HB       TYR  71 -11.543  -7.649 -11.522
  565   2HB   TYR  71          1HB       TYR  71  -9.968  -7.005 -11.061
  566    HD1  TYR  71           HD1      TYR  71  -8.048  -8.716 -10.711
  567    HD2  TYR  71           HD2      TYR  71 -11.686  -9.608 -12.808
  568    HE1  TYR  71           HE1      TYR  71  -6.933 -10.628 -11.830
  569    HE2  TYR  71           HE2      TYR  71 -10.575 -11.521 -13.927
  570    HH   TYR  71           HH       TYR  71  -7.960 -12.045 -14.502
  571    H    TYR  72           H        TYR  72  -9.360  -7.540  -7.615
  572    HA   TYR  72           HA       TYR  72 -10.432  -4.769  -7.467
  573   1HB   TYR  72          2HB       TYR  72 -10.913  -4.935  -5.094
  574   2HB   TYR  72          1HB       TYR  72 -11.809  -6.192  -5.938
  575    HD1  TYR  72           HD1      TYR  72  -8.975  -5.487  -3.694
  576    HD2  TYR  72           HD2      TYR  72 -11.174  -8.554  -5.734
  577    HE1  TYR  72           HE1      TYR  72  -7.851  -7.191  -2.322
  578    HE2  TYR  72           HE2      TYR  72 -10.045 -10.274  -4.359
  579    HH   TYR  72           HH       TYR  72  -8.760 -10.615  -2.535
  580    H    ILE  73           H        ILE  73  -8.761  -3.350  -7.054
  581    HA   ILE  73           HA       ILE  73  -6.106  -4.425  -6.372
  582    HB   ILE  73           HB       ILE  73  -6.837  -1.489  -6.349
  583   1HG1  ILE  73          2HG1      ILE  73  -6.473  -3.297  -8.749
  584   2HG1  ILE  73          1HG1      ILE  73  -7.807  -2.193  -8.417
  585   1HG2  ILE  73          2HG2      ILE  73  -4.535  -2.478  -5.711
  586   2HG2  ILE  73          1HG2      ILE  73  -4.352  -2.807  -7.434
  587   3HG2  ILE  73          3HG2      ILE  73  -4.562  -1.148  -6.871
  588   1HD1  ILE  73          1HD1      ILE  73  -4.937  -1.326  -8.889
  589   2HD1  ILE  73          3HD1      ILE  73  -6.206  -1.293 -10.114
  590   3HD1  ILE  73          2HD1      ILE  73  -6.333  -0.267  -8.686
  591    H    THR  74           H        THR  74  -8.851  -2.918  -4.928
  592    HA   THR  74           HA       THR  74  -7.641  -3.280  -2.237
  593    HB   THR  74           HB       THR  74  -7.781  -1.039  -1.942
  594    HG1  THR  74           HG1      THR  74 -10.107  -0.322  -1.795
  595   1HG2  THR  74          3HG2      THR  74  -8.021  -0.847  -4.477
  596   2HG2  THR  74          2HG2      THR  74  -9.762  -0.746  -4.206
  597   3HG2  THR  74          1HG2      THR  74  -8.692   0.488  -3.540
  598    H    THR  75           H        THR  75  -9.069  -4.237  -0.787
  599    HA   THR  75           HA       THR  75 -11.166  -5.819  -1.919
  600    HB   THR  75           HB       THR  75 -11.616  -6.511   0.387
  601    HG1  THR  75           HG1      THR  75 -10.534  -5.445   2.062
  602   1HG2  THR  75          1HG2      THR  75  -9.113  -6.555  -0.986
  603   2HG2  THR  75          3HG2      THR  75  -8.785  -6.424   0.745
  604   3HG2  THR  75          2HG2      THR  75  -9.765  -7.757   0.134
  605    H    ARG  76           H        ARG  76 -11.261  -2.559  -1.267
  606    HA   ARG  76           HA       ARG  76 -13.993  -2.433  -0.249
  607   1HB   ARG  76          2HB       ARG  76 -11.924  -0.669  -0.207
  608   2HB   ARG  76          1HB       ARG  76 -12.830  -0.059  -1.592
  609   1HG   ARG  76          2HG       ARG  76 -13.924  -0.547   1.195
  610   2HG   ARG  76          1HG       ARG  76 -13.633   1.025   0.447
  611   1HD   ARG  76          2HD       ARG  76 -15.257   0.387  -1.363
  612   2HD   ARG  76          1HD       ARG  76 -15.627  -1.076  -0.452
  613    HE   ARG  76           HE       ARG  76 -16.043   0.910   1.402
  614   1HH1  ARG  76          1HH2      ARG  76 -16.818   3.045  -0.144
  615   2HH1  ARG  76          2HH2      ARG  76 -18.421   2.709  -0.708
  616   1HH2  ARG  76          2HH1      ARG  76 -18.223  -0.691  -0.057
  617   2HH2  ARG  76          1HH1      ARG  76 -19.216   0.594  -0.659
  618    H    ALA  77           H        ALA  77 -12.551  -2.941  -3.318
  619    HA   ALA  77           HA       ALA  77 -15.199  -2.790  -4.585
  620   1HB   ALA  77          3HB       ALA  77 -12.966  -0.890  -5.306
  621   2HB   ALA  77          2HB       ALA  77 -14.261  -1.286  -6.439
  622   3HB   ALA  77          1HB       ALA  77 -14.639  -0.504  -4.904
  623    H    GLN  78           H        GLN  78 -15.322  -4.496  -5.930
  624    HA   GLN  78           HA       GLN  78 -12.852  -5.454  -7.277
  625   1HB   GLN  78          2HB       GLN  78 -14.452  -7.678  -7.218
  626   2HB   GLN  78          1HB       GLN  78 -13.166  -7.359  -6.067
  627   1HG   GLN  78          2HG       GLN  78 -15.156  -5.985  -4.863
  628   2HG   GLN  78          1HG       GLN  78 -16.104  -7.213  -5.693
  629   1HE2  GLN  78          2HE2      GLN  78 -13.488  -8.341  -2.728
  630   2HE2  GLN  78          1HE2      GLN  78 -13.295  -6.834  -3.485
  631    H    PHE  79           H        PHE  79 -13.582  -6.906  -9.255
  632    HA   PHE  79           HA       PHE  79 -16.076  -5.893 -10.500
  633   1HB   PHE  79          2HB       PHE  79 -13.291  -5.463 -11.600
  634   2HB   PHE  79          1HB       PHE  79 -14.738  -5.368 -12.605
  635    HD1  PHE  79           HD1      PHE  79 -13.244  -4.026  -9.460
  636    HD2  PHE  79           HD2      PHE  79 -15.999  -3.381 -12.686
  637    HE1  PHE  79           HE1      PHE  79 -13.652  -1.729  -8.645
  638    HE2  PHE  79           HE2      PHE  79 -16.410  -1.071 -11.872
  639    HZ   PHE  79           HZ       PHE  79 -15.234  -0.245  -9.847
  640    H    GLU  80           H        GLU  80 -15.623  -6.921 -13.062
  641    HA   GLU  80           HA       GLU  80 -15.594  -9.800 -12.389
  642   1HB   GLU  80          2HB       GLU  80 -16.612 -10.050 -14.682
  643   2HB   GLU  80          1HB       GLU  80 -17.559  -9.059 -13.572
  644   1HG   GLU  80          2HG       GLU  80 -17.355  -7.242 -14.881
  645   2HG   GLU  80          1HG       GLU  80 -15.614  -7.457 -15.016
  646    H    THR  81           H        THR  81 -13.871  -7.445 -14.415
  647    HA   THR  81           HA       THR  81 -11.823  -9.563 -14.837
  648    HB   THR  81           HB       THR  81 -12.631  -9.742 -16.982
  649    HG1  THR  81           HG1      THR  81 -11.601  -7.332 -17.755
  650   1HG2  THR  81          1HG2      THR  81 -14.464  -8.012 -16.339
  651   2HG2  THR  81          3HG2      THR  81 -13.402  -6.858 -17.136
  652   3HG2  THR  81          2HG2      THR  81 -14.058  -8.222 -18.038
  653    H    LEU  82           H        LEU  82  -9.837  -8.399 -15.971
  654    HA   LEU  82           HA       LEU  82  -9.093  -6.244 -14.153
  655   1HB   LEU  82          2HB       LEU  82  -7.689  -7.908 -16.203
  656   2HB   LEU  82          1HB       LEU  82  -6.973  -6.357 -15.761
  657    HG   LEU  82           HG       LEU  82  -7.850  -8.402 -13.708
  658   1HD1  LEU  82          3HD1      LEU  82  -6.020  -9.199 -15.323
  659   2HD1  LEU  82          2HD1      LEU  82  -5.010  -7.931 -14.627
  660   3HD1  LEU  82          1HD1      LEU  82  -5.627  -9.231 -13.603
  661   1HD2  LEU  82          2HD2      LEU  82  -6.576  -5.731 -13.694
  662   2HD2  LEU  82          1HD2      LEU  82  -7.547  -6.523 -12.453
  663   3HD2  LEU  82          3HD2      LEU  82  -5.837  -6.921 -12.622
  664    H    GLN  83           H        GLN  83  -9.910  -6.620 -17.558
  665    HA   GLN  83           HA       GLN  83  -9.227  -3.901 -18.270
  666   1HB   GLN  83          2HB       GLN  83  -9.861  -6.152 -19.704
  667   2HB   GLN  83          1HB       GLN  83 -11.352  -5.220 -19.837
  668   1HG   GLN  83          2HG       GLN  83 -10.030  -3.256 -20.595
  669   2HG   GLN  83          1HG       GLN  83  -8.565  -4.236 -20.522
  670   1HE2  GLN  83          2HE2      GLN  83  -9.491  -4.607 -24.017
  671   2HE2  GLN  83          1HE2      GLN  83  -8.676  -3.536 -22.984
  672    H    GLN  84           H        GLN  84 -12.088  -5.546 -17.054
  673    HA   GLN  84           HA       GLN  84 -13.915  -3.358 -17.466
  674   1HB   GLN  84          2HB       GLN  84 -13.927  -5.843 -15.797
  675   2HB   GLN  84          1HB       GLN  84 -15.123  -4.595 -15.483
  676   1HG   GLN  84          2HG       GLN  84 -15.706  -6.478 -17.200
  677   2HG   GLN  84          1HG       GLN  84 -16.115  -4.818 -17.583
  678   1HE2  GLN  84          2HE2      GLN  84 -14.052  -6.717 -20.296
  679   2HE2  GLN  84          1HE2      GLN  84 -15.185  -7.373 -19.215
  680    H    LEU  85           H        LEU  85 -11.699  -4.256 -14.878
  681    HA   LEU  85           HA       LEU  85 -12.680  -2.139 -13.106
  682   1HB   LEU  85          2HB       LEU  85 -11.271  -3.022 -11.532
  683   2HB   LEU  85          1HB       LEU  85 -11.270  -4.405 -12.620
  684    HG   LEU  85           HG       LEU  85  -9.293  -2.821 -13.699
  685   1HD1  LEU  85          1HD1      LEU  85  -9.760  -1.755 -11.163
  686   2HD1  LEU  85          3HD1      LEU  85  -8.348  -2.792 -10.953
  687   3HD1  LEU  85          2HD1      LEU  85  -8.325  -1.501 -12.156
  688   1HD2  LEU  85          2HD2      LEU  85  -9.582  -5.329 -12.502
  689   2HD2  LEU  85          1HD2      LEU  85  -8.217  -4.748 -13.454
  690   3HD2  LEU  85          3HD2      LEU  85  -8.205  -4.575 -11.699
  691    H    VAL  86           H        VAL  86 -10.086  -2.459 -15.503
  692    HA   VAL  86           HA       VAL  86  -8.867   0.023 -14.787
  693    HB   VAL  86           HB       VAL  86  -7.677  -0.097 -16.837
  694   1HG1  VAL  86          1HG1      VAL  86  -8.128  -2.468 -15.308
  695   2HG1  VAL  86          3HG1      VAL  86  -7.945  -2.931 -17.000
  696   3HG1  VAL  86          2HG1      VAL  86  -6.680  -2.000 -16.197
  697   1HG2  VAL  86          2HG2      VAL  86 -10.232  -1.001 -17.852
  698   2HG2  VAL  86          1HG2      VAL  86  -8.859  -0.344 -18.736
  699   3HG2  VAL  86          3HG2      VAL  86  -8.944  -2.072 -18.397
  700    H    GLN  87           H        GLN  87 -11.734  -0.918 -16.355
  701    HA   GLN  87           HA       GLN  87 -12.293   1.499 -17.807
  702   1HB   GLN  87          2HB       GLN  87 -13.321  -0.757 -18.232
  703   2HB   GLN  87          1HB       GLN  87 -14.248  -0.543 -16.756
  704   1HG   GLN  87          2HG       GLN  87 -15.450   1.281 -17.617
  705   2HG   GLN  87          1HG       GLN  87 -14.286   1.556 -18.914
  706   1HE2  GLN  87          2HE2      GLN  87 -16.671  -1.775 -19.359
  707   2HE2  GLN  87          1HE2      GLN  87 -16.028  -1.419 -17.829
  708    H    HIS  88           H        HIS  88 -13.342   0.203 -14.683
  709    HA   HIS  88           HA       HIS  88 -14.998   2.472 -14.054
  710   1HB   HIS  88          2HB       HIS  88 -15.048   0.047 -13.094
  711   2HB   HIS  88          1HB       HIS  88 -13.804   0.637 -11.998
  712    HD1  HIS  88           HD1      HIS  88 -17.403   1.268 -12.985
  713    HD2  HIS  88           HD2      HIS  88 -14.742   2.331  -9.959
  714    HE1  HIS  88           HE1      HIS  88 -18.770   2.456 -11.214
  715    H    TYR  89           H        TYR  89 -11.767   1.420 -13.206
  716    HA   TYR  89           HA       TYR  89 -11.220   3.648 -11.480
  717   1HB   TYR  89          2HB       TYR  89  -9.459   1.608 -12.840
  718   2HB   TYR  89          1HB       TYR  89  -8.811   2.872 -11.803
  719    HD1  TYR  89           HD1      TYR  89 -11.602   0.365 -11.763
  720    HD2  TYR  89           HD2      TYR  89  -8.479   2.308  -9.558
  721    HE1  TYR  89           HE1      TYR  89 -12.134  -1.026  -9.814
  722    HE2  TYR  89           HE2      TYR  89  -9.015   0.908  -7.582
  723    HH   TYR  89           HH       TYR  89 -11.180  -1.797  -7.782
  724    H    SER  90           H        SER  90 -11.305   3.214 -14.872
  725    HA   SER  90           HA       SER  90  -9.357   5.148 -15.650
  726   1HB   SER  90          2HB       SER  90 -11.232   3.440 -16.947
  727   2HB   SER  90          1HB       SER  90 -11.503   5.079 -17.538
  728    HG   SER  90           HG       SER  90  -9.692   4.981 -18.567
  729    H    GLU  91           H        GLU  91 -12.860   5.334 -15.142
  730    HA   GLU  91           HA       GLU  91 -12.750   8.275 -15.463
  731   1HB   GLU  91          2HB       GLU  91 -15.193   6.638 -14.771
  732   2HB   GLU  91          1HB       GLU  91 -15.120   8.215 -15.557
  733   1HG   GLU  91          2HG       GLU  91 -13.634   6.744 -17.291
  734   2HG   GLU  91          1HG       GLU  91 -14.748   5.508 -16.707
  735    H    ARG  92           H        ARG  92 -12.264   6.063 -12.997
  736    HA   ARG  92           HA       ARG  92 -12.723   8.195 -10.988
  737   1HB   ARG  92          2HB       ARG  92 -13.854   5.437 -10.503
  738   2HB   ARG  92          1HB       ARG  92 -14.139   6.909  -9.575
  739   1HG   ARG  92          2HG       ARG  92 -15.178   7.888 -11.687
  740   2HG   ARG  92          1HG       ARG  92 -15.119   6.261 -12.365
  741   1HD   ARG  92          2HD       ARG  92 -16.436   5.444 -10.403
  742   2HD   ARG  92          1HD       ARG  92 -16.572   7.109  -9.840
  743    HE   ARG  92           HE       ARG  92 -17.781   6.089 -12.375
  744   1HH1  ARG  92          2HH1      ARG  92 -17.042   9.082 -11.430
  745   2HH1  ARG  92          1HH1      ARG  92 -18.653   9.652 -11.148
  746   1HH2  ARG  92          1HH2      ARG  92 -20.081   6.495 -11.304
  747   2HH2  ARG  92          2HH2      ARG  92 -20.373   8.186 -11.076
  748    H    ALA  93           H        ALA  93 -11.682   7.649  -8.889
  749    HA   ALA  93           HA       ALA  93  -9.170   6.221  -9.343
  750   1HB   ALA  93          2HB       ALA  93  -9.516   8.364  -7.925
  751   2HB   ALA  93          1HB       ALA  93 -10.110   7.269  -6.677
  752   3HB   ALA  93          3HB       ALA  93  -8.457   7.112  -7.273
  753    H    ALA  94           H        ALA  94 -11.933   5.872  -7.141
  754    HA   ALA  94           HA       ALA  94 -12.983   3.802  -6.551
  755   1HB   ALA  94          1HB       ALA  94 -11.306   2.766  -8.355
  756   2HB   ALA  94          3HB       ALA  94 -10.460   2.244  -6.900
  757   3HB   ALA  94          2HB       ALA  94 -12.130   1.750  -7.172
  758    H    GLY  95           H        GLY  95 -10.117   5.275  -5.466
  759   1HA   GLY  95          2HA       GLY  95 -10.419   5.461  -2.858
  760   2HA   GLY  95          1HA       GLY  95 -10.161   3.722  -2.932
  761    H    LEU  96           H        LEU  96  -8.218   4.225  -5.260
  762    HA   LEU  96           HA       LEU  96  -5.871   4.475  -3.561
  763   1HB   LEU  96          2HB       LEU  96  -4.605   3.833  -5.446
  764   2HB   LEU  96          1HB       LEU  96  -6.112   2.934  -5.593
  765    HG   LEU  96           HG       LEU  96  -5.380   5.484  -7.053
  766   1HD1  LEU  96          3HD1      LEU  96  -5.360   2.584  -7.670
  767   2HD1  LEU  96          2HD1      LEU  96  -6.000   3.639  -8.932
  768   3HD1  LEU  96          1HD1      LEU  96  -4.359   3.880  -8.330
  769   1HD2  LEU  96          1HD2      LEU  96  -7.920   3.851  -7.052
  770   2HD2  LEU  96          3HD2      LEU  96  -7.748   5.536  -6.566
  771   3HD2  LEU  96          2HD2      LEU  96  -7.544   5.081  -8.257
  772    H    SER  97           H        SER  97  -4.029   5.914  -4.364
  773    HA   SER  97           HA       SER  97  -4.461   8.565  -3.889
  774   1HB   SER  97          2HB       SER  97  -2.209   7.973  -4.130
  775   2HB   SER  97          1HB       SER  97  -2.480   7.215  -5.701
  776    HG   SER  97           HG       SER  97  -2.628   9.985  -5.113
  777    H    SER  98           H        SER  98  -4.587   7.129  -7.154
  778    HA   SER  98           HA       SER  98  -6.578   9.171  -7.903
  779   1HB   SER  98          2HB       SER  98  -3.930   9.752  -8.383
  780   2HB   SER  98          1HB       SER  98  -4.431   9.015  -9.905
  781    HG   SER  98           HG       SER  98  -5.532  10.733 -10.325
  782    H    ARG  99           H        ARG  99  -7.065   8.812 -10.394
  783    HA   ARG  99           HA       ARG  99  -7.880   6.037 -10.636
  784   1HB   ARG  99          2HB       ARG  99  -8.595   6.887 -12.991
  785   2HB   ARG  99          1HB       ARG  99  -9.424   7.532 -11.576
  786   1HG   ARG  99          2HG       ARG  99  -8.195   9.566 -11.660
  787   2HG   ARG  99          1HG       ARG  99  -6.997   8.888 -12.762
  788   1HD   ARG  99          2HD       ARG  99  -8.505   8.909 -14.589
  789   2HD   ARG  99          1HD       ARG  99  -9.908   9.097 -13.536
  790    HE   ARG  99           HE       ARG  99  -7.888  11.287 -13.764
  791   1HH1  ARG  99          2HH1      ARG  99 -10.621  10.373 -15.368
  792   2HH1  ARG  99          1HH1      ARG  99 -11.574  11.760 -14.956
  793   1HH2  ARG  99          1HH2      ARG  99  -9.313  12.944 -12.608
  794   2HH2  ARG  99          2HH2      ARG  99 -10.834  13.215 -13.393
  795    H    LEU 100           H        LEU 100  -7.333   4.640 -12.417
  796    HA   LEU 100           HA       LEU 100  -4.607   4.190 -12.816
  797   1HB   LEU 100          2HB       LEU 100  -5.379   2.914 -14.916
  798   2HB   LEU 100          1HB       LEU 100  -6.074   2.417 -13.375
  799    HG   LEU 100           HG       LEU 100  -7.928   4.205 -13.995
  800   1HD1  LEU 100          1HD1      LEU 100  -6.334   3.930 -16.431
  801   2HD1  LEU 100          3HD1      LEU 100  -8.052   3.617 -16.682
  802   3HD1  LEU 100          2HD1      LEU 100  -7.527   5.156 -15.997
  803   1HD2  LEU 100          3HD2      LEU 100  -7.862   1.524 -13.945
  804   2HD2  LEU 100          2HD2      LEU 100  -9.271   2.416 -14.518
  805   3HD2  LEU 100          1HD2      LEU 100  -8.114   1.757 -15.674
  806    H    VAL 101           H        VAL 101  -3.924   4.039 -15.475
  807    HA   VAL 101           HA       VAL 101  -2.925   6.538 -16.123
  808    HB   VAL 101           HB       VAL 101  -2.975   5.708 -18.531
  809   1HG1  VAL 101          1HG1      VAL 101  -1.357   5.069 -16.452
  810   2HG1  VAL 101          3HG1      VAL 101  -1.931   3.462 -16.903
  811   3HG1  VAL 101          2HG1      VAL 101  -1.104   4.470 -18.092
  812   1HG2  VAL 101          1HG2      VAL 101  -4.642   3.651 -17.157
  813   2HG2  VAL 101          3HG2      VAL 101  -4.784   4.298 -18.790
  814   3HG2  VAL 101          2HG2      VAL 101  -3.540   3.104 -18.420
  815    H    VAL 102           H        VAL 102  -4.040   8.395 -16.256
  816    HA   VAL 102           HA       VAL 102  -6.834   8.459 -17.084
  817    HB   VAL 102           HB       VAL 102  -5.222  10.963 -16.895
  818   1HG1  VAL 102          2HG1      VAL 102  -7.946  10.000 -16.007
  819   2HG1  VAL 102          1HG1      VAL 102  -7.290  11.561 -15.518
  820   3HG1  VAL 102          3HG1      VAL 102  -7.572  11.220 -17.225
  821   1HG2  VAL 102          2HG2      VAL 102  -5.739   9.044 -14.619
  822   2HG2  VAL 102          1HG2      VAL 102  -4.221   9.826 -15.061
  823   3HG2  VAL 102          3HG2      VAL 102  -5.527  10.774 -14.346
  824    HA   PRO 103           HA       PRO 103  -4.942  10.619 -20.901
  825   1HB   PRO 103          2HB       PRO 103  -2.211  10.513 -21.197
  826   2HB   PRO 103          1HB       PRO 103  -3.056  11.826 -20.362
  827   1HG   PRO 103          2HG       PRO 103  -1.447   9.590 -19.217
  828   2HG   PRO 103          1HG       PRO 103  -1.780  11.190 -18.538
  829   1HD   PRO 103          2HD       PRO 103  -3.049   8.749 -17.818
  830   2HD   PRO 103          1HD       PRO 103  -3.557  10.379 -17.336
  831    H    SER 104           H        SER 104  -2.967   9.702 -22.713
  832    HA   SER 104           HA       SER 104  -3.022   6.755 -22.682
  833   1HB   SER 104          2HB       SER 104  -4.080   6.711 -24.983
  834   2HB   SER 104          1HB       SER 104  -5.177   7.173 -23.682
  835    HG   SER 104           HG       SER 104  -5.375   8.604 -25.411
  836    H    HIS 105           H        HIS 105  -0.685   7.388 -22.560
  837    HA   HIS 105           HA       HIS 105   0.592   8.757 -24.748
  838   1HB   HIS 105          2HB       HIS 105   2.666   8.004 -23.779
  839   2HB   HIS 105          1HB       HIS 105   1.579   8.390 -22.446
  840    HD1  HIS 105           HD1      HIS 105   3.702   6.470 -21.680
  841    HD2  HIS 105           HD2      HIS 105   0.171   5.169 -23.474
  842    HE1  HIS 105           HE1      HIS 105   3.453   4.022 -21.081
  843    H    LYS 106           HN       LYS 106   2.697   6.739 -25.212
  844    HA   LYS 106           HA       LYS 106   1.960   5.639 -27.622
  845   1HB   LYS 106          2HB       LYS 106   4.172   5.424 -26.033
  846   2HB   LYS 106          1HB       LYS 106   3.546   3.776 -25.967
  847   1HG   LYS 106          2HG       LYS 106   3.671   5.142 -28.628
  848   2HG   LYS 106          1HG       LYS 106   5.173   4.539 -27.928
  849   1HD   LYS 106          2HD       LYS 106   4.398   2.307 -27.896
  850   2HD   LYS 106          1HD       LYS 106   2.712   2.797 -28.071
  851   1HE   LYS 106          2HE       LYS 106   2.988   2.378 -30.280
  852   2HE   LYS 106          1HE       LYS 106   3.911   3.880 -30.323
  853   1HZ   LYS 106          3HZ       LYS 106   5.389   1.576 -29.401
  854   2HZ   LYS 106          2HZ       LYS 106   4.884   1.482 -31.020
  855   3HZ   LYS 106          1HZ       LYS 106   5.840   2.786 -30.500
  856   1H    GLU 201          2HT       GLU 201   1.514  -4.780   6.979
  857   2H    GLU 201          1HT       GLU 201   1.786  -6.452   7.112
  858   3H    GLU 201          3HT       GLU 201   2.109  -5.435   8.429
  859    HA   GLU 201           HA       GLU 201   4.154  -5.018   7.727
  860   1HB   GLU 201          2HB       GLU 201   3.476  -6.890   5.439
  861   2HB   GLU 201          1HB       GLU 201   5.086  -6.531   6.065
  862   1HG   GLU 201          2HG       GLU 201   4.852  -7.966   7.805
  863   2HG   GLU 201          1HG       GLU 201   3.201  -7.435   8.131
  864    HA   PRO 202           HA       PRO 202   4.079  -1.873   4.666
  865   1HB   PRO 202          2HB       PRO 202   6.777  -1.649   4.189
  866   2HB   PRO 202          1HB       PRO 202   5.989  -1.044   5.656
  867   1HG   PRO 202          2HG       PRO 202   7.702  -3.461   5.307
  868   2HG   PRO 202          1HG       PRO 202   7.425  -2.482   6.758
  869   1HD   PRO 202          2HD       PRO 202   6.231  -4.987   6.197
  870   2HD   PRO 202          1HD       PRO 202   5.723  -3.847   7.463
  871    H    GLN 203           H        GLN 203   3.048  -3.222   2.975
  872    HA   GLN 203           HA       GLN 203   4.852  -3.646   0.691
  873   1HB   GLN 203          2HB       GLN 203   4.499  -5.816   2.261
  874   2HB   GLN 203          1HB       GLN 203   3.072  -5.967   1.234
  875   1HG   GLN 203          2HG       GLN 203   4.648  -7.107  -0.041
  876   2HG   GLN 203          1HG       GLN 203   4.796  -5.481  -0.707
  877   1HE2  GLN 203          2HE2      GLN 203   8.256  -5.686  -0.024
  878   2HE2  GLN 203          1HE2      GLN 203   7.048  -5.497  -1.202
  879   1HN   PTR 204          1HN       PTR 204   3.769  -2.553  -0.873
  880    HA   PTR 204           HA       PTR 204   2.010  -1.831  -2.247
  881   1HB   PTR 204          1HB       PTR 204   0.005  -3.421  -2.334
  882    HD1  PTR 204           HD1      PTR 204   1.622  -2.552  -4.343
  883    HD2  PTR 204           HD2      PTR 204   2.122  -6.156  -2.073
  884    HE1  PTR 204           HE1      PTR 204   2.973  -3.525  -6.187
  885    HE2  PTR 204           HE2      PTR 204   3.482  -7.129  -3.906
  886    H    GLU 205           H        GLU 205   0.904  -0.032  -1.661
  887    HA   GLU 205           HA       GLU 205  -0.318   0.167   0.994
  888   1HB   GLU 205          2HB       GLU 205  -0.264   2.093  -1.351
  889   2HB   GLU 205          1HB       GLU 205  -0.920   2.470   0.243
  890   1HG   GLU 205          2HG       GLU 205   1.856   1.370   0.101
  891   2HG   GLU 205          1HG       GLU 205   1.607   3.050  -0.379
  892    H    GLU 206           H        GLU 206  -2.271  -0.797   1.295
  893    HA   GLU 206           HA       GLU 206  -4.122  -1.166  -0.956
  894   1HB   GLU 206          2HB       GLU 206  -4.647  -1.768   1.963
  895   2HB   GLU 206          1HB       GLU 206  -5.426  -2.488   0.554
  896   1HG   GLU 206          2HG       GLU 206  -2.931  -3.165  -0.056
  897   2HG   GLU 206          1HG       GLU 206  -2.705  -3.006   1.686
  898    H    ILE 207           H        ILE 207  -5.861   0.131  -1.383
  899    HA   ILE 207           HA       ILE 207  -6.158   2.714  -0.438
  900    HB   ILE 207           HB       ILE 207  -8.173   0.741  -1.505
  901   1HG1  ILE 207          2HG1      ILE 207  -8.170   2.482  -3.362
  902   2HG1  ILE 207          1HG1      ILE 207  -6.835   3.264  -2.516
  903   1HG2  ILE 207          3HG2      ILE 207  -9.333   2.288   0.100
  904   2HG2  ILE 207          2HG2      ILE 207  -8.742   3.649  -0.852
  905   3HG2  ILE 207          1HG2      ILE 207  -9.861   2.490  -1.569
  906   1HD1  ILE 207          3HD1      ILE 207  -6.692   0.326  -3.147
  907   2HD1  ILE 207          2HD1      ILE 207  -6.297   1.513  -4.390
  908   3HD1  ILE 207          1HD1      ILE 207  -5.375   1.470  -2.887
  909    HA   PRO 208           HA       PRO 208  -7.477   2.052   3.751
  910   1HB   PRO 208          2HB       PRO 208  -7.878   4.704   4.348
  911   2HB   PRO 208          1HB       PRO 208  -6.277   3.948   4.281
  912   1HG   PRO 208          2HG       PRO 208  -7.559   5.801   2.330
  913   2HG   PRO 208          1HG       PRO 208  -5.839   5.518   2.645
  914   1HD   PRO 208          2HD       PRO 208  -7.326   4.473   0.471
  915   2HD   PRO 208          1HD       PRO 208  -5.702   3.959   0.971
  916    H    ILE 209           H        ILE 209  -9.383   3.420   5.099
  917    HA   ILE 209           HA       ILE 209 -11.730   4.139   3.622
  918    HB   ILE 209           HB       ILE 209 -11.645   1.682   3.093
  919   1HG1  ILE 209          2HG1      ILE 209 -14.010   1.987   4.875
  920   2HG1  ILE 209          1HG1      ILE 209 -13.789   3.236   3.649
  921   1HG2  ILE 209          2HG2      ILE 209 -12.072   1.449   6.088
  922   2HG2  ILE 209          1HG2      ILE 209 -12.185   0.116   4.939
  923   3HG2  ILE 209          3HG2      ILE 209 -10.640   0.924   5.203
  924   1HD1  ILE 209          1HD1      ILE 209 -13.339   0.542   2.599
  925   2HD1  ILE 209          3HD1      ILE 209 -14.970   0.759   3.233
  926   3HD1  ILE 209          2HD1      ILE 209 -14.365   1.832   1.972
  927    H    TYR 210           H        TYR 210 -10.349   2.819   6.583
  928    HA   TYR 210           HA       TYR 210 -12.428   3.412   8.395
  929   1HB   TYR 210          2HB       TYR 210 -10.394   3.833  10.000
  930   2HB   TYR 210          1HB       TYR 210 -10.651   2.219   9.341
  931    HD1  TYR 210           HD1      TYR 210  -9.017   5.441   8.300
  932    HD2  TYR 210           HD2      TYR 210  -8.782   1.156   8.461
  933    HE1  TYR 210           HE1      TYR 210  -6.780   5.524   7.233
  934    HE2  TYR 210           HE2      TYR 210  -6.545   1.238   7.394
  935    HH   TYR 210           HH       TYR 210  -4.929   4.323   6.750
  936    H    LEU 211           HN       LEU 211 -11.735   5.268  10.213
  937    HA   LEU 211           HA       LEU 211 -12.198   7.777   8.771
  938   1HB   LEU 211          2HB       LEU 211 -13.332   7.184  10.946
  939   2HB   LEU 211          1HB       LEU 211 -11.769   7.364  11.743
  940    HG   LEU 211           HG       LEU 211 -12.225   9.657  10.077
  941   1HD1  LEU 211          3HD1      LEU 211 -14.497   8.830  11.889
  942   2HD1  LEU 211          2HD1      LEU 211 -14.204  10.520  11.477
  943   3HD1  LEU 211          1HD1      LEU 211 -14.580   9.354  10.207
  944   1HD2  LEU 211          1HD2      LEU 211 -11.620   8.968  12.888
  945   2HD2  LEU 211          3HD2      LEU 211 -10.878  10.178  11.842
  946   3HD2  LEU 211          2HD2      LEU 211 -12.402  10.531  12.657
   
  No H/Q in entry =         946
  Start of MODEL    3
    1   1H    SER   1          1HT       SER   1  -7.321 -10.956 -22.437
    2   2H    SER   1          3HT       SER   1  -7.851 -11.168 -24.034
    3   3H    SER   1          2HT       SER   1  -6.440 -11.948 -23.498
    4    HA   SER   1           HA       SER   1  -5.203 -10.000 -23.452
    5   1HB   SER   1          2HB       SER   1  -7.110 -10.117 -25.782
    6   2HB   SER   1          1HB       SER   1  -5.879  -8.858 -25.691
    7    HG   SER   1           HG       SER   1  -5.600 -11.624 -25.973
    8    H    ILE   2           H        ILE   2  -5.522  -8.477 -21.846
    9    HA   ILE   2           HA       ILE   2  -7.953  -6.801 -21.897
   10    HB   ILE   2           HB       ILE   2  -7.106  -5.887 -19.782
   11   1HG1  ILE   2          2HG1      ILE   2  -4.662  -7.545 -20.468
   12   2HG1  ILE   2          1HG1      ILE   2  -4.734  -5.799 -20.233
   13   1HG2  ILE   2          1HG2      ILE   2  -8.009  -8.434 -20.198
   14   2HG2  ILE   2          3HG2      ILE   2  -6.489  -8.747 -19.361
   15   3HG2  ILE   2          2HG2      ILE   2  -7.721  -7.737 -18.603
   16   1HD1  ILE   2          2HD1      ILE   2  -5.831  -7.117 -17.918
   17   2HD1  ILE   2          1HD1      ILE   2  -4.239  -7.788 -18.269
   18   3HD1  ILE   2          3HD1      ILE   2  -4.430  -6.053 -18.016
   19    H    GLN   3           H        GLN   3  -7.425  -4.340 -21.412
   20    HA   GLN   3           HA       GLN   3  -6.451  -3.096 -23.673
   21   1HB   GLN   3          2HB       GLN   3  -7.427  -2.154 -21.358
   22   2HB   GLN   3          1HB       GLN   3  -5.719  -1.779 -21.105
   23   1HG   GLN   3          2HG       GLN   3  -5.801  -0.078 -22.585
   24   2HG   GLN   3          1HG       GLN   3  -6.571  -1.094 -23.803
   25   1HE2  GLN   3          2HE2      GLN   3  -9.882  -0.049 -22.962
   26   2HE2  GLN   3          1HE2      GLN   3  -8.969  -1.255 -23.734
   27    H    ALA   4           H        ALA   4  -4.516  -3.525 -20.722
   28    HA   ALA   4           HA       ALA   4  -2.179  -3.428 -20.451
   29   1HB   ALA   4          3HB       ALA   4  -2.683  -5.739 -21.353
   30   2HB   ALA   4          2HB       ALA   4  -2.241  -5.130 -22.948
   31   3HB   ALA   4          1HB       ALA   4  -1.043  -5.163 -21.655
   32    H    GLU   5           H        GLU   5  -1.978  -1.183 -21.013
   33    HA   GLU   5           HA       GLU   5  -0.203  -0.728 -23.269
   34   1HB   GLU   5          2HB       GLU   5  -3.050   0.275 -23.337
   35   2HB   GLU   5          1HB       GLU   5  -1.762   1.116 -24.197
   36   1HG   GLU   5          2HG       GLU   5  -1.196  -1.231 -25.173
   37   2HG   GLU   5          1HG       GLU   5  -2.818  -1.670 -24.641
   38    H    GLU   6           H        GLU   6  -2.253   0.648 -20.723
   39    HA   GLU   6           HA       GLU   6  -0.035   2.543 -20.119
   40   1HB   GLU   6          2HB       GLU   6  -2.891   3.430 -19.831
   41   2HB   GLU   6          1HB       GLU   6  -1.436   4.410 -20.014
   42   1HG   GLU   6          2HG       GLU   6  -2.497   2.591 -22.192
   43   2HG   GLU   6          1HG       GLU   6  -2.909   4.301 -22.077
   44    H    TRP   7           H        TRP   7  -2.923   0.834 -18.988
   45    HA   TRP   7           HA       TRP   7  -2.076   1.372 -16.188
   46   1HB   TRP   7          2HB       TRP   7  -4.331   0.492 -15.579
   47   2HB   TRP   7          1HB       TRP   7  -4.410   1.900 -16.637
   48    HD1  TRP   7           HD1      TRP   7  -5.477   1.611 -18.978
   49    HE1  TRP   7           HE1      TRP   7  -6.631  -0.351 -20.187
   50    HE3  TRP   7           HE3      TRP   7  -4.266  -2.207 -15.816
   51    HZ2  TRP   7           HZ2      TRP   7  -6.987  -3.173 -19.860
   52    HZ3  TRP   7           HZ3      TRP   7  -5.023  -4.520 -16.288
   53    HH2  TRP   7           HH2      TRP   7  -6.380  -5.007 -18.303
   54    H    TYR   8           H        TYR   8  -1.477  -0.879 -18.490
   55    HA   TYR   8           HA       TYR   8  -0.741  -2.899 -16.503
   56   1HB   TYR   8          2HB       TYR   8  -2.923  -3.672 -16.767
   57   2HB   TYR   8          1HB       TYR   8  -2.964  -3.316 -18.491
   58    HD1  TYR   8           HD1      TYR   8  -0.987  -4.690 -19.847
   59    HD2  TYR   8           HD2      TYR   8  -2.826  -5.857 -16.145
   60    HE1  TYR   8           HE1      TYR   8  -0.383  -7.049 -20.289
   61    HE2  TYR   8           HE2      TYR   8  -2.236  -8.214 -16.600
   62    HH   TYR   8           HH       TYR   8  -0.967  -9.238 -19.671
   63    H    PHE   9           H        PHE   9   1.183  -3.665 -17.093
   64    HA   PHE   9           HA       PHE   9   2.070  -3.231 -19.897
   65   1HB   PHE   9          2HB       PHE   9   3.474  -3.540 -17.256
   66   2HB   PHE   9          1HB       PHE   9   4.350  -3.850 -18.753
   67    HD1  PHE   9           HD1      PHE   9   1.589  -1.394 -18.466
   68    HD2  PHE   9           HD2      PHE   9   5.853  -1.939 -18.589
   69    HE1  PHE   9           HE1      PHE   9   1.894   1.043 -18.787
   70    HE2  PHE   9           HE2      PHE   9   6.151   0.499 -18.909
   71    HZ   PHE   9           HZ       PHE   9   4.174   1.991 -19.008
   72    H    GLY  10           H        GLY  10   1.625  -5.748 -17.468
   73   1HA   GLY  10          2HA       GLY  10   1.013  -7.934 -18.831
   74   2HA   GLY  10          1HA       GLY  10   2.687  -7.780 -19.355
   75    H    LYS  11           H        LYS  11   3.983  -9.087 -18.213
   76    HA   LYS  11           HA       LYS  11   3.289  -9.688 -15.377
   77   1HB   LYS  11          2HB       LYS  11   5.414 -11.151 -16.918
   78   2HB   LYS  11          1HB       LYS  11   4.365 -11.745 -15.629
   79   1HG   LYS  11          2HG       LYS  11   2.592 -10.963 -17.640
   80   2HG   LYS  11          1HG       LYS  11   3.920 -11.729 -18.513
   81   1HD   LYS  11          2HD       LYS  11   3.573 -13.444 -16.387
   82   2HD   LYS  11          1HD       LYS  11   1.919 -12.929 -16.717
   83   1HE   LYS  11          2HE       LYS  11   2.105 -14.705 -18.201
   84   2HE   LYS  11          1HE       LYS  11   2.635 -13.376 -19.232
   85   1HZ   LYS  11          1HZ       LYS  11   4.809 -14.364 -17.722
   86   2HZ   LYS  11          3HZ       LYS  11   4.064 -15.645 -18.548
   87   3HZ   LYS  11          2HZ       LYS  11   4.625 -14.292 -19.411
   88    H    LEU  12           H        LEU  12   4.164  -7.376 -15.159
   89    HA   LEU  12           HA       LEU  12   7.136  -7.302 -15.141
   90   1HB   LEU  12          2HB       LEU  12   5.763  -5.501 -16.284
   91   2HB   LEU  12          1HB       LEU  12   5.200  -5.025 -14.685
   92    HG   LEU  12           HG       LEU  12   7.544  -4.679 -13.979
   93   1HD1  LEU  12          2HD1      LEU  12   8.078  -6.200 -16.302
   94   2HD1  LEU  12          1HD1      LEU  12   8.709  -4.584 -16.622
   95   3HD1  LEU  12          3HD1      LEU  12   9.258  -5.477 -15.203
   96   1HD2  LEU  12          2HD2      LEU  12   6.126  -3.183 -16.052
   97   2HD2  LEU  12          1HD2      LEU  12   6.928  -2.601 -14.592
   98   3HD2  LEU  12          3HD2      LEU  12   7.865  -2.887 -16.059
   99    H    GLY  13           H        GLY  13   8.148  -6.194 -13.221
  100   1HA   GLY  13          2HA       GLY  13   6.708  -6.997 -10.728
  101   2HA   GLY  13          1HA       GLY  13   8.464  -6.966 -10.892
  102    H    ARG  14           H        ARG  14   8.412  -5.549  -8.968
  103    HA   ARG  14           HA       ARG  14   7.281  -2.847  -9.352
  104   1HB   ARG  14          2HB       ARG  14   8.311  -2.514  -7.026
  105   2HB   ARG  14          1HB       ARG  14   6.998  -3.684  -7.147
  106   1HG   ARG  14          2HG       ARG  14   8.352  -5.391  -6.545
  107   2HG   ARG  14          1HG       ARG  14   9.596  -4.896  -7.692
  108   1HD   ARG  14          2HD       ARG  14  10.796  -3.845  -6.089
  109   2HD   ARG  14          1HD       ARG  14   9.363  -3.058  -5.427
  110    HE   ARG  14           HE       ARG  14   9.063  -5.632  -4.544
  111   1HH1  ARG  14          2HH1      ARG  14  10.485  -2.970  -3.339
  112   2HH1  ARG  14          1HH1      ARG  14  11.726  -3.765  -2.429
  113   1HH2  ARG  14          1HH2      ARG  14  11.186  -6.862  -3.892
  114   2HH2  ARG  14          2HH2      ARG  14  12.122  -5.969  -2.742
  115    H    LYS  15           H        LYS  15  10.324  -4.473  -9.654
  116    HA   LYS  15           HA       LYS  15  12.004  -2.179  -9.329
  117   1HB   LYS  15          2HB       LYS  15  12.510  -4.827  -9.442
  118   2HB   LYS  15          1HB       LYS  15  12.892  -4.384 -11.106
  119   1HG   LYS  15          2HG       LYS  15  14.838  -3.459 -10.455
  120   2HG   LYS  15          1HG       LYS  15  13.997  -2.422  -9.304
  121   1HD   LYS  15          2HD       LYS  15  15.025  -3.629  -7.689
  122   2HD   LYS  15          1HD       LYS  15  13.902  -4.925  -8.102
  123   1HE   LYS  15          2HE       LYS  15  15.535  -6.165  -9.059
  124   2HE   LYS  15          1HE       LYS  15  16.171  -4.779  -9.945
  125   1HZ   LYS  15          3HZ       LYS  15  16.668  -4.544  -7.155
  126   2HZ   LYS  15          2HZ       LYS  15  17.307  -5.996  -7.763
  127   3HZ   LYS  15          1HZ       LYS  15  17.765  -4.510  -8.447
  128    H    ASP  16           H        ASP  16  10.519  -3.804 -12.103
  129    HA   ASP  16           HA       ASP  16  11.670  -1.953 -13.974
  130   1HB   ASP  16          2HB       ASP  16  10.845  -4.377 -14.391
  131   2HB   ASP  16          1HB       ASP  16   9.255  -3.634 -14.495
  132    H    ALA  17           H        ALA  17   8.495  -2.486 -12.523
  133    HA   ALA  17           HA       ALA  17   6.960  -0.551 -13.749
  134   1HB   ALA  17          2HB       ALA  17   6.543  -2.105 -11.613
  135   2HB   ALA  17          1HB       ALA  17   6.836  -0.579 -10.775
  136   3HB   ALA  17          3HB       ALA  17   5.531  -0.702 -11.955
  137    H    GLU  18           H        GLU  18   9.274  -0.008 -11.106
  138    HA   GLU  18           HA       GLU  18   8.868   2.851 -11.054
  139   1HB   GLU  18          2HB       GLU  18  11.038   2.877  -9.800
  140   2HB   GLU  18          1HB       GLU  18   9.875   1.729  -9.135
  141   1HG   GLU  18          2HG       GLU  18  10.974  -0.121 -10.247
  142   2HG   GLU  18          1HG       GLU  18  12.043   0.980 -11.117
  143    H    ARG  19           H        ARG  19  11.129   0.694 -12.741
  144    HA   ARG  19           HA       ARG  19  12.757   2.748 -13.892
  145   1HB   ARG  19          2HB       ARG  19  12.735  -0.022 -13.927
  146   2HB   ARG  19          1HB       ARG  19  12.370   0.402 -15.600
  147   1HG   ARG  19          2HG       ARG  19  14.573   0.789 -15.894
  148   2HG   ARG  19          1HG       ARG  19  14.406   2.177 -14.820
  149   1HD   ARG  19          2HD       ARG  19  14.524  -0.260 -13.271
  150   2HD   ARG  19          1HD       ARG  19  15.912  -0.167 -14.356
  151    HE   ARG  19           HE       ARG  19  15.211   2.087 -12.517
  152   1HH1  ARG  19          2HH1      ARG  19  17.483   1.076 -14.717
  153   2HH1  ARG  19          1HH1      ARG  19  18.852   1.227 -13.666
  154   1HH2  ARG  19          1HH2      ARG  19  16.943   1.764 -10.821
  155   2HH2  ARG  19          2HH2      ARG  19  18.546   1.616 -11.461
  156    H    GLN  20           H        GLN  20  10.516   0.736 -15.788
  157    HA   GLN  20           HA       GLN  20  10.247   2.261 -18.039
  158   1HB   GLN  20          2HB       GLN  20   8.092   0.767 -16.530
  159   2HB   GLN  20          1HB       GLN  20   7.824   1.466 -18.126
  160   1HG   GLN  20          2HG       GLN  20  10.299  -0.108 -17.937
  161   2HG   GLN  20          1HG       GLN  20   8.839  -1.056 -17.655
  162   1HE2  GLN  20          2HE2      GLN  20   9.737   0.097 -21.404
  163   2HE2  GLN  20          1HE2      GLN  20  10.813   0.284 -20.105
  164    H    LEU  21           H        LEU  21   8.144   2.733 -15.162
  165    HA   LEU  21           HA       LEU  21   6.733   4.971 -16.081
  166   1HB   LEU  21          2HB       LEU  21   7.108   3.670 -13.599
  167   2HB   LEU  21          1HB       LEU  21   7.435   5.379 -13.317
  168    HG   LEU  21           HG       LEU  21   5.286   6.013 -14.189
  169   1HD1  LEU  21          3HD1      LEU  21   5.428   3.316 -15.384
  170   2HD1  LEU  21          2HD1      LEU  21   3.835   3.766 -14.775
  171   3HD1  LEU  21          1HD1      LEU  21   4.633   4.772 -15.984
  172   1HD2  LEU  21          2HD2      LEU  21   5.152   3.588 -12.381
  173   2HD2  LEU  21          1HD2      LEU  21   5.132   5.286 -11.907
  174   3HD2  LEU  21          3HD2      LEU  21   3.746   4.589 -12.745
  175    H    LEU  22           H        LEU  22   9.519   5.256 -13.871
  176    HA   LEU  22           HA       LEU  22   9.961   7.995 -14.184
  177   1HB   LEU  22          2HB       LEU  22  12.043   5.816 -13.839
  178   2HB   LEU  22          1HB       LEU  22  12.326   7.535 -13.566
  179    HG   LEU  22           HG       LEU  22  10.506   5.675 -12.028
  180   1HD1  LEU  22          3HD1      LEU  22  12.888   7.419 -11.412
  181   2HD1  LEU  22          2HD1      LEU  22  11.796   6.884 -10.135
  182   3HD1  LEU  22          1HD1      LEU  22  12.677   5.697 -11.097
  183   1HD2  LEU  22          3HD2      LEU  22  10.527   8.703 -12.103
  184   2HD2  LEU  22          2HD2      LEU  22   9.161   7.631 -12.415
  185   3HD2  LEU  22          1HD2      LEU  22   9.816   7.775 -10.783
  186    H    SER  23           H        SER  23  10.518   5.481 -16.503
  187    HA   SER  23           HA       SER  23  12.521   6.779 -18.090
  188   1HB   SER  23          2HB       SER  23  11.050   4.380 -18.210
  189   2HB   SER  23          1HB       SER  23  10.656   5.247 -19.695
  190    HG   SER  23           HG       SER  23  13.283   4.826 -18.718
  191    H    PHE  24           H        PHE  24  12.262   8.078 -19.979
  192    HA   PHE  24           HA       PHE  24  10.461  10.178 -19.929
  193   1HB   PHE  24          2HB       PHE  24  12.120   8.914 -22.011
  194   2HB   PHE  24          1HB       PHE  24  10.736   9.807 -22.640
  195    HD1  PHE  24           HD1      PHE  24  10.368  12.208 -21.808
  196    HD2  PHE  24           HD2      PHE  24  14.036  10.051 -21.226
  197    HE1  PHE  24           HE1      PHE  24  11.558  14.344 -21.394
  198    HE2  PHE  24           HE2      PHE  24  15.227  12.186 -20.811
  199    HZ   PHE  24           HZ       PHE  24  13.987  14.332 -20.894
  200    H    GLY  25           H        GLY  25   8.326   9.615 -19.422
  201   1HA   GLY  25          2HA       GLY  25   6.755   8.521 -21.666
  202   2HA   GLY  25          1HA       GLY  25   6.673   7.616 -20.157
  203    H    ASN  26           H        ASN  26   5.946   8.846 -18.227
  204    HA   ASN  26           HA       ASN  26   4.426  11.322 -18.817
  205   1HB   ASN  26          2HB       ASN  26   3.203   8.790 -17.683
  206   2HB   ASN  26          1HB       ASN  26   2.408  10.364 -17.672
  207   1HD2  ASN  26          1HD2      ASN  26   1.667  11.233 -19.732
  208   2HD2  ASN  26          2HD2      ASN  26   1.595  10.274 -21.130
  209    HA   PRO  27           HA       PRO  27   5.774  12.335 -14.763
  210   1HB   PRO  27          2HB       PRO  27   3.909  14.265 -14.169
  211   2HB   PRO  27          1HB       PRO  27   5.264  14.521 -15.278
  212   1HG   PRO  27          2HG       PRO  27   2.370  14.113 -15.895
  213   2HG   PRO  27          1HG       PRO  27   3.602  14.975 -16.829
  214   1HD   PRO  27          2HD       PRO  27   2.628  12.367 -17.362
  215   2HD   PRO  27          1HD       PRO  27   4.075  13.105 -18.076
  216    H    ARG  28           H        ARG  28   4.389  13.017 -12.529
  217    HA   ARG  28           HA       ARG  28   3.487  10.663 -11.377
  218   1HB   ARG  28          2HB       ARG  28   2.337  12.035  -9.705
  219   2HB   ARG  28          1HB       ARG  28   3.876  12.785 -10.133
  220   1HG   ARG  28          2HG       ARG  28   2.630  14.212 -11.795
  221   2HG   ARG  28          1HG       ARG  28   1.125  13.555 -11.149
  222   1HD   ARG  28          2HD       ARG  28   1.275  14.766  -9.217
  223   2HD   ARG  28          1HD       ARG  28   3.029  14.597  -9.131
  224    HE   ARG  28           HE       ARG  28   3.090  16.378 -10.965
  225   1HH1  ARG  28          1HH2      ARG  28   0.404  16.927 -11.672
  226   2HH1  ARG  28          2HH2      ARG  28  -0.122  18.147 -10.561
  227   1HH2  ARG  28          1HH1      ARG  28   1.024  18.501  -8.645
  228   2HH2  ARG  28          2HH1      ARG  28   2.428  17.552  -8.288
  229    H    GLY  29           H        GLY  29   1.283   9.889 -10.874
  230   1HA   GLY  29          2HA       GLY  29  -1.068   9.724 -11.332
  231   2HA   GLY  29          1HA       GLY  29  -0.871  10.892 -12.637
  232    H    THR  30           H        THR  30   1.570   8.562 -12.741
  233    HA   THR  30           HA       THR  30   0.191   7.220 -15.013
  234    HB   THR  30           HB       THR  30   3.074   6.773 -14.285
  235    HG1  THR  30           HG1      THR  30   1.863   9.106 -15.182
  236   1HG2  THR  30          2HG2      THR  30   1.455   5.838 -16.291
  237   2HG2  THR  30          1HG2      THR  30   2.216   7.227 -17.066
  238   3HG2  THR  30          3HG2      THR  30   3.212   5.939 -16.391
  239    H    PHE  31           H        PHE  31  -1.110   5.697 -13.909
  240    HA   PHE  31           HA       PHE  31   0.293   3.823 -12.077
  241   1HB   PHE  31          2HB       PHE  31  -2.662   3.748 -12.584
  242   2HB   PHE  31          1HB       PHE  31  -1.772   3.333 -11.119
  243    HD1  PHE  31           HD1      PHE  31   0.045   5.832 -11.168
  244    HD2  PHE  31           HD2      PHE  31  -4.199   5.307 -11.556
  245    HE1  PHE  31           HE1      PHE  31  -0.318   8.125 -10.298
  246    HE2  PHE  31           HE2      PHE  31  -4.562   7.599 -10.689
  247    HZ   PHE  31           HZ       PHE  31  -2.622   9.010 -10.058
  248    H    LEU  32           H        LEU  32   1.129   2.074 -13.104
  249    HA   LEU  32           HA       LEU  32  -0.424   0.923 -15.383
  250   1HB   LEU  32          2HB       LEU  32   1.681  -0.107 -16.111
  251   2HB   LEU  32          1HB       LEU  32   1.901   1.632 -15.926
  252    HG   LEU  32           HG       LEU  32   2.666   1.047 -13.511
  253   1HD1  LEU  32          2HD1      LEU  32   2.366  -1.601 -14.786
  254   2HD1  LEU  32          1HD1      LEU  32   3.904  -1.357 -13.958
  255   3HD1  LEU  32          3HD1      LEU  32   2.388  -1.174 -13.075
  256   1HD2  LEU  32          3HD2      LEU  32   4.118   0.792 -16.093
  257   2HD2  LEU  32          2HD2      LEU  32   4.427   1.868 -14.732
  258   3HD2  LEU  32          1HD2      LEU  32   4.958   0.188 -14.664
  259    H    ILE  33           H        ILE  33  -0.304  -1.513 -15.490
  260    HA   ILE  33           HA       ILE  33  -0.462  -2.645 -12.730
  261    HB   ILE  33           HB       ILE  33  -1.983  -3.236 -15.259
  262   1HG1  ILE  33          2HG1      ILE  33  -2.719  -2.874 -12.344
  263   2HG1  ILE  33          1HG1      ILE  33  -2.977  -1.707 -13.640
  264   1HG2  ILE  33          3HG2      ILE  33  -1.068  -5.415 -14.517
  265   2HG2  ILE  33          2HG2      ILE  33  -1.750  -5.133 -12.914
  266   3HG2  ILE  33          1HG2      ILE  33  -2.816  -5.323 -14.304
  267   1HD1  ILE  33          2HD1      ILE  33  -4.219  -3.867 -14.708
  268   2HD1  ILE  33          1HD1      ILE  33  -4.484  -4.182 -12.992
  269   3HD1  ILE  33          3HD1      ILE  33  -5.051  -2.674 -13.711
  270    H    ARG  34           H        ARG  34   0.077  -5.091 -12.741
  271    HA   ARG  34           HA       ARG  34   1.737  -6.295 -14.687
  272   1HB   ARG  34          2HB       ARG  34   3.981  -5.918 -13.561
  273   2HB   ARG  34          1HB       ARG  34   3.321  -4.510 -14.393
  274   1HG   ARG  34          2HG       ARG  34   3.522  -3.374 -12.456
  275   2HG   ARG  34          1HG       ARG  34   2.245  -4.398 -11.800
  276   1HD   ARG  34          2HD       ARG  34   3.833  -5.969 -10.927
  277   2HD   ARG  34          1HD       ARG  34   5.158  -5.222 -11.819
  278    HE   ARG  34           HE       ARG  34   4.419  -3.148 -10.276
  279   1HH1  ARG  34          2HH1      ARG  34   5.209  -6.433  -9.682
  280   2HH1  ARG  34          1HH1      ARG  34   5.403  -6.225  -7.972
  281   1HH2  ARG  34          1HH2      ARG  34   4.454  -2.889  -8.005
  282   2HH2  ARG  34          2HH2      ARG  34   4.976  -4.218  -7.024
  283    H    GLU  35           H        GLU  35   2.218  -8.385 -14.040
  284    HA   GLU  35           HA       GLU  35   0.917  -9.560 -11.859
  285   1HB   GLU  35          2HB       GLU  35   3.155 -10.345 -13.650
  286   2HB   GLU  35          1HB       GLU  35   2.963 -11.280 -12.171
  287   1HG   GLU  35          2HG       GLU  35   0.456 -11.395 -12.816
  288   2HG   GLU  35          1HG       GLU  35   0.992 -10.889 -14.419
  289    H    SER  36           H        SER  36   1.383  -9.802  -9.694
  290    HA   SER  36           HA       SER  36   3.769  -8.405  -8.659
  291   1HB   SER  36          2HB       SER  36   1.355  -9.629  -7.293
  292   2HB   SER  36          1HB       SER  36   2.658  -8.796  -6.457
  293    HG   SER  36           HG       SER  36   1.435  -7.125  -6.825
  294    H    GLU  37           H        GLU  37   5.537  -9.521  -7.961
  295    HA   GLU  37           HA       GLU  37   5.447 -12.480  -7.997
  296   1HB   GLU  37          2HB       GLU  37   7.679 -10.474  -7.648
  297   2HB   GLU  37          1HB       GLU  37   7.919 -12.217  -7.560
  298   1HG   GLU  37          2HG       GLU  37   6.546 -12.059  -9.891
  299   2HG   GLU  37          1HG       GLU  37   7.365 -10.497  -9.920
  300    H    THR  38           H        THR  38   4.307 -10.542  -5.870
  301    HA   THR  38           HA       THR  38   5.840 -11.314  -3.470
  302    HB   THR  38           HB       THR  38   4.620  -9.053  -3.894
  303    HG1  THR  38           HG1      THR  38   5.154  -9.024  -1.878
  304   1HG2  THR  38          3HG2      THR  38   2.303 -10.805  -3.034
  305   2HG2  THR  38          2HG2      THR  38   2.266  -9.043  -3.103
  306   3HG2  THR  38          1HG2      THR  38   2.467  -9.980  -4.583
  307    H    THR  39           H        THR  39   2.733 -11.909  -4.988
  308    HA   THR  39           HA       THR  39   2.158 -14.043  -2.992
  309    HB   THR  39           HB       THR  39   0.493 -12.414  -4.909
  310    HG1  THR  39           HG1      THR  39  -0.581 -11.934  -3.034
  311   1HG2  THR  39          3HG2      THR  39  -0.354 -14.966  -3.522
  312   2HG2  THR  39          2HG2      THR  39  -1.433 -13.856  -4.364
  313   3HG2  THR  39          1HG2      THR  39  -0.196 -14.729  -5.260
  314    H    LYS  40           H        LYS  40   1.045 -16.034  -4.099
  315    HA   LYS  40           HA       LYS  40   2.752 -17.534  -5.607
  316   1HB   LYS  40          2HB       LYS  40  -0.173 -17.544  -6.318
  317   2HB   LYS  40          1HB       LYS  40   0.933 -18.913  -6.217
  318   1HG   LYS  40          2HG       LYS  40   1.136 -18.299  -3.713
  319   2HG   LYS  40          1HG       LYS  40  -0.305 -17.318  -3.979
  320   1HD   LYS  40          2HD       LYS  40  -0.053 -20.295  -4.518
  321   2HD   LYS  40          1HD       LYS  40  -0.939 -19.557  -3.183
  322   1HE   LYS  40          2HE       LYS  40  -2.734 -19.175  -4.495
  323   2HE   LYS  40          1HE       LYS  40  -1.736 -18.402  -5.728
  324   1HZ   LYS  40          3HZ       LYS  40  -1.393 -21.252  -5.592
  325   2HZ   LYS  40          2HZ       LYS  40  -2.980 -20.791  -5.988
  326   3HZ   LYS  40          1HZ       LYS  40  -1.676 -20.257  -6.937
  327    H    GLY  41           H        GLY  41   0.700 -14.968  -6.759
  328   1HA   GLY  41          2HA       GLY  41   2.156 -14.085  -8.885
  329   2HA   GLY  41          1HA       GLY  41   1.248 -15.435  -9.578
  330    H    ALA  42           H        ALA  42   0.545 -12.787  -7.299
  331    HA   ALA  42           HA       ALA  42  -2.181 -12.472  -8.305
  332   1HB   ALA  42          1HB       ALA  42  -1.000 -11.917  -5.925
  333   2HB   ALA  42          3HB       ALA  42  -0.902 -10.333  -6.696
  334   3HB   ALA  42          2HB       ALA  42  -2.472 -11.113  -6.477
  335    H    TYR  43           H        TYR  43  -2.262  -9.616  -8.236
  336    HA   TYR  43           HA       TYR  43  -0.515  -8.980 -10.559
  337   1HB   TYR  43          2HB       TYR  43  -3.379  -9.083 -10.529
  338   2HB   TYR  43          1HB       TYR  43  -2.870  -7.409 -10.788
  339    HD1  TYR  43           HD1      TYR  43  -0.413  -7.531 -12.185
  340    HD2  TYR  43           HD2      TYR  43  -3.823 -10.108 -12.605
  341    HE1  TYR  43           HE1      TYR  43   0.308  -8.112 -14.490
  342    HE2  TYR  43           HE2      TYR  43  -3.101 -10.695 -14.905
  343    HH   TYR  43           HH       TYR  43  -1.568 -10.409 -16.477
  344    H    SER  44           H        SER  44  -0.940  -6.320 -10.874
  345    HA   SER  44           HA       SER  44  -0.906  -4.983  -8.258
  346   1HB   SER  44          2HB       SER  44   1.314  -5.599  -8.091
  347   2HB   SER  44          1HB       SER  44   1.556  -5.549  -9.837
  348    HG   SER  44           HG       SER  44   2.495  -3.765  -8.663
  349    H    LEU  45           H        LEU  45  -0.226  -2.658  -8.563
  350    HA   LEU  45           HA       LEU  45  -0.900  -1.589 -11.255
  351   1HB   LEU  45          2HB       LEU  45  -2.769  -1.618  -9.205
  352   2HB   LEU  45          1HB       LEU  45  -2.052  -0.011  -9.087
  353    HG   LEU  45           HG       LEU  45  -3.515  -1.249 -11.383
  354   1HD1  LEU  45          1HD1      LEU  45  -3.628   1.268  -9.751
  355   2HD1  LEU  45          3HD1      LEU  45  -4.398   1.203 -11.337
  356   3HD1  LEU  45          2HD1      LEU  45  -4.913   0.100 -10.061
  357   1HD2  LEU  45          2HD2      LEU  45  -1.177   0.531 -11.524
  358   2HD2  LEU  45          1HD2      LEU  45  -1.935  -0.425 -12.796
  359   3HD2  LEU  45          3HD2      LEU  45  -2.593   1.154 -12.370
  360    H    SER  46           H        SER  46   1.489  -1.211 -11.098
  361    HA   SER  46           HA       SER  46   2.685   0.410  -9.120
  362   1HB   SER  46          2HB       SER  46   4.148  -0.598 -10.705
  363   2HB   SER  46          1HB       SER  46   3.300   0.141 -12.054
  364    HG   SER  46           HG       SER  46   5.369   1.092 -10.829
  365    H    ILE  47           H        ILE  47   3.371   2.658  -9.439
  366    HA   ILE  47           HA       ILE  47   1.681   4.386 -11.089
  367    HB   ILE  47           HB       ILE  47   0.505   5.494  -9.388
  368   1HG1  ILE  47          2HG1      ILE  47   2.313   4.153  -7.350
  369   2HG1  ILE  47          1HG1      ILE  47   2.492   5.816  -7.912
  370   1HG2  ILE  47          2HG2      ILE  47   0.733   2.610  -8.478
  371   2HG2  ILE  47          1HG2      ILE  47  -0.565   3.718  -8.036
  372   3HG2  ILE  47          3HG2      ILE  47  -0.366   3.220  -9.716
  373   1HD1  ILE  47          2HD1      ILE  47  -0.238   5.192  -7.043
  374   2HD1  ILE  47          1HD1      ILE  47   0.952   5.012  -5.754
  375   3HD1  ILE  47          3HD1      ILE  47   0.798   6.550  -6.604
  376    H    ARG  48           H        ARG  48   2.607   6.422 -11.398
  377    HA   ARG  48           HA       ARG  48   5.342   6.726 -10.248
  378   1HB   ARG  48          2HB       ARG  48   4.394   6.983 -12.860
  379   2HB   ARG  48          1HB       ARG  48   4.581   8.648 -12.311
  380   1HG   ARG  48          2HG       ARG  48   6.808   6.889 -11.533
  381   2HG   ARG  48          1HG       ARG  48   6.625   7.072 -13.278
  382   1HD   ARG  48          2HD       ARG  48   6.281   9.622 -11.935
  383   2HD   ARG  48          1HD       ARG  48   7.832   8.897 -11.512
  384    HE   ARG  48           HE       ARG  48   7.577   8.630 -14.302
  385   1HH1  ARG  48          2HH1      ARG  48   7.189  11.253 -12.126
  386   2HH1  ARG  48          1HH1      ARG  48   8.118  12.363 -13.077
  387   1HH2  ARG  48          1HH2      ARG  48   8.997  10.003 -15.459
  388   2HH2  ARG  48          2HH2      ARG  48   9.141  11.656 -14.963
  389    H    ASP  49           H        ASP  49   5.700   8.344  -8.768
  390    HA   ASP  49           HA       ASP  49   3.836  10.651  -8.739
  391   1HB   ASP  49          2HB       ASP  49   2.776   9.135  -7.190
  392   2HB   ASP  49          1HB       ASP  49   4.311   8.803  -6.388
  393    H    TRP  50           H        TRP  50   6.092  11.398  -9.589
  394    HA   TRP  50           HA       TRP  50   8.312  11.620  -7.782
  395   1HB   TRP  50          2HB       TRP  50   8.804  12.054 -10.062
  396   2HB   TRP  50          1HB       TRP  50   7.437  13.148 -10.238
  397    HD1  TRP  50           HD1      TRP  50  11.068  13.094  -9.367
  398    HE1  TRP  50           HE1      TRP  50  11.845  15.456  -8.689
  399    HE3  TRP  50           HE3      TRP  50   6.570  15.385  -9.027
  400    HZ2  TRP  50           HZ2      TRP  50  10.684  18.016  -8.135
  401    HZ3  TRP  50           HZ3      TRP  50   6.405  17.792  -8.439
  402    HH2  TRP  50           HH2      TRP  50   8.461  19.109  -7.996
  403    H    ASP  51           H        ASP  51   9.014  13.796  -6.817
  404    HA   ASP  51           HA       ASP  51   6.731  15.534  -6.065
  405   1HB   ASP  51          2HB       ASP  51   7.548  13.478  -4.393
  406   2HB   ASP  51          1HB       ASP  51   8.410  14.879  -3.757
  407    H    ASP  52           H        ASP  52   7.425  17.595  -5.190
  408    HA   ASP  52           HA       ASP  52  10.037  18.436  -6.246
  409   1HB   ASP  52          2HB       ASP  52   9.265  20.660  -5.934
  410   2HB   ASP  52          1HB       ASP  52   7.828  19.759  -6.412
  411    H    MET  53           H        MET  53  10.291  16.640  -4.035
  412    HA   MET  53           HA       MET  53  11.917  18.297  -2.312
  413   1HB   MET  53          2HB       MET  53  10.769  17.974  -0.248
  414   2HB   MET  53          1HB       MET  53   9.548  18.519  -1.396
  415   1HG   MET  53          2HG       MET  53   9.728  15.674  -1.595
  416   2HG   MET  53          1HG       MET  53   9.594  16.089   0.113
  417   1HE   MET  53          3HE       MET  53   8.440  16.702  -3.380
  418   2HE   MET  53          2HE       MET  53   6.785  17.302  -3.288
  419   3HE   MET  53          1HE       MET  53   8.123  18.362  -2.855
  420    H    LYS  54           H        LYS  54  11.974  15.754  -4.031
  421    HA   LYS  54           HA       LYS  54  13.843  14.352  -2.394
  422   1HB   LYS  54          2HB       LYS  54  12.481  12.188  -2.283
  423   2HB   LYS  54          1HB       LYS  54  12.006  13.470  -1.170
  424   1HG   LYS  54          2HG       LYS  54  10.438  14.177  -3.199
  425   2HG   LYS  54          1HG       LYS  54  10.612  12.474  -3.625
  426   1HD   LYS  54          2HD       LYS  54  10.142  12.653  -0.806
  427   2HD   LYS  54          1HD       LYS  54   8.921  13.619  -1.635
  428   1HE   LYS  54          2HE       LYS  54   8.323  11.728  -3.051
  429   2HE   LYS  54          1HE       LYS  54   9.625  10.760  -2.360
  430   1HZ   LYS  54          3HZ       LYS  54   8.549  10.971  -0.189
  431   2HZ   LYS  54          2HZ       LYS  54   7.271  11.832  -0.903
  432   3HZ   LYS  54          1HZ       LYS  54   7.541  10.207  -1.319
  433    H    GLY  55           H        GLY  55  11.780  14.353  -5.255
  434   1HA   GLY  55          2HA       GLY  55  13.139  14.019  -7.363
  435   2HA   GLY  55          1HA       GLY  55  13.770  12.596  -6.548
  436    H    ASP  56           H        ASP  56  12.810  11.566  -8.582
  437    HA   ASP  56           HA       ASP  56   9.900  11.434  -8.713
  438   1HB   ASP  56          2HB       ASP  56  10.472   9.538 -10.373
  439   2HB   ASP  56          1HB       ASP  56  10.994  11.164 -10.800
  440    H    HIS  57           H        HIS  57   8.883   9.136  -8.700
  441    HA   HIS  57           HA       HIS  57  10.141   7.129  -7.020
  442   1HB   HIS  57          2HB       HIS  57   8.005   8.947  -5.894
  443   2HB   HIS  57          1HB       HIS  57   8.248   7.314  -5.273
  444    HD1  HIS  57           HD1      HIS  57   9.768  10.717  -5.317
  445    HD2  HIS  57           HD2      HIS  57  10.789   6.907  -3.969
  446    HE1  HIS  57           HE1      HIS  57  11.770  11.009  -3.793
  447    H    VAL  58           H        VAL  58   8.233   5.475  -6.402
  448    HA   VAL  58           HA       VAL  58   6.027   5.503  -8.307
  449    HB   VAL  58           HB       VAL  58   8.517   3.966  -8.796
  450   1HG1  VAL  58          2HG1      VAL  58   5.760   2.754  -8.990
  451   2HG1  VAL  58          1HG1      VAL  58   7.026   2.281 -10.122
  452   3HG1  VAL  58          3HG1      VAL  58   7.246   2.018  -8.391
  453   1HG2  VAL  58          1HG2      VAL  58   6.251   5.121 -10.416
  454   2HG2  VAL  58          3HG2      VAL  58   7.920   5.685 -10.326
  455   3HG2  VAL  58          2HG2      VAL  58   7.544   4.166 -11.145
  456    H    LYS  59           H        LYS  59   4.375   4.715  -7.170
  457    HA   LYS  59           HA       LYS  59   4.900   2.784  -4.961
  458   1HB   LYS  59          2HB       LYS  59   3.143   5.017  -5.266
  459   2HB   LYS  59          1HB       LYS  59   2.147   3.568  -5.130
  460   1HG   LYS  59          2HG       LYS  59   4.420   4.223  -3.236
  461   2HG   LYS  59          1HG       LYS  59   2.736   4.632  -2.915
  462   1HD   LYS  59          2HD       LYS  59   2.162   2.200  -3.198
  463   2HD   LYS  59          1HD       LYS  59   3.886   1.857  -3.322
  464   1HE   LYS  59          2HE       LYS  59   2.389   2.996  -0.953
  465   2HE   LYS  59          1HE       LYS  59   3.311   1.495  -1.029
  466   1HZ   LYS  59          2HZ       LYS  59   5.249   3.061  -1.644
  467   2HZ   LYS  59          1HZ       LYS  59   4.287   4.268  -0.934
  468   3HZ   LYS  59          3HZ       LYS  59   4.778   2.929  -0.018
  469    H    HIS  60           H        HIS  60   2.527   1.399  -4.859
  470    HA   HIS  60           HA       HIS  60   1.783   0.489  -7.539
  471   1HB   HIS  60          2HB       HIS  60   2.978  -1.641  -5.803
  472   2HB   HIS  60          1HB       HIS  60   2.742  -1.636  -7.546
  473    HD1  HIS  60           HD1      HIS  60   4.676  -0.896  -8.961
  474    HD2  HIS  60           HD2      HIS  60   5.199   0.126  -4.956
  475    HE1  HIS  60           HE1      HIS  60   7.029   0.017  -8.760
  476    H    TYR  61           H        TYR  61  -0.054  -0.854  -7.527
  477    HA   TYR  61           HA       TYR  61  -1.279  -1.206  -4.808
  478   1HB   TYR  61          2HB       TYR  61  -2.592  -0.553  -7.457
  479   2HB   TYR  61          1HB       TYR  61  -3.502  -1.124  -6.063
  480    HD1  TYR  61           HD1      TYR  61  -0.997   1.487  -7.041
  481    HD2  TYR  61           HD2      TYR  61  -4.255   0.393  -4.469
  482    HE1  TYR  61           HE1      TYR  61  -1.015   3.778  -6.089
  483    HE2  TYR  61           HE2      TYR  61  -4.285   2.681  -3.527
  484    HH   TYR  61           HH       TYR  61  -1.822   4.795  -3.768
  485    H    LYS  62           H        LYS  62  -0.599  -3.323  -4.483
  486    HA   LYS  62           HA       LYS  62  -0.509  -5.391  -6.401
  487   1HB   LYS  62          2HB       LYS  62   0.414  -5.417  -4.033
  488   2HB   LYS  62          1HB       LYS  62  -1.214  -5.796  -3.486
  489   1HG   LYS  62          2HG       LYS  62  -0.272  -7.457  -5.729
  490   2HG   LYS  62          1HG       LYS  62   0.667  -7.648  -4.247
  491   1HD   LYS  62          2HD       LYS  62  -2.359  -7.772  -4.334
  492   2HD   LYS  62          1HD       LYS  62  -1.322  -9.197  -4.429
  493   1HE   LYS  62          2HE       LYS  62  -0.910  -9.155  -2.202
  494   2HE   LYS  62          1HE       LYS  62  -0.576  -7.424  -2.226
  495   1HZ   LYS  62          2HZ       LYS  62  -3.319  -7.843  -2.669
  496   2HZ   LYS  62          1HZ       LYS  62  -2.857  -8.711  -1.284
  497   3HZ   LYS  62          3HZ       LYS  62  -2.566  -7.042  -1.373
  498    H    ILE  63           H        ILE  63  -2.204  -5.900  -7.662
  499    HA   ILE  63           HA       ILE  63  -4.959  -5.674  -6.741
  500    HB   ILE  63           HB       ILE  63  -3.634  -6.573  -9.298
  501   1HG1  ILE  63          2HG1      ILE  63  -5.677  -4.646  -9.667
  502   2HG1  ILE  63          1HG1      ILE  63  -4.775  -4.145  -8.237
  503   1HG2  ILE  63          1HG2      ILE  63  -6.539  -6.838  -8.492
  504   2HG2  ILE  63          3HG2      ILE  63  -6.029  -6.761 -10.180
  505   3HG2  ILE  63          2HG2      ILE  63  -5.476  -8.083  -9.151
  506   1HD1  ILE  63          1HD1      ILE  63  -2.954  -5.075 -10.279
  507   2HD1  ILE  63          3HD1      ILE  63  -4.008  -3.822 -10.935
  508   3HD1  ILE  63          2HD1      ILE  63  -3.031  -3.493  -9.504
  509    H    ARG  64           H        ARG  64  -6.380  -7.395  -6.373
  510    HA   ARG  64           HA       ARG  64  -5.167 -10.107  -6.155
  511   1HB   ARG  64          2HB       ARG  64  -7.058  -8.722  -4.229
  512   2HB   ARG  64          1HB       ARG  64  -6.640 -10.432  -4.141
  513   1HG   ARG  64          2HG       ARG  64  -4.810  -8.050  -3.788
  514   2HG   ARG  64          1HG       ARG  64  -5.168  -9.322  -2.621
  515   1HD   ARG  64          2HD       ARG  64  -4.241 -10.782  -4.741
  516   2HD   ARG  64          1HD       ARG  64  -3.276  -9.314  -4.884
  517    HE   ARG  64           HE       ARG  64  -2.028 -10.320  -3.144
  518   1HH1  ARG  64          2HH1      ARG  64  -5.241 -11.426  -2.938
  519   2HH1  ARG  64          1HH1      ARG  64  -5.167 -11.797  -1.248
  520   1HH2  ARG  64          1HH2      ARG  64  -1.989 -10.474  -0.826
  521   2HH2  ARG  64          2HH2      ARG  64  -3.326 -11.258  -0.052
  522    H    LYS  65           H        LYS  65  -6.321 -11.597  -7.303
  523    HA   LYS  65           HA       LYS  65  -9.051 -10.793  -8.187
  524   1HB   LYS  65          2HB       LYS  65  -7.633 -11.230 -10.074
  525   2HB   LYS  65          1HB       LYS  65  -7.025 -12.720  -9.352
  526   1HG   LYS  65          2HG       LYS  65  -9.262 -13.727  -9.508
  527   2HG   LYS  65          1HG       LYS  65  -9.903 -12.229 -10.183
  528   1HD   LYS  65          2HD       LYS  65  -9.425 -13.165 -12.197
  529   2HD   LYS  65          1HD       LYS  65  -7.757 -12.726 -11.833
  530   1HE   LYS  65          2HE       LYS  65  -7.619 -15.027 -12.338
  531   2HE   LYS  65          1HE       LYS  65  -7.666 -15.000 -10.576
  532   1HZ   LYS  65          1HZ       LYS  65 -10.288 -15.020 -11.314
  533   2HZ   LYS  65          3HZ       LYS  65  -9.563 -16.073 -12.427
  534   3HZ   LYS  65          2HZ       LYS  65  -9.398 -16.356 -10.760
  535    H    LEU  66           H        LEU  66 -10.700 -11.789  -7.199
  536    HA   LEU  66           HA       LEU  66 -10.304 -13.957  -5.342
  537   1HB   LEU  66          2HB       LEU  66 -12.781 -12.736  -6.579
  538   2HB   LEU  66          1HB       LEU  66 -12.864 -14.079  -5.446
  539    HG   LEU  66           HG       LEU  66 -13.122 -12.249  -4.029
  540   1HD1  LEU  66          3HD1      LEU  66 -10.953 -13.701  -3.616
  541   2HD1  LEU  66          2HD1      LEU  66 -10.129 -12.185  -3.991
  542   3HD1  LEU  66          1HD1      LEU  66 -11.262 -12.262  -2.642
  543   1HD2  LEU  66          3HD2      LEU  66 -12.748 -10.549  -5.778
  544   2HD2  LEU  66          2HD2      LEU  66 -11.910 -10.129  -4.283
  545   3HD2  LEU  66          1HD2      LEU  66 -11.007 -10.799  -5.642
  546    H    ASP  67           H        ASP  67 -10.649 -16.144  -5.607
  547    HA   ASP  67           HA       ASP  67 -10.531 -17.193  -8.311
  548   1HB   ASP  67          2HB       ASP  67 -10.351 -18.218  -5.583
  549   2HB   ASP  67          1HB       ASP  67 -11.292 -19.285  -6.622
  550    H    ASN  68           H        ASN  68 -12.982 -16.214  -6.144
  551    HA   ASN  68           HA       ASN  68 -15.118 -17.863  -7.268
  552   1HB   ASN  68          2HB       ASN  68 -15.695 -15.306  -5.844
  553   2HB   ASN  68          1HB       ASN  68 -16.464 -16.883  -5.661
  554   1HD2  ASN  68          2HD2      ASN  68 -13.274 -17.846  -3.753
  555   2HD2  ASN  68          1HD2      ASN  68 -13.782 -18.253  -5.317
  556    H    GLY  69           H        GLY  69 -13.397 -15.087  -8.170
  557   1HA   GLY  69          2HA       GLY  69 -13.720 -14.132 -10.388
  558   2HA   GLY  69          1HA       GLY  69 -15.437 -14.463 -10.208
  559    H    GLY  70           H        GLY  70 -12.818 -12.377  -9.078
  560   1HA   GLY  70          2HA       GLY  70 -14.579 -10.129  -8.867
  561   2HA   GLY  70          1HA       GLY  70 -14.139 -10.738  -7.278
  562    H    TYR  71           H        TYR  71 -12.938  -9.165 -10.174
  563    HA   TYR  71           HA       TYR  71 -10.159  -9.072  -9.279
  564   1HB   TYR  71          2HB       TYR  71 -11.755  -7.856 -11.509
  565   2HB   TYR  71          1HB       TYR  71 -10.239  -7.077 -11.058
  566    HD1  TYR  71           HD1      TYR  71  -8.178  -8.702 -10.748
  567    HD2  TYR  71           HD2      TYR  71 -11.704  -9.646 -13.008
  568    HE1  TYR  71           HE1      TYR  71  -6.913 -10.430 -11.996
  569    HE2  TYR  71           HE2      TYR  71 -10.442 -11.378 -14.256
  570    HH   TYR  71           HH       TYR  71  -7.492 -11.561 -14.665
  571    H    TYR  72           H        TYR  72  -9.514  -7.774  -7.618
  572    HA   TYR  72           HA       TYR  72 -10.796  -5.119  -7.302
  573   1HB   TYR  72          2HB       TYR  72 -11.597  -5.542  -5.103
  574   2HB   TYR  72          1HB       TYR  72 -12.107  -6.929  -6.064
  575    HD1  TYR  72           HD1      TYR  72 -10.513  -8.993  -6.103
  576    HD2  TYR  72           HD2      TYR  72 -10.307  -5.879  -3.163
  577    HE1  TYR  72           HE1      TYR  72  -9.222 -10.486  -4.618
  578    HE2  TYR  72           HE2      TYR  72  -9.009  -7.355  -1.676
  579    HH   TYR  72           HH       TYR  72  -8.692  -9.795  -1.332
  580    H    ILE  73           H        ILE  73  -9.169  -3.677  -6.774
  581    HA   ILE  73           HA       ILE  73  -6.609  -4.748  -5.761
  582    HB   ILE  73           HB       ILE  73  -7.189  -1.798  -5.988
  583   1HG1  ILE  73          2HG1      ILE  73  -6.659  -3.695  -8.298
  584   2HG1  ILE  73          1HG1      ILE  73  -8.100  -2.704  -8.066
  585   1HG2  ILE  73          2HG2      ILE  73  -4.875  -3.613  -5.903
  586   2HG2  ILE  73          1HG2      ILE  73  -4.745  -2.308  -7.082
  587   3HG2  ILE  73          3HG2      ILE  73  -5.020  -1.933  -5.382
  588   1HD1  ILE  73          2HD1      ILE  73  -5.298  -1.582  -8.360
  589   2HD1  ILE  73          1HD1      ILE  73  -6.454  -1.712  -9.686
  590   3HD1  ILE  73          3HD1      ILE  73  -6.804  -0.665  -8.310
  591    H    THR  74           H        THR  74  -9.520  -3.278  -4.700
  592    HA   THR  74           HA       THR  74  -8.573  -3.427  -1.894
  593    HB   THR  74           HB       THR  74  -8.636  -1.163  -1.785
  594    HG1  THR  74           HG1      THR  74 -10.496  -1.492  -0.702
  595   1HG2  THR  74          1HG2      THR  74 -10.345  -1.193  -4.288
  596   2HG2  THR  74          3HG2      THR  74  -9.720   0.263  -3.514
  597   3HG2  THR  74          2HG2      THR  74  -8.606  -0.909  -4.218
  598    H    THR  75           H        THR  75 -10.182  -4.200  -0.509
  599    HA   THR  75           HA       THR  75 -12.197  -5.848  -1.686
  600    HB   THR  75           HB       THR  75 -13.030  -6.082   0.679
  601    HG1  THR  75           HG1      THR  75 -10.831  -4.407   1.276
  602   1HG2  THR  75          1HG2      THR  75 -10.521  -6.795  -0.495
  603   2HG2  THR  75          3HG2      THR  75 -10.263  -6.486   1.224
  604   3HG2  THR  75          2HG2      THR  75 -11.455  -7.682   0.713
  605    H    ARG  76           H        ARG  76 -12.251  -2.515  -1.327
  606    HA   ARG  76           HA       ARG  76 -15.098  -2.259  -0.739
  607   1HB   ARG  76          2HB       ARG  76 -13.610  -0.463  -0.056
  608   2HB   ARG  76          1HB       ARG  76 -13.038  -0.259  -1.712
  609   1HG   ARG  76          2HG       ARG  76 -15.255   0.440  -2.440
  610   2HG   ARG  76          1HG       ARG  76 -15.918   0.113  -0.838
  611   1HD   ARG  76          2HD       ARG  76 -14.267   1.809   0.075
  612   2HD   ARG  76          1HD       ARG  76 -13.896   2.238  -1.594
  613    HE   ARG  76           HE       ARG  76 -16.582   2.594  -0.332
  614   1HH1  ARG  76          2HH1      ARG  76 -15.969   2.422  -3.424
  615   2HH1  ARG  76          1HH1      ARG  76 -16.053   4.107  -3.817
  616   1HH2  ARG  76          1HH2      ARG  76 -15.920   5.155  -0.514
  617   2HH2  ARG  76          2HH2      ARG  76 -16.025   5.654  -2.169
  618    H    ALA  77           H        ALA  77 -13.348  -3.143  -3.506
  619    HA   ALA  77           HA       ALA  77 -15.757  -2.863  -5.144
  620   1HB   ALA  77          1HB       ALA  77 -13.489  -0.975  -5.379
  621   2HB   ALA  77          3HB       ALA  77 -14.102  -1.630  -6.898
  622   3HB   ALA  77          2HB       ALA  77 -15.186  -0.761  -5.812
  623    H    GLN  78           H        GLN  78 -15.816  -4.775  -6.189
  624    HA   GLN  78           HA       GLN  78 -13.296  -5.936  -7.251
  625   1HB   GLN  78          2HB       GLN  78 -15.821  -7.346  -6.339
  626   2HB   GLN  78          1HB       GLN  78 -14.388  -8.122  -7.002
  627   1HG   GLN  78          2HG       GLN  78 -13.539  -8.210  -4.910
  628   2HG   GLN  78          1HG       GLN  78 -13.471  -6.449  -4.919
  629   1HE2  GLN  78          2HE2      GLN  78 -15.596  -6.776  -2.074
  630   2HE2  GLN  78          1HE2      GLN  78 -13.993  -6.531  -2.570
  631    H    PHE  79           H        PHE  79 -13.837  -7.400  -9.235
  632    HA   PHE  79           HA       PHE  79 -16.244  -6.516 -10.722
  633   1HB   PHE  79          2HB       PHE  79 -13.403  -6.004 -11.626
  634   2HB   PHE  79          1HB       PHE  79 -14.779  -5.985 -12.731
  635    HD1  PHE  79           HD1      PHE  79 -13.447  -4.473  -9.602
  636    HD2  PHE  79           HD2      PHE  79 -16.220  -4.104 -12.857
  637    HE1  PHE  79           HE1      PHE  79 -14.002  -2.182  -8.863
  638    HE2  PHE  79           HE2      PHE  79 -16.778  -1.802 -12.118
  639    HZ   PHE  79           HZ       PHE  79 -15.668  -0.839 -10.120
  640    H    GLU  80           H        GLU  80 -15.539  -7.591 -13.207
  641    HA   GLU  80           HA       GLU  80 -15.288 -10.459 -12.442
  642   1HB   GLU  80          2HB       GLU  80 -16.644 -11.028 -14.288
  643   2HB   GLU  80          1HB       GLU  80 -17.395  -9.575 -13.635
  644   1HG   GLU  80          2HG       GLU  80 -16.130  -8.222 -15.305
  645   2HG   GLU  80          1HG       GLU  80 -15.511  -9.719 -16.001
  646    H    THR  81           H        THR  81 -14.044  -7.996 -14.719
  647    HA   THR  81           HA       THR  81 -11.832  -9.933 -15.266
  648    HB   THR  81           HB       THR  81 -12.794  -9.985 -17.365
  649    HG1  THR  81           HG1      THR  81 -11.807  -7.631 -18.164
  650   1HG2  THR  81          2HG2      THR  81 -14.542  -8.206 -16.511
  651   2HG2  THR  81          1HG2      THR  81 -13.509  -7.089 -17.403
  652   3HG2  THR  81          3HG2      THR  81 -14.270  -8.438 -18.235
  653    H    LEU  82           H        LEU  82  -9.930  -8.624 -16.318
  654    HA   LEU  82           HA       LEU  82  -9.278  -6.505 -14.401
  655   1HB   LEU  82          2HB       LEU  82  -7.793  -8.152 -16.377
  656   2HB   LEU  82          1HB       LEU  82  -7.154  -6.534 -16.084
  657    HG   LEU  82           HG       LEU  82  -7.941  -8.236 -13.740
  658   1HD1  LEU  82          1HD1      LEU  82  -6.410  -9.503 -15.432
  659   2HD1  LEU  82          3HD1      LEU  82  -5.164  -8.375 -14.895
  660   3HD1  LEU  82          2HD1      LEU  82  -5.938  -9.456 -13.733
  661   1HD2  LEU  82          1HD2      LEU  82  -6.540  -5.755 -14.261
  662   2HD2  LEU  82          3HD2      LEU  82  -7.096  -6.414 -12.723
  663   3HD2  LEU  82          2HD2      LEU  82  -5.513  -6.865 -13.355
  664    H    GLN  83           H        GLN  83 -10.179  -6.817 -17.763
  665    HA   GLN  83           HA       GLN  83  -9.511  -4.073 -18.454
  666   1HB   GLN  83          2HB       GLN  83  -9.763  -6.010 -20.102
  667   2HB   GLN  83          1HB       GLN  83 -11.505  -5.874 -19.856
  668   1HG   GLN  83          2HG       GLN  83 -11.234  -3.390 -20.446
  669   2HG   GLN  83          1HG       GLN  83  -9.619  -3.813 -21.014
  670   1HE2  GLN  83          2HE2      GLN  83 -11.617  -4.193 -24.042
  671   2HE2  GLN  83          1HE2      GLN  83 -10.879  -2.975 -23.119
  672    H    GLN  84           H        GLN  84 -12.229  -5.784 -17.076
  673    HA   GLN  84           HA       GLN  84 -14.086  -3.572 -17.445
  674   1HB   GLN  84          2HB       GLN  84 -14.212  -6.205 -16.031
  675   2HB   GLN  84          1HB       GLN  84 -15.430  -4.977 -15.720
  676   1HG   GLN  84          2HG       GLN  84 -15.980  -4.824 -18.077
  677   2HG   GLN  84          1HG       GLN  84 -14.656  -5.906 -18.495
  678   1HE2  GLN  84          2HE2      GLN  84 -16.857  -8.617 -18.344
  679   2HE2  GLN  84          1HE2      GLN  84 -15.692  -7.763 -19.223
  680    H    LEU  85           H        LEU  85 -11.847  -4.637 -14.971
  681    HA   LEU  85           HA       LEU  85 -12.916  -2.722 -13.005
  682   1HB   LEU  85          2HB       LEU  85 -11.530  -3.733 -11.494
  683   2HB   LEU  85          1HB       LEU  85 -11.453  -5.004 -12.709
  684    HG   LEU  85           HG       LEU  85  -9.514  -3.332 -13.621
  685   1HD1  LEU  85          3HD1      LEU  85 -10.083  -2.128 -11.275
  686   2HD1  LEU  85          2HD1      LEU  85  -8.894  -3.308 -10.718
  687   3HD1  LEU  85          1HD1      LEU  85  -8.461  -2.144 -11.971
  688   1HD2  LEU  85          3HD2      LEU  85  -9.727  -5.858 -12.409
  689   2HD2  LEU  85          2HD2      LEU  85  -8.393  -5.231 -13.377
  690   3HD2  LEU  85          1HD2      LEU  85  -8.376  -5.038 -11.624
  691    H    VAL  86           H        VAL  86 -10.343  -2.826 -15.412
  692    HA   VAL  86           HA       VAL  86  -9.225  -0.307 -14.534
  693    HB   VAL  86           HB       VAL  86  -8.076  -0.279 -16.702
  694   1HG1  VAL  86          2HG1      VAL  86  -8.167  -2.677 -14.991
  695   2HG1  VAL  86          1HG1      VAL  86  -7.498  -2.962 -16.596
  696   3HG1  VAL  86          3HG1      VAL  86  -6.777  -1.743 -15.545
  697   1HG2  VAL  86          1HG2      VAL  86 -10.026  -0.979 -18.056
  698   2HG2  VAL  86          3HG2      VAL  86  -8.607  -1.964 -18.414
  699   3HG2  VAL  86          2HG2      VAL  86  -9.888  -2.605 -17.389
  700    H    GLN  87           H        GLN  87 -11.922  -1.434 -16.289
  701    HA   GLN  87           HA       GLN  87 -12.585   0.963 -17.731
  702   1HB   GLN  87          2HB       GLN  87 -13.411  -1.348 -18.260
  703   2HB   GLN  87          1HB       GLN  87 -14.411  -1.262 -16.819
  704   1HG   GLN  87          2HG       GLN  87 -15.811   0.344 -17.701
  705   2HG   GLN  87          1HG       GLN  87 -14.575   0.982 -18.785
  706   1HE2  GLN  87          2HE2      GLN  87 -15.949  -2.653 -20.068
  707   2HE2  GLN  87          1HE2      GLN  87 -15.300  -2.489 -18.508
  708    H    HIS  88           H        HIS  88 -13.647  -0.472 -14.673
  709    HA   HIS  88           HA       HIS  88 -15.527   1.626 -14.085
  710   1HB   HIS  88          2HB       HIS  88 -15.386  -0.816 -13.166
  711   2HB   HIS  88          1HB       HIS  88 -14.263  -0.125 -12.002
  712    HD1  HIS  88           HD1      HIS  88 -17.870  -0.230 -12.926
  713    HD2  HIS  88           HD2      HIS  88 -15.448   1.833 -10.233
  714    HE1  HIS  88           HE1      HIS  88 -19.429   0.895 -11.278
  715    H    TYR  89           H        TYR  89 -12.238   0.859 -13.182
  716    HA   TYR  89           HA       TYR  89 -11.918   3.067 -11.369
  717   1HB   TYR  89          2HB       TYR  89  -9.976   1.260 -12.803
  718   2HB   TYR  89          1HB       TYR  89  -9.432   2.568 -11.761
  719    HD1  TYR  89           HD1      TYR  89 -12.070  -0.095 -11.645
  720    HD2  TYR  89           HD2      TYR  89  -8.871   1.898  -9.590
  721    HE1  TYR  89           HE1      TYR  89 -12.413  -1.568  -9.719
  722    HE2  TYR  89           HE2      TYR  89  -9.217   0.414  -7.634
  723    HH   TYR  89           HH       TYR  89 -11.313  -2.361  -7.781
  724    H    SER  90           H        SER  90 -11.963   2.748 -14.776
  725    HA   SER  90           HA       SER  90 -10.232   4.881 -15.513
  726   1HB   SER  90          2HB       SER  90 -12.026   3.097 -16.829
  727   2HB   SER  90          1HB       SER  90 -12.437   4.739 -17.328
  728    HG   SER  90           HG       SER  90 -10.793   4.514 -18.604
  729    H    GLU  91           H        GLU  91 -13.638   4.746 -14.618
  730    HA   GLU  91           HA       GLU  91 -13.838   7.697 -14.899
  731   1HB   GLU  91          2HB       GLU  91 -16.046   5.819 -14.041
  732   2HB   GLU  91          1HB       GLU  91 -16.195   7.422 -14.761
  733   1HG   GLU  91          2HG       GLU  91 -14.713   6.049 -16.647
  734   2HG   GLU  91          1HG       GLU  91 -15.828   4.815 -16.062
  735    H    ARG  92           H        ARG  92 -13.139   5.324 -12.567
  736    HA   ARG  92           HA       ARG  92 -13.551   7.360 -10.420
  737   1HB   ARG  92          2HB       ARG  92 -13.972   4.529  -9.636
  738   2HB   ARG  92          1HB       ARG  92 -14.784   5.986  -9.067
  739   1HG   ARG  92          2HG       ARG  92 -15.718   5.981 -11.575
  740   2HG   ARG  92          1HG       ARG  92 -15.425   4.250 -11.410
  741   1HD   ARG  92          2HD       ARG  92 -16.836   4.135  -9.448
  742   2HD   ARG  92          1HD       ARG  92 -16.995   5.891  -9.402
  743    HE   ARG  92           HE       ARG  92 -18.395   4.073 -11.253
  744   1HH1  ARG  92          1HH2      ARG  92 -18.581   5.522 -13.310
  745   2HH1  ARG  92          2HH2      ARG  92 -19.308   7.057 -12.968
  746   1HH2  ARG  92          2HH1      ARG  92 -18.844   6.812  -9.540
  747   2HH2  ARG  92          1HH1      ARG  92 -19.457   7.787 -10.835
  748    H    ALA  93           H        ALA  93 -11.953   7.316  -8.805
  749    HA   ALA  93           HA       ALA  93  -9.455   6.003  -9.565
  750   1HB   ALA  93          3HB       ALA  93 -10.173   7.639  -7.113
  751   2HB   ALA  93          2HB       ALA  93  -8.543   7.130  -7.553
  752   3HB   ALA  93          1HB       ALA  93  -9.423   8.259  -8.584
  753    H    ALA  94           H        ALA  94 -12.077   5.399  -7.356
  754    HA   ALA  94           HA       ALA  94 -12.555   3.391  -6.212
  755   1HB   ALA  94          1HB       ALA  94 -10.487   2.592  -7.906
  756   2HB   ALA  94          3HB       ALA  94  -9.903   2.178  -6.295
  757   3HB   ALA  94          2HB       ALA  94 -11.444   1.538  -6.865
  758    H    GLY  95           H        GLY  95 -10.157   5.664  -5.590
  759   1HA   GLY  95          2HA       GLY  95 -10.036   6.454  -3.243
  760   2HA   GLY  95          1HA       GLY  95 -10.048   4.764  -2.751
  761    H    LEU  96           H        LEU  96  -8.141   4.691  -5.398
  762    HA   LEU  96           HA       LEU  96  -5.707   4.860  -3.719
  763   1HB   LEU  96          2HB       LEU  96  -4.657   3.894  -5.899
  764   2HB   LEU  96          1HB       LEU  96  -5.724   2.863  -4.951
  765    HG   LEU  96           HG       LEU  96  -7.116   4.523  -6.938
  766   1HD1  LEU  96          3HD1      LEU  96  -4.756   3.002  -7.693
  767   2HD1  LEU  96          2HD1      LEU  96  -6.206   2.357  -8.462
  768   3HD1  LEU  96          1HD1      LEU  96  -5.770   4.052  -8.683
  769   1HD2  LEU  96          1HD2      LEU  96  -7.043   1.597  -6.121
  770   2HD2  LEU  96          3HD2      LEU  96  -8.262   2.794  -5.678
  771   3HD2  LEU  96          2HD2      LEU  96  -8.144   2.235  -7.348
  772    H    SER  97           H        SER  97  -3.833   5.443  -5.759
  773    HA   SER  97           HA       SER  97  -3.490   8.164  -5.636
  774   1HB   SER  97          2HB       SER  97  -2.003   6.351  -6.760
  775   2HB   SER  97          1HB       SER  97  -2.905   6.741  -8.225
  776    HG   SER  97           HG       SER  97  -0.909   8.095  -7.052
  777    H    SER  98           H        SER  98  -5.149   6.503  -8.321
  778    HA   SER  98           HA       SER  98  -7.295   8.314  -8.525
  779   1HB   SER  98          2HB       SER  98  -6.144  10.175  -9.192
  780   2HB   SER  98          1HB       SER  98  -4.777   9.239  -9.797
  781    HG   SER  98           HG       SER  98  -6.617  10.338 -11.228
  782    H    ARG  99           H        ARG  99  -8.581   7.931 -10.400
  783    HA   ARG  99           HA       ARG  99  -9.037   5.448 -11.317
  784   1HB   ARG  99          2HB       ARG  99  -9.671   6.529 -13.581
  785   2HB   ARG  99          1HB       ARG  99 -10.470   7.133 -12.129
  786   1HG   ARG  99          2HG       ARG  99  -8.611   8.888 -12.010
  787   2HG   ARG  99          1HG       ARG  99  -8.171   8.388 -13.643
  788   1HD   ARG  99          2HD       ARG  99 -10.607   8.797 -14.284
  789   2HD   ARG  99          1HD       ARG  99 -10.793   9.580 -12.714
  790    HE   ARG  99           HE       ARG  99  -9.102  10.582 -14.946
  791   1HH1  ARG  99          1HH1      ARG  99  -9.238  12.492 -11.541
  792   2HH1  ARG  99          2HH1      ARG  99  -8.973  10.783 -11.647
  793   1HH2  ARG  99          1HH2      ARG  99 -10.084  12.839 -14.885
  794   2HH2  ARG  99          2HH2      ARG  99  -9.867  13.655 -13.374
  795    H    LEU 100           H        LEU 100  -7.039   4.240 -11.433
  796    HA   LEU 100           HA       LEU 100  -4.993   3.541 -12.417
  797   1HB   LEU 100          2HB       LEU 100  -5.781   3.252 -15.074
  798   2HB   LEU 100          1HB       LEU 100  -5.995   2.066 -13.795
  799    HG   LEU 100           HG       LEU 100  -8.171   3.692 -13.384
  800   1HD1  LEU 100          3HD1      LEU 100  -7.186   4.104 -16.112
  801   2HD1  LEU 100          2HD1      LEU 100  -8.862   3.554 -16.054
  802   3HD1  LEU 100          1HD1      LEU 100  -8.385   5.023 -15.202
  803   1HD2  LEU 100          2HD2      LEU 100  -8.120   1.218 -13.528
  804   2HD2  LEU 100          1HD2      LEU 100  -9.455   1.911 -14.444
  805   3HD2  LEU 100          3HD2      LEU 100  -8.013   1.343 -15.284
  806    H    VAL 101           H        VAL 101  -4.156   3.926 -15.185
  807    HA   VAL 101           HA       VAL 101  -2.548   6.198 -14.955
  808    HB   VAL 101           HB       VAL 101  -2.689   6.121 -17.587
  809   1HG1  VAL 101          1HG1      VAL 101  -1.021   5.048 -15.798
  810   2HG1  VAL 101          3HG1      VAL 101  -1.726   3.553 -16.410
  811   3HG1  VAL 101          2HG1      VAL 101  -0.906   4.656 -17.513
  812   1HG2  VAL 101          3HG2      VAL 101  -4.795   4.408 -16.916
  813   2HG2  VAL 101          2HG2      VAL 101  -4.051   4.577 -18.506
  814   3HG2  VAL 101          1HG2      VAL 101  -3.483   3.331 -17.395
  815    H    VAL 102           H        VAL 102  -2.741   8.357 -15.703
  816    HA   VAL 102           HA       VAL 102  -5.480   9.381 -15.678
  817    HB   VAL 102           HB       VAL 102  -2.766  10.699 -15.815
  818   1HG1  VAL 102          3HG1      VAL 102  -5.458  11.791 -16.448
  819   2HG1  VAL 102          2HG1      VAL 102  -4.442  12.772 -15.391
  820   3HG1  VAL 102          1HG1      VAL 102  -3.871  12.326 -16.999
  821   1HG2  VAL 102          3HG2      VAL 102  -4.691   9.972 -13.759
  822   2HG2  VAL 102          2HG2      VAL 102  -3.021  10.513 -13.584
  823   3HG2  VAL 102          1HG2      VAL 102  -4.322  11.696 -13.722
  824    HA   PRO 103           HA       PRO 103  -4.313  10.527 -20.167
  825   1HB   PRO 103          2HB       PRO 103  -2.103   9.307 -21.253
  826   2HB   PRO 103          1HB       PRO 103  -2.054  10.876 -20.433
  827   1HG   PRO 103          2HG       PRO 103  -1.117   8.212 -19.467
  828   2HG   PRO 103          1HG       PRO 103  -0.561   9.828 -19.008
  829   1HD   PRO 103          2HD       PRO 103  -2.311   8.167 -17.515
  830   2HD   PRO 103          1HD       PRO 103  -1.983   9.883 -17.213
  831    H    SER 104           H        SER 104  -3.256   7.197 -19.390
  832    HA   SER 104           HA       SER 104  -3.863   5.148 -20.384
  833   1HB   SER 104          2HB       SER 104  -6.247   4.780 -20.445
  834   2HB   SER 104          1HB       SER 104  -5.919   5.855 -19.086
  835    HG   SER 104           HG       SER 104  -7.133   7.267 -20.013
  836    H    HIS 105           H        HIS 105  -2.552   6.451 -22.275
  837    HA   HIS 105           HA       HIS 105  -3.652   7.448 -24.573
  838   1HB   HIS 105          2HB       HIS 105  -1.299   5.779 -23.985
  839   2HB   HIS 105          1HB       HIS 105  -1.859   5.674 -25.656
  840    HD1  HIS 105           HD1      HIS 105   0.679   7.065 -25.653
  841    HD2  HIS 105           HD2      HIS 105  -2.804   9.110 -24.631
  842    HE1  HIS 105           HE1      HIS 105   1.177   9.528 -25.976
  843    H    LYS 106           HN       LYS 106  -4.897   6.728 -26.249
  844    HA   LYS 106           HA       LYS 106  -5.235   4.076 -27.109
  845   1HB   LYS 106          2HB       LYS 106  -6.323   4.220 -24.637
  846   2HB   LYS 106          1HB       LYS 106  -7.709   4.729 -25.600
  847   1HG   LYS 106          2HG       LYS 106  -6.761   2.589 -27.049
  848   2HG   LYS 106          1HG       LYS 106  -6.442   2.080 -25.391
  849   1HD   LYS 106          2HD       LYS 106  -8.635   1.354 -25.639
  850   2HD   LYS 106          1HD       LYS 106  -8.905   2.971 -24.989
  851   1HE   LYS 106          2HE       LYS 106  -9.031   3.802 -27.379
  852   2HE   LYS 106          1HE       LYS 106  -9.022   2.115 -27.892
  853   1HZ   LYS 106          3HZ       LYS 106 -10.943   1.901 -26.203
  854   2HZ   LYS 106          2HZ       LYS 106 -11.074   3.586 -26.380
  855   3HZ   LYS 106          1HZ       LYS 106 -11.256   2.570 -27.729
  856   1H    GLU 201          3HT       GLU 201   5.644  -0.075   7.699
  857   2H    GLU 201          2HT       GLU 201   5.890   1.547   8.142
  858   3H    GLU 201          1HT       GLU 201   4.524   0.708   8.705
  859    HA   GLU 201           HA       GLU 201   3.599   1.919   7.014
  860   1HB   GLU 201          2HB       GLU 201   6.364   1.772   5.967
  861   2HB   GLU 201          1HB       GLU 201   5.099   1.795   4.739
  862   1HG   GLU 201          2HG       GLU 201   5.622   4.085   5.163
  863   2HG   GLU 201          1HG       GLU 201   4.101   3.781   6.003
  864    HA   PRO 202           HA       PRO 202   2.004  -1.729   5.151
  865   1HB   PRO 202          2HB       PRO 202   0.268  -0.535   3.385
  866   2HB   PRO 202          1HB       PRO 202  -0.034  -0.650   5.127
  867   1HG   PRO 202          2HG       PRO 202   0.785   1.723   3.518
  868   2HG   PRO 202          1HG       PRO 202  -0.109   1.657   5.045
  869   1HD   PRO 202          2HD       PRO 202   2.637   2.287   4.756
  870   2HD   PRO 202          1HD       PRO 202   1.809   1.894   6.280
  871    H    GLN 203           H        GLN 203   3.029  -2.978   3.632
  872    HA   GLN 203           HA       GLN 203   4.857  -2.171   1.719
  873   1HB   GLN 203          2HB       GLN 203   2.984  -4.511   1.855
  874   2HB   GLN 203          1HB       GLN 203   3.948  -4.270   0.399
  875   1HG   GLN 203          2HG       GLN 203   5.834  -4.963   1.427
  876   2HG   GLN 203          1HG       GLN 203   5.539  -3.920   2.818
  877   1HE2  GLN 203          2HE2      GLN 203   3.316  -6.577   4.255
  878   2HE2  GLN 203          1HE2      GLN 203   3.075  -4.976   3.744
  879   1HN   PTR 204          1HN       PTR 204   1.968  -3.494   0.239
  880    HA   PTR 204           HA       PTR 204   2.057  -1.504  -1.870
  881   1HB   PTR 204          1HB       PTR 204  -0.233  -2.640  -2.428
  882    HD1  PTR 204           HD1      PTR 204   1.223  -2.314  -4.437
  883    HD2  PTR 204           HD2      PTR 204   1.974  -5.402  -1.547
  884    HE1  PTR 204           HE1      PTR 204   2.711  -3.467  -6.052
  885    HE2  PTR 204           HE2      PTR 204   3.464  -6.550  -3.160
  886    H    GLU 205           H        GLU 205  -0.444  -0.684  -2.402
  887    HA   GLU 205           HA       GLU 205  -1.145   0.946   0.001
  888   1HB   GLU 205          2HB       GLU 205  -0.995   1.497  -2.889
  889   2HB   GLU 205          1HB       GLU 205  -2.463   2.104  -2.121
  890   1HG   GLU 205          2HG       GLU 205  -0.203   2.635  -0.416
  891   2HG   GLU 205          1HG       GLU 205   0.121   3.257  -2.036
  892    H    GLU 206           H        GLU 206  -3.099   0.583   0.947
  893    HA   GLU 206           HA       GLU 206  -5.095  -1.028  -0.596
  894   1HB   GLU 206          2HB       GLU 206  -4.326  -1.028   2.316
  895   2HB   GLU 206          1HB       GLU 206  -5.918  -1.594   1.812
  896   1HG   GLU 206          2HG       GLU 206  -4.205  -2.838   0.016
  897   2HG   GLU 206          1HG       GLU 206  -3.313  -2.897   1.537
  898    H    ILE 207           H        ILE 207  -6.868   0.141  -1.132
  899    HA   ILE 207           HA       ILE 207  -7.366   2.776  -0.105
  900    HB   ILE 207           HB       ILE 207  -9.069   0.839  -1.690
  901   1HG1  ILE 207          2HG1      ILE 207  -8.559   3.163  -3.143
  902   2HG1  ILE 207          1HG1      ILE 207  -7.049   2.868  -2.278
  903   1HG2  ILE 207          3HG2      ILE 207 -10.428   2.442  -0.257
  904   2HG2  ILE 207          2HG2      ILE 207  -9.676   3.758  -1.158
  905   3HG2  ILE 207          1HG2      ILE 207 -10.692   2.585  -1.994
  906   1HD1  ILE 207          3HD1      ILE 207  -7.572   0.354  -3.087
  907   2HD1  ILE 207          2HD1      ILE 207  -8.377   1.237  -4.384
  908   3HD1  ILE 207          1HD1      ILE 207  -6.659   1.495  -4.076
  909    HA   PRO 208           HA       PRO 208  -9.502   1.628   3.592
  910   1HB   PRO 208          2HB       PRO 208 -10.495   4.123   4.179
  911   2HB   PRO 208          1HB       PRO 208  -8.808   3.652   4.452
  912   1HG   PRO 208          2HG       PRO 208  -9.945   5.403   2.324
  913   2HG   PRO 208          1HG       PRO 208  -8.317   5.395   3.018
  914   1HD   PRO 208          2HD       PRO 208  -9.061   4.284   0.524
  915   2HD   PRO 208          1HD       PRO 208  -7.529   4.003   1.378
  916    H    ILE 209           H        ILE 209 -11.853   2.278   4.544
  917    HA   ILE 209           HA       ILE 209 -13.835   2.418   2.335
  918    HB   ILE 209           HB       ILE 209 -13.750   0.259   4.463
  919   1HG1  ILE 209          2HG1      ILE 209 -14.038  -0.734   1.809
  920   2HG1  ILE 209          1HG1      ILE 209 -12.719   0.437   1.786
  921   1HG2  ILE 209          2HG2      ILE 209 -16.038   1.296   3.792
  922   2HG2  ILE 209          1HG2      ILE 209 -15.778   0.493   2.243
  923   3HG2  ILE 209          3HG2      ILE 209 -15.871  -0.458   3.726
  924   1HD1  ILE 209          2HD1      ILE 209 -11.979  -0.803   3.993
  925   2HD1  ILE 209          1HD1      ILE 209 -12.956  -2.119   3.340
  926   3HD1  ILE 209          3HD1      ILE 209 -11.586  -1.496   2.419
  927    H    TYR 210           H        TYR 210 -13.208   2.454   5.819
  928    HA   TYR 210           HA       TYR 210 -15.761   3.421   6.646
  929   1HB   TYR 210          2HB       TYR 210 -13.059   3.223   7.804
  930   2HB   TYR 210          1HB       TYR 210 -14.020   4.556   8.442
  931    HD1  TYR 210           HD1      TYR 210 -14.045   0.882   7.819
  932    HD2  TYR 210           HD2      TYR 210 -15.827   4.168   9.934
  933    HE1  TYR 210           HE1      TYR 210 -15.344  -0.714   9.203
  934    HE2  TYR 210           HE2      TYR 210 -17.126   2.573  11.318
  935    HH   TYR 210           HH       TYR 210 -16.878  -0.946  10.786
  936    H    LEU 211           HN       LEU 211 -15.448   5.797   7.937
  937    HA   LEU 211           HA       LEU 211 -15.541   7.699   5.737
  938   1HB   LEU 211          2HB       LEU 211 -16.531   7.588   8.373
  939   2HB   LEU 211          1HB       LEU 211 -15.404   8.945   8.348
  940    HG   LEU 211           HG       LEU 211 -17.566   9.793   7.693
  941   1HD1  LEU 211          1HD1      LEU 211 -15.311  10.135   6.219
  942   2HD1  LEU 211          3HD1      LEU 211 -16.399   9.508   4.981
  943   3HD1  LEU 211          2HD1      LEU 211 -16.827  10.967   5.873
  944   1HD2  LEU 211          2HD2      LEU 211 -17.548   7.416   5.827
  945   2HD2  LEU 211          1HD2      LEU 211 -18.752   7.836   7.046
  946   3HD2  LEU 211          3HD2      LEU 211 -18.620   8.792   5.569
   
  No H/Q in entry =         946
  Start of MODEL    4
    1   1H    SER   1          3HT       SER   1  -7.047 -10.113 -22.910
    2   2H    SER   1          2HT       SER   1  -8.038  -9.719 -24.233
    3   3H    SER   1          1HT       SER   1  -6.860 -10.934 -24.383
    4    HA   SER   1           HA       SER   1  -5.095  -9.334 -24.136
    5   1HB   SER   1          2HB       SER   1  -5.340  -8.253 -26.255
    6   2HB   SER   1          1HB       SER   1  -6.222  -9.774 -26.386
    7    HG   SER   1           HG       SER   1  -8.117  -8.714 -26.189
    8    H    ILE   2           H        ILE   2  -5.944  -8.434 -21.904
    9    HA   ILE   2           HA       ILE   2  -7.557  -6.207 -21.576
   10    HB   ILE   2           HB       ILE   2  -5.611  -5.471 -19.905
   11   1HG1  ILE   2          2HG1      ILE   2  -4.974  -8.395 -20.140
   12   2HG1  ILE   2          1HG1      ILE   2  -4.146  -7.253 -21.199
   13   1HG2  ILE   2          3HG2      ILE   2  -7.908  -7.031 -19.758
   14   2HG2  ILE   2          2HG2      ILE   2  -6.670  -8.052 -19.028
   15   3HG2  ILE   2          1HG2      ILE   2  -6.975  -6.439 -18.384
   16   1HD1  ILE   2          3HD1      ILE   2  -4.230  -6.289 -18.451
   17   2HD1  ILE   2          2HD1      ILE   2  -3.450  -7.867 -18.557
   18   3HD1  ILE   2          1HD1      ILE   2  -2.840  -6.516 -19.513
   19    H    GLN   3           H        GLN   3  -6.995  -3.874 -21.447
   20    HA   GLN   3           HA       GLN   3  -6.112  -2.738 -23.799
   21   1HB   GLN   3          2HB       GLN   3  -7.009  -1.672 -21.528
   22   2HB   GLN   3          1HB       GLN   3  -5.290  -1.348 -21.286
   23   1HG   GLN   3          2HG       GLN   3  -5.903   0.557 -22.460
   24   2HG   GLN   3          1HG       GLN   3  -5.451  -0.496 -23.800
   25   1HE2  GLN   3          2HE2      GLN   3  -8.657   0.242 -25.129
   26   2HE2  GLN   3          1HE2      GLN   3  -6.981   0.431 -25.312
   27    H    ALA   4           H        ALA   4  -4.045  -3.027 -20.919
   28    HA   ALA   4           HA       ALA   4  -1.715  -3.157 -20.728
   29   1HB   ALA   4          2HB       ALA   4  -2.462  -5.251 -22.140
   30   2HB   ALA   4          1HB       ALA   4  -1.629  -4.412 -23.448
   31   3HB   ALA   4          3HB       ALA   4  -0.749  -4.858 -21.985
   32    H    GLU   5           H        GLU   5   0.358  -2.423 -21.784
   33    HA   GLU   5           HA       GLU   5   1.596  -0.827 -22.984
   34   1HB   GLU   5          2HB       GLU   5  -0.476  -1.697 -24.781
   35   2HB   GLU   5          1HB       GLU   5  -0.219   0.036 -24.987
   36   1HG   GLU   5          2HG       GLU   5   2.308  -1.373 -24.694
   37   2HG   GLU   5          1HG       GLU   5   1.369  -2.022 -26.038
   38    H    GLU   6           H        GLU   6  -0.856  -0.211 -21.054
   39    HA   GLU   6           HA       GLU   6  -0.503   2.715 -21.280
   40   1HB   GLU   6          2HB       GLU   6  -3.297   1.643 -20.973
   41   2HB   GLU   6          1HB       GLU   6  -2.780   3.250 -21.482
   42   1HG   GLU   6          2HG       GLU   6  -2.027   2.413 -23.614
   43   2HG   GLU   6          1HG       GLU   6  -2.254   0.742 -23.098
   44    H    TRP   7           H        TRP   7  -2.441   0.286 -19.532
   45    HA   TRP   7           HA       TRP   7  -1.410   1.457 -16.989
   46   1HB   TRP   7          2HB       TRP   7  -3.661   0.708 -16.019
   47   2HB   TRP   7          1HB       TRP   7  -3.707   2.109 -17.090
   48    HD1  TRP   7           HD1      TRP   7  -5.038   1.912 -19.297
   49    HE1  TRP   7           HE1      TRP   7  -6.477   0.060 -20.368
   50    HE3  TRP   7           HE3      TRP   7  -3.855  -2.005 -16.241
   51    HZ2  TRP   7           HZ2      TRP   7  -7.049  -2.716 -19.979
   52    HZ3  TRP   7           HZ3      TRP   7  -4.858  -4.239 -16.616
   53    HH2  TRP   7           HH2      TRP   7  -6.453  -4.599 -18.479
   54    H    TYR   8           H        TYR   8  -0.899  -0.986 -18.863
   55    HA   TYR   8           HA       TYR   8  -0.431  -2.884 -16.669
   56   1HB   TYR   8          2HB       TYR   8  -2.563  -3.669 -17.195
   57   2HB   TYR   8          1HB       TYR   8  -2.383  -3.332 -18.915
   58    HD1  TYR   8           HD1      TYR   8  -0.486  -4.733 -20.138
   59    HD2  TYR   8           HD2      TYR   8  -2.324  -5.818 -16.414
   60    HE1  TYR   8           HE1      TYR   8   0.174  -7.099 -20.497
   61    HE2  TYR   8           HE2      TYR   8  -1.660  -8.169 -16.773
   62    HH   TYR   8           HH       TYR   8  -0.266  -9.249 -19.800
   63    H    PHE   9           H        PHE   9   1.561  -3.678 -16.978
   64    HA   PHE   9           HA       PHE   9   2.834  -3.323 -19.620
   65   1HB   PHE   9          2HB       PHE   9   3.822  -3.728 -16.812
   66   2HB   PHE   9          1HB       PHE   9   4.899  -4.028 -18.174
   67    HD1  PHE   9           HD1      PHE   9   2.205  -1.530 -18.437
   68    HD2  PHE   9           HD2      PHE   9   6.373  -2.133 -17.535
   69    HE1  PHE   9           HE1      PHE   9   2.610   0.906 -18.643
   70    HE2  PHE   9           HE2      PHE   9   6.765   0.304 -17.744
   71    HZ   PHE   9           HZ       PHE   9   4.886   1.822 -18.297
   72    H    GLY  10           H        GLY  10   1.984  -5.892 -17.338
   73   1HA   GLY  10          2HA       GLY  10   1.516  -8.019 -18.825
   74   2HA   GLY  10          1HA       GLY  10   3.232  -7.874 -19.163
   75    H    LYS  11           H        LYS  11   4.357  -9.254 -17.974
   76    HA   LYS  11           HA       LYS  11   3.404  -9.975 -15.247
   77   1HB   LYS  11          2HB       LYS  11   5.558 -11.346 -16.878
   78   2HB   LYS  11          1HB       LYS  11   4.691 -11.987 -15.482
   79   1HG   LYS  11          2HG       LYS  11   2.859 -12.551 -16.722
   80   2HG   LYS  11          1HG       LYS  11   2.973 -11.103 -17.725
   81   1HD   LYS  11          2HD       LYS  11   5.058 -13.248 -18.007
   82   2HD   LYS  11          1HD       LYS  11   3.482 -13.479 -18.766
   83   1HE   LYS  11          2HE       LYS  11   4.859 -10.849 -19.145
   84   2HE   LYS  11          1HE       LYS  11   5.455 -12.239 -20.054
   85   1HZ   LYS  11          1HZ       LYS  11   2.694 -12.310 -20.222
   86   2HZ   LYS  11          3HZ       LYS  11   3.130 -10.694 -20.497
   87   3HZ   LYS  11          2HZ       LYS  11   3.793 -11.928 -21.460
   88    H    LEU  12           H        LEU  12   4.243  -7.731 -14.773
   89    HA   LEU  12           HA       LEU  12   7.211  -7.731 -14.426
   90   1HB   LEU  12          2HB       LEU  12   6.097  -5.945 -15.859
   91   2HB   LEU  12          1HB       LEU  12   5.368  -5.335 -14.375
   92    HG   LEU  12           HG       LEU  12   7.531  -4.905 -13.408
   93   1HD1  LEU  12          1HD1      LEU  12   8.379  -6.794 -15.484
   94   2HD1  LEU  12          3HD1      LEU  12   9.414  -5.370 -15.394
   95   3HD1  LEU  12          2HD1      LEU  12   9.168  -6.368 -13.961
   96   1HD2  LEU  12          3HD2      LEU  12   6.759  -3.831 -16.012
   97   2HD2  LEU  12          2HD2      LEU  12   7.333  -2.986 -14.574
   98   3HD2  LEU  12          1HD2      LEU  12   8.490  -3.684 -15.708
   99    H    GLY  13           H        GLY  13   7.941  -6.422 -12.467
  100   1HA   GLY  13          2HA       GLY  13   6.161  -7.079 -10.158
  101   2HA   GLY  13          1HA       GLY  13   7.922  -7.042 -10.069
  102    H    ARG  14           H        ARG  14   7.533  -5.502  -8.260
  103    HA   ARG  14           HA       ARG  14   6.517  -2.833  -9.022
  104   1HB   ARG  14          2HB       ARG  14   6.918  -2.297  -6.631
  105   2HB   ARG  14          1HB       ARG  14   5.904  -3.726  -6.827
  106   1HG   ARG  14          2HG       ARG  14   7.377  -4.785  -5.475
  107   2HG   ARG  14          1HG       ARG  14   8.491  -4.750  -6.842
  108   1HD   ARG  14          2HD       ARG  14   8.869  -2.248  -5.891
  109   2HD   ARG  14          1HD       ARG  14   8.444  -3.070  -4.390
  110    HE   ARG  14           HE       ARG  14  10.704  -3.940  -6.150
  111   1HH1  ARG  14          2HH1      ARG  14   9.938  -5.955  -4.158
  112   2HH1  ARG  14          1HH1      ARG  14  10.898  -5.535  -2.778
  113   1HH2  ARG  14          1HH2      ARG  14  11.610  -2.338  -3.916
  114   2HH2  ARG  14          2HH2      ARG  14  11.844  -3.487  -2.641
  115    H    LYS  15           H        LYS  15   9.536  -4.479  -8.666
  116    HA   LYS  15           HA       LYS  15  11.142  -2.129  -8.251
  117   1HB   LYS  15          2HB       LYS  15  11.705  -4.640  -7.755
  118   2HB   LYS  15          1HB       LYS  15  12.214  -4.665  -9.444
  119   1HG   LYS  15          2HG       LYS  15  13.515  -2.475  -8.787
  120   2HG   LYS  15          1HG       LYS  15  13.349  -3.096  -7.145
  121   1HD   LYS  15          2HD       LYS  15  14.306  -4.955  -9.293
  122   2HD   LYS  15          1HD       LYS  15  15.436  -3.772  -8.635
  123   1HE   LYS  15          2HE       LYS  15  15.045  -4.600  -6.373
  124   2HE   LYS  15          1HE       LYS  15  13.810  -5.713  -6.964
  125   1HZ   LYS  15          3HZ       LYS  15  16.222  -6.035  -8.414
  126   2HZ   LYS  15          2HZ       LYS  15  16.519  -6.189  -6.748
  127   3HZ   LYS  15          1HZ       LYS  15  15.362  -7.178  -7.503
  128    H    ASP  16           H        ASP  16  10.231  -4.111 -11.043
  129    HA   ASP  16           HA       ASP  16  11.815  -2.563 -12.867
  130   1HB   ASP  16          2HB       ASP  16  10.858  -5.004 -13.045
  131   2HB   ASP  16          1HB       ASP  16   9.456  -4.172 -13.695
  132    H    ALA  17           H        ALA  17   8.495  -2.622 -11.758
  133    HA   ALA  17           HA       ALA  17   7.379  -0.830 -13.663
  134   1HB   ALA  17          3HB       ALA  17   6.654  -1.438 -10.794
  135   2HB   ALA  17          2HB       ALA  17   5.706  -0.340 -11.797
  136   3HB   ALA  17          1HB       ALA  17   5.872  -2.035 -12.257
  137    H    GLU  18           H        GLU  18   9.113  -0.253 -10.640
  138    HA   GLU  18           HA       GLU  18   8.679   2.620 -10.691
  139   1HB   GLU  18          2HB       GLU  18  10.444   2.660  -8.938
  140   2HB   GLU  18          1HB       GLU  18   9.186   1.477  -8.583
  141   1HG   GLU  18          2HG       GLU  18  10.566  -0.341  -9.316
  142   2HG   GLU  18          1HG       GLU  18  11.750   0.759 -10.024
  143    H    ARG  19           H        ARG  19  11.169   0.421 -11.895
  144    HA   ARG  19           HA       ARG  19  13.009   2.558 -12.621
  145   1HB   ARG  19          2HB       ARG  19  13.033  -0.304 -12.575
  146   2HB   ARG  19          1HB       ARG  19  13.491   0.228 -14.193
  147   1HG   ARG  19          2HG       ARG  19  14.843   1.979 -12.488
  148   2HG   ARG  19          1HG       ARG  19  14.987   0.409 -11.697
  149   1HD   ARG  19          2HD       ARG  19  15.382   0.127 -14.549
  150   2HD   ARG  19          1HD       ARG  19  16.480   1.346 -13.901
  151    HE   ARG  19           HE       ARG  19  16.635  -0.811 -12.123
  152   1HH1  ARG  19          2HH1      ARG  19  16.255  -2.629 -14.380
  153   2HH1  ARG  19          1HH1      ARG  19  17.846  -2.784 -15.047
  154   1HH2  ARG  19          1HH2      ARG  19  19.077   0.038 -13.453
  155   2HH2  ARG  19          2HH2      ARG  19  19.444  -1.273 -14.522
  156    H    GLN  20           H        GLN  20  10.235   1.093 -14.119
  157    HA   GLN  20           HA       GLN  20  10.965   1.969 -16.822
  158   1HB   GLN  20          2HB       GLN  20   9.305   0.004 -15.927
  159   2HB   GLN  20          1HB       GLN  20   8.138   1.291 -16.225
  160   1HG   GLN  20          2HG       GLN  20   8.514  -0.146 -18.232
  161   2HG   GLN  20          1HG       GLN  20   8.943   1.540 -18.518
  162   1HE2  GLN  20          2HE2      GLN  20  12.135  -0.977 -17.854
  163   2HE2  GLN  20          1HE2      GLN  20  10.760  -1.108 -16.868
  164    H    LEU  21           H        LEU  21   8.794   3.005 -14.220
  165    HA   LEU  21           HA       LEU  21   7.682   5.217 -15.733
  166   1HB   LEU  21          2HB       LEU  21   7.566   4.223 -12.933
  167   2HB   LEU  21          1HB       LEU  21   7.229   5.934 -13.176
  168    HG   LEU  21           HG       LEU  21   5.406   5.471 -14.640
  169   1HD1  LEU  21          1HD1      LEU  21   6.594   3.676 -15.918
  170   2HD1  LEU  21          3HD1      LEU  21   6.253   2.558 -14.597
  171   3HD1  LEU  21          2HD1      LEU  21   4.927   3.251 -15.530
  172   1HD2  LEU  21          2HD2      LEU  21   5.006   5.007 -12.201
  173   2HD2  LEU  21          1HD2      LEU  21   3.940   4.102 -13.274
  174   3HD2  LEU  21          3HD2      LEU  21   5.320   3.303 -12.523
  175    H    LEU  22           H        LEU  22  10.016   5.033 -13.042
  176    HA   LEU  22           HA       LEU  22  10.750   7.770 -13.033
  177   1HB   LEU  22          2HB       LEU  22  12.238   5.255 -12.264
  178   2HB   LEU  22          1HB       LEU  22  12.972   6.850 -12.098
  179    HG   LEU  22           HG       LEU  22  10.270   6.833 -11.032
  180   1HD1  LEU  22          3HD1      LEU  22  12.079   4.587 -10.333
  181   2HD1  LEU  22          2HD1      LEU  22  11.339   5.427  -8.971
  182   3HD1  LEU  22          1HD1      LEU  22  10.323   4.697 -10.213
  183   1HD2  LEU  22          3HD2      LEU  22  12.315   8.394 -10.645
  184   2HD2  LEU  22          2HD2      LEU  22  11.298   7.998  -9.260
  185   3HD2  LEU  22          1HD2      LEU  22  12.838   7.168  -9.489
  186    H    SER  23           H        SER  23  12.114   5.031 -14.875
  187    HA   SER  23           HA       SER  23  14.297   6.215 -16.100
  188   1HB   SER  23          2HB       SER  23  12.298   4.190 -16.953
  189   2HB   SER  23          1HB       SER  23  13.261   4.916 -18.240
  190    HG   SER  23           HG       SER  23  15.118   4.420 -16.877
  191    H    PHE  24           H        PHE  24  11.129   6.162 -17.767
  192    HA   PHE  24           HA       PHE  24  10.914   8.964 -18.163
  193   1HB   PHE  24          2HB       PHE  24  13.087   8.344 -19.476
  194   2HB   PHE  24          1HB       PHE  24  11.974   7.667 -20.664
  195    HD1  PHE  24           HD1      PHE  24  12.224  10.758 -18.536
  196    HD2  PHE  24           HD2      PHE  24  11.352   9.086 -22.395
  197    HE1  PHE  24           HE1      PHE  24  11.786  13.033 -19.422
  198    HE2  PHE  24           HE2      PHE  24  10.915  11.361 -23.282
  199    HZ   PHE  24           HZ       PHE  24  11.131  13.333 -21.796
  200    H    GLY  25           H        GLY  25   8.782   9.178 -18.634
  201   1HA   GLY  25          2HA       GLY  25   7.489   7.840 -20.810
  202   2HA   GLY  25          1HA       GLY  25   7.072   7.029 -19.302
  203    H    ASN  26           H        ASN  26   7.169   9.446 -17.683
  204    HA   ASN  26           HA       ASN  26   5.709  11.643 -18.516
  205   1HB   ASN  26          2HB       ASN  26   4.075   9.224 -18.543
  206   2HB   ASN  26          1HB       ASN  26   3.397  10.469 -17.494
  207   1HD2  ASN  26          2HD2      ASN  26   1.968  11.758 -20.488
  208   2HD2  ASN  26          1HD2      ASN  26   1.657  10.941 -19.033
  209    HA   PRO  27           HA       PRO  27   5.952  12.451 -14.210
  210   1HB   PRO  27          2HB       PRO  27   4.033  14.406 -13.968
  211   2HB   PRO  27          1HB       PRO  27   5.614  14.673 -14.718
  212   1HG   PRO  27          2HG       PRO  27   2.936  14.381 -16.010
  213   2HG   PRO  27          1HG       PRO  27   4.369  15.244 -16.589
  214   1HD   PRO  27          2HD       PRO  27   3.493  12.690 -17.458
  215   2HD   PRO  27          1HD       PRO  27   5.079  13.418 -17.788
  216    H    ARG  28           H        ARG  28   3.957  13.188 -12.413
  217    HA   ARG  28           HA       ARG  28   2.850  10.822 -11.497
  218   1HB   ARG  28          2HB       ARG  28   2.780  12.974 -10.254
  219   2HB   ARG  28          1HB       ARG  28   1.514  13.542 -11.343
  220   1HG   ARG  28          2HG       ARG  28   0.007  11.804 -10.607
  221   2HG   ARG  28          1HG       ARG  28   1.286  11.015  -9.685
  222   1HD   ARG  28          2HD       ARG  28   1.092  12.469  -7.942
  223   2HD   ARG  28          1HD       ARG  28   0.857  13.858  -9.005
  224    HE   ARG  28           HE       ARG  28  -1.463  12.139  -9.034
  225   1HH1  ARG  28          2HH1      ARG  28  -0.008  13.347  -6.320
  226   2HH1  ARG  28          1HH1      ARG  28  -1.281  14.433  -5.877
  227   1HH2  ARG  28          1HH2      ARG  28  -3.012  14.041  -8.856
  228   2HH2  ARG  28          2HH2      ARG  28  -2.982  14.827  -7.313
  229    H    GLY  29           H        GLY  29   0.641   9.948 -11.625
  230   1HA   GLY  29          2HA       GLY  29  -1.481   9.667 -12.718
  231   2HA   GLY  29          1HA       GLY  29  -0.967  10.811 -13.955
  232    H    THR  30           H        THR  30   1.520   8.638 -13.332
  233    HA   THR  30           HA       THR  30   0.816   7.118 -15.791
  234    HB   THR  30           HB       THR  30   3.508   6.899 -14.516
  235    HG1  THR  30           HG1      THR  30   2.334   9.223 -15.470
  236   1HG2  THR  30          1HG2      THR  30   2.225   6.504 -17.110
  237   2HG2  THR  30          3HG2      THR  30   3.715   7.439 -17.232
  238   3HG2  THR  30          2HG2      THR  30   3.737   5.837 -16.495
  239    H    PHE  31           H        PHE  31  -0.722   6.032 -14.035
  240    HA   PHE  31           HA       PHE  31   0.686   4.024 -12.400
  241   1HB   PHE  31          2HB       PHE  31  -2.277   3.960 -12.820
  242   2HB   PHE  31          1HB       PHE  31  -1.352   3.643 -11.356
  243    HD1  PHE  31           HD1      PHE  31   0.425   6.114 -11.456
  244    HD2  PHE  31           HD2      PHE  31  -3.807   5.600 -11.981
  245    HE1  PHE  31           HE1      PHE  31   0.048   8.443 -10.699
  246    HE2  PHE  31           HE2      PHE  31  -4.184   7.931 -11.226
  247    HZ   PHE  31           HZ       PHE  31  -2.256   9.353 -10.583
  248    H    LEU  32           H        LEU  32   0.714   1.801 -12.870
  249    HA   LEU  32           HA       LEU  32  -0.576   0.986 -15.427
  250   1HB   LEU  32          2HB       LEU  32   1.486  -0.328 -15.982
  251   2HB   LEU  32          1HB       LEU  32   1.740   1.415 -15.997
  252    HG   LEU  32           HG       LEU  32   2.499   1.169 -13.563
  253   1HD1  LEU  32          2HD1      LEU  32   2.181  -1.688 -14.415
  254   2HD1  LEU  32          1HD1      LEU  32   3.504  -1.274 -13.326
  255   3HD1  LEU  32          3HD1      LEU  32   1.838  -0.945 -12.852
  256   1HD2  LEU  32          1HD2      LEU  32   3.915   0.321 -16.033
  257   2HD2  LEU  32          3HD2      LEU  32   4.320   1.598 -14.886
  258   3HD2  LEU  32          2HD2      LEU  32   4.705  -0.081 -14.508
  259    H    ILE  33           H        ILE  33   0.254  -1.637 -15.488
  260    HA   ILE  33           HA       ILE  33  -0.576  -2.768 -12.855
  261    HB   ILE  33           HB       ILE  33  -1.836  -3.169 -15.564
  262   1HG1  ILE  33          2HG1      ILE  33  -2.824  -2.706 -12.745
  263   2HG1  ILE  33          1HG1      ILE  33  -2.948  -1.613 -14.125
  264   1HG2  ILE  33          3HG2      ILE  33  -1.194  -5.428 -14.805
  265   2HG2  ILE  33          2HG2      ILE  33  -1.990  -5.131 -13.261
  266   3HG2  ILE  33          1HG2      ILE  33  -2.940  -5.202 -14.741
  267   1HD1  ILE  33          2HD1      ILE  33  -4.116  -4.090 -14.902
  268   2HD1  ILE  33          1HD1      ILE  33  -4.772  -3.676 -13.319
  269   3HD1  ILE  33          3HD1      ILE  33  -4.925  -2.542 -14.660
  270    H    ARG  34           H        ARG  34  -0.175  -5.282 -12.967
  271    HA   ARG  34           HA       ARG  34   1.578  -6.475 -14.818
  272   1HB   ARG  34          2HB       ARG  34   3.689  -6.252 -13.194
  273   2HB   ARG  34          1HB       ARG  34   3.387  -5.082 -14.478
  274   1HG   ARG  34          2HG       ARG  34   2.583  -3.464 -12.991
  275   2HG   ARG  34          1HG       ARG  34   2.173  -4.658 -11.759
  276   1HD   ARG  34          2HD       ARG  34   5.043  -4.384 -12.556
  277   2HD   ARG  34          1HD       ARG  34   4.345  -3.130 -11.532
  278    HE   ARG  34           HE       ARG  34   4.787  -5.945 -10.766
  279   1HH1  ARG  34          2HH1      ARG  34   4.639  -2.784  -9.720
  280   2HH1  ARG  34          1HH1      ARG  34   3.845  -3.121  -8.219
  281   1HH2  ARG  34          1HH2      ARG  34   3.204  -6.438  -8.995
  282   2HH2  ARG  34          2HH2      ARG  34   3.030  -5.188  -7.810
  283    H    GLU  35           H        GLU  35   2.593  -8.474 -13.918
  284    HA   GLU  35           HA       GLU  35   0.816  -9.675 -11.952
  285   1HB   GLU  35          2HB       GLU  35   1.651 -11.672 -12.704
  286   2HB   GLU  35          1HB       GLU  35   2.152 -10.678 -14.058
  287   1HG   GLU  35          2HG       GLU  35   4.387 -10.463 -13.158
  288   2HG   GLU  35          1HG       GLU  35   3.908 -11.249 -11.654
  289    H    SER  36           H        SER  36   1.151  -9.757  -9.755
  290    HA   SER  36           HA       SER  36   3.555  -8.575  -8.621
  291   1HB   SER  36          2HB       SER  36   1.237 -10.032  -7.314
  292   2HB   SER  36          1HB       SER  36   2.505  -9.173  -6.454
  293    HG   SER  36           HG       SER  36   0.803  -7.778  -6.701
  294    H    GLU  37           H        GLU  37   5.382  -9.672  -8.119
  295    HA   GLU  37           HA       GLU  37   5.385 -12.624  -8.312
  296   1HB   GLU  37          2HB       GLU  37   7.615 -10.636  -7.824
  297   2HB   GLU  37          1HB       GLU  37   7.835 -12.369  -8.060
  298   1HG   GLU  37          2HG       GLU  37   6.235 -10.985 -10.139
  299   2HG   GLU  37          1HG       GLU  37   7.944 -10.556 -10.087
  300    H    THR  38           H        THR  38   4.310 -10.749  -6.043
  301    HA   THR  38           HA       THR  38   5.925 -11.518  -3.738
  302    HB   THR  38           HB       THR  38   4.423  -9.411  -4.046
  303    HG1  THR  38           HG1      THR  38   3.942  -9.520  -1.746
  304   1HG2  THR  38          3HG2      THR  38   2.380 -10.683  -4.651
  305   2HG2  THR  38          2HG2      THR  38   2.370 -11.397  -3.039
  306   3HG2  THR  38          1HG2      THR  38   2.131  -9.661  -3.236
  307    H    THR  39           H        THR  39   2.818 -12.437  -5.148
  308    HA   THR  39           HA       THR  39   2.736 -14.745  -3.238
  309    HB   THR  39           HB       THR  39   0.757 -13.100  -3.486
  310    HG1  THR  39           HG1      THR  39  -0.678 -15.100  -3.670
  311   1HG2  THR  39          1HG2      THR  39   1.066 -13.661  -6.157
  312   2HG2  THR  39          3HG2      THR  39  -0.265 -14.727  -5.711
  313   3HG2  THR  39          2HG2      THR  39  -0.395 -12.991  -5.433
  314    H    LYS  40           H        LYS  40   1.287 -16.595  -4.569
  315    HA   LYS  40           HA       LYS  40   3.031 -17.979  -6.202
  316   1HB   LYS  40          2HB       LYS  40   0.090 -17.943  -6.850
  317   2HB   LYS  40          1HB       LYS  40   1.204 -19.309  -6.893
  318   1HG   LYS  40          2HG       LYS  40   0.025 -17.928  -4.480
  319   2HG   LYS  40          1HG       LYS  40  -0.106 -19.627  -4.930
  320   1HD   LYS  40          2HD       LYS  40   2.253 -19.987  -4.484
  321   2HD   LYS  40          1HD       LYS  40   2.505 -18.265  -4.206
  322   1HE   LYS  40          2HE       LYS  40   2.229 -19.768  -2.125
  323   2HE   LYS  40          1HE       LYS  40   1.262 -18.295  -2.189
  324   1HZ   LYS  40          2HZ       LYS  40   0.227 -20.861  -3.222
  325   2HZ   LYS  40          1HZ       LYS  40   0.088 -20.452  -1.579
  326   3HZ   LYS  40          3HZ       LYS  40  -0.641 -19.477  -2.759
  327    H    GLY  41           H        GLY  41   0.779 -15.439  -7.093
  328   1HA   GLY  41          2HA       GLY  41   2.186 -14.231  -9.105
  329   2HA   GLY  41          1HA       GLY  41   1.404 -15.582  -9.935
  330    H    ALA  42           H        ALA  42   0.689 -12.854  -7.781
  331    HA   ALA  42           HA       ALA  42  -2.142 -12.824  -8.622
  332   1HB   ALA  42          3HB       ALA  42  -0.468 -11.489  -6.534
  333   2HB   ALA  42          2HB       ALA  42  -1.905 -10.633  -7.095
  334   3HB   ALA  42          1HB       ALA  42  -2.059 -12.237  -6.379
  335    H    TYR  43           H        TYR  43  -2.591 -10.061  -8.700
  336    HA   TYR  43           HA       TYR  43  -0.934  -9.330 -11.068
  337   1HB   TYR  43          2HB       TYR  43  -3.786  -9.337 -10.686
  338   2HB   TYR  43          1HB       TYR  43  -3.231  -7.693 -11.015
  339    HD1  TYR  43           HD1      TYR  43  -1.022  -7.857 -12.749
  340    HD2  TYR  43           HD2      TYR  43  -4.489 -10.404 -12.643
  341    HE1  TYR  43           HE1      TYR  43  -0.650  -8.485 -15.128
  342    HE2  TYR  43           HE2      TYR  43  -4.111 -11.029 -15.011
  343    HH   TYR  43           HH       TYR  43  -2.983 -10.073 -17.005
  344    H    SER  44           H        SER  44  -1.437  -6.640 -11.228
  345    HA   SER  44           HA       SER  44  -1.056  -5.434  -8.585
  346   1HB   SER  44          2HB       SER  44   1.163  -6.259  -8.893
  347   2HB   SER  44          1HB       SER  44   1.185  -5.692 -10.563
  348    HG   SER  44           HG       SER  44   1.213  -4.175  -8.184
  349    H    LEU  45           H        LEU  45  -0.620  -3.116  -8.758
  350    HA   LEU  45           HA       LEU  45  -1.294  -1.855 -11.349
  351   1HB   LEU  45          2HB       LEU  45  -3.499  -2.074 -10.425
  352   2HB   LEU  45          1HB       LEU  45  -2.947  -1.567  -8.827
  353    HG   LEU  45           HG       LEU  45  -2.381   0.664  -9.747
  354   1HD1  LEU  45          2HD1      LEU  45  -2.717  -0.750 -12.229
  355   2HD1  LEU  45          1HD1      LEU  45  -3.840   0.608 -12.183
  356   3HD1  LEU  45          3HD1      LEU  45  -2.112   0.887 -11.971
  357   1HD2  LEU  45          3HD2      LEU  45  -5.135  -0.475  -9.894
  358   2HD2  LEU  45          2HD2      LEU  45  -4.496   0.786  -8.840
  359   3HD2  LEU  45          1HD2      LEU  45  -4.887   1.154 -10.520
  360    H    SER  46           H        SER  46   0.801  -0.943 -11.290
  361    HA   SER  46           HA       SER  46   1.840   0.396  -8.956
  362   1HB   SER  46          2HB       SER  46   3.444  -0.359 -10.544
  363   2HB   SER  46          1HB       SER  46   2.631   0.478 -11.861
  364    HG   SER  46           HG       SER  46   4.580   1.406 -10.490
  365    H    ILE  47           H        ILE  47   2.484   2.765  -9.124
  366    HA   ILE  47           HA       ILE  47   0.595   4.470 -10.613
  367    HB   ILE  47           HB       ILE  47  -0.818   4.065  -8.765
  368   1HG1  ILE  47          2HG1      ILE  47   0.251   6.601  -9.221
  369   2HG1  ILE  47          1HG1      ILE  47  -1.224   6.248  -8.331
  370   1HG2  ILE  47          1HG2      ILE  47   0.843   2.904  -7.373
  371   2HG2  ILE  47          3HG2      ILE  47   1.611   4.444  -6.989
  372   3HG2  ILE  47          2HG2      ILE  47  -0.028   4.112  -6.427
  373   1HD1  ILE  47          1HD1      ILE  47   1.426   6.148  -6.909
  374   2HD1  ILE  47          3HD1      ILE  47   0.645   7.701  -7.201
  375   3HD1  ILE  47          2HD1      ILE  47  -0.178   6.465  -6.250
  376    H    ARG  48           H        ARG  48   2.349   5.540 -11.548
  377    HA   ARG  48           HA       ARG  48   4.698   6.385 -10.169
  378   1HB   ARG  48          2HB       ARG  48   3.919   6.418 -12.767
  379   2HB   ARG  48          1HB       ARG  48   3.699   8.120 -12.361
  380   1HG   ARG  48          2HG       ARG  48   6.234   6.668 -11.614
  381   2HG   ARG  48          1HG       ARG  48   6.030   7.365 -13.221
  382   1HD   ARG  48          2HD       ARG  48   5.272   9.162 -11.006
  383   2HD   ARG  48          1HD       ARG  48   6.984   8.741 -11.052
  384    HE   ARG  48           HE       ARG  48   5.512  10.226 -13.155
  385   1HH1  ARG  48          2HH1      ARG  48   7.878   8.028 -13.509
  386   2HH1  ARG  48          1HH1      ARG  48   9.145   9.122 -13.950
  387   1HH2  ARG  48          1HH2      ARG  48   7.362  11.961 -13.065
  388   2HH2  ARG  48          2HH2      ARG  48   8.853  11.350 -13.698
  389    H    ASP  49           H        ASP  49   5.171   8.299  -9.050
  390    HA   ASP  49           HA       ASP  49   3.039  10.353  -8.863
  391   1HB   ASP  49          2HB       ASP  49   2.505   8.854  -7.027
  392   2HB   ASP  49          1HB       ASP  49   4.182   8.862  -6.483
  393    H    TRP  50           H        TRP  50   5.265  10.927 -10.212
  394    HA   TRP  50           HA       TRP  50   7.546  11.769  -8.700
  395   1HB   TRP  50          2HB       TRP  50   7.844  11.665 -11.061
  396   2HB   TRP  50          1HB       TRP  50   6.398  12.624 -11.367
  397    HD1  TRP  50           HD1      TRP  50  10.076  12.955 -10.810
  398    HE1  TRP  50           HE1      TRP  50  10.732  15.446 -10.681
  399    HE3  TRP  50           HE3      TRP  50   5.460  15.024 -10.554
  400    HZ2  TRP  50           HZ2      TRP  50   9.434  17.998 -10.548
  401    HZ3  TRP  50           HZ3      TRP  50   5.171  17.486 -10.437
  402    HH2  TRP  50           HH2      TRP  50   7.154  18.976 -10.433
  403    H    ASP  51           H        ASP  51   8.127  14.053  -8.223
  404    HA   ASP  51           HA       ASP  51   5.838  15.900  -7.873
  405   1HB   ASP  51          2HB       ASP  51   6.182  14.439  -5.775
  406   2HB   ASP  51          1HB       ASP  51   7.686  15.335  -5.552
  407    H    ASP  52           H        ASP  52   6.561  18.120  -7.478
  408    HA   ASP  52           HA       ASP  52   9.163  18.652  -8.754
  409   1HB   ASP  52          2HB       ASP  52   6.747  19.939  -8.856
  410   2HB   ASP  52          1HB       ASP  52   7.621  20.929  -7.687
  411    H    MET  53           H        MET  53   9.438  17.416  -6.230
  412    HA   MET  53           HA       MET  53  11.101  19.384  -4.932
  413   1HB   MET  53          2HB       MET  53   9.881  18.898  -2.663
  414   2HB   MET  53          1HB       MET  53   9.240  20.136  -3.742
  415   1HG   MET  53          2HG       MET  53   7.287  19.017  -3.778
  416   2HG   MET  53          1HG       MET  53   8.105  17.687  -4.595
  417   1HE   MET  53          2HE       MET  53   9.234  16.046  -3.808
  418   2HE   MET  53          1HE       MET  53   9.345  15.370  -2.184
  419   3HE   MET  53          3HE       MET  53   7.908  15.073  -3.173
  420    H    LYS  54           H        LYS  54  11.322  16.668  -6.134
  421    HA   LYS  54           HA       LYS  54  13.129  15.547  -4.271
  422   1HB   LYS  54          2HB       LYS  54  11.923  13.636  -3.429
  423   2HB   LYS  54          1HB       LYS  54  10.969  15.074  -3.064
  424   1HG   LYS  54          2HG       LYS  54   9.568  14.677  -5.034
  425   2HG   LYS  54          1HG       LYS  54  10.555  13.285  -5.478
  426   1HD   LYS  54          2HD       LYS  54   9.874  12.070  -3.519
  427   2HD   LYS  54          1HD       LYS  54   9.105  13.497  -2.828
  428   1HE   LYS  54          2HE       LYS  54   7.612  13.496  -4.925
  429   2HE   LYS  54          1HE       LYS  54   8.216  11.864  -5.209
  430   1HZ   LYS  54          2HZ       LYS  54   7.449  12.150  -2.508
  431   2HZ   LYS  54          1HZ       LYS  54   6.166  12.633  -3.512
  432   3HZ   LYS  54          3HZ       LYS  54   6.839  11.085  -3.682
  433    H    GLY  55           H        GLY  55  11.049  15.074  -7.077
  434   1HA   GLY  55          2HA       GLY  55  12.323  14.320  -9.105
  435   2HA   GLY  55          1HA       GLY  55  13.012  13.094  -8.052
  436    H    ASP  56           H        ASP  56  12.001  11.680  -9.825
  437    HA   ASP  56           HA       ASP  56   9.081  11.461  -9.717
  438   1HB   ASP  56          2HB       ASP  56  10.716   9.309 -10.973
  439   2HB   ASP  56          1HB       ASP  56   9.277  10.125 -11.572
  440    H    HIS  57           H        HIS  57   8.196   9.139  -9.381
  441    HA   HIS  57           HA       HIS  57   9.673   7.391  -7.598
  442   1HB   HIS  57          2HB       HIS  57   7.661   9.330  -6.518
  443   2HB   HIS  57          1HB       HIS  57   7.712   7.708  -5.835
  444    HD1  HIS  57           HD1      HIS  57   8.639  10.300  -4.266
  445    HD2  HIS  57           HD2      HIS  57  11.173   7.648  -6.246
  446    HE1  HIS  57           HE1      HIS  57  10.921  10.558  -3.199
  447    H    VAL  58           H        VAL  58   7.825   5.775  -6.649
  448    HA   VAL  58           HA       VAL  58   5.558   5.478  -8.461
  449    HB   VAL  58           HB       VAL  58   8.083   3.929  -8.806
  450   1HG1  VAL  58          2HG1      VAL  58   5.296   2.758  -9.094
  451   2HG1  VAL  58          1HG1      VAL  58   6.711   2.087  -9.909
  452   3HG1  VAL  58          3HG1      VAL  58   6.637   2.111  -8.147
  453   1HG2  VAL  58          3HG2      VAL  58   5.882   5.020 -10.545
  454   2HG2  VAL  58          2HG2      VAL  58   7.589   5.467 -10.525
  455   3HG2  VAL  58          1HG2      VAL  58   7.092   3.903 -11.176
  456    H    LYS  59           H        LYS  59   3.967   4.461  -7.389
  457    HA   LYS  59           HA       LYS  59   4.680   2.911  -4.935
  458   1HB   LYS  59          2HB       LYS  59   2.932   5.064  -5.220
  459   2HB   LYS  59          1HB       LYS  59   1.863   3.661  -5.241
  460   1HG   LYS  59          2HG       LYS  59   2.015   3.869  -2.965
  461   2HG   LYS  59          1HG       LYS  59   3.508   2.961  -3.203
  462   1HD   LYS  59          2HD       LYS  59   4.488   4.715  -2.133
  463   2HD   LYS  59          1HD       LYS  59   4.344   5.529  -3.692
  464   1HE   LYS  59          2HE       LYS  59   1.977   6.206  -2.897
  465   2HE   LYS  59          1HE       LYS  59   2.529   5.741  -1.288
  466   1HZ   LYS  59          2HZ       LYS  59   4.505   7.239  -1.766
  467   2HZ   LYS  59          1HZ       LYS  59   3.586   7.866  -3.049
  468   3HZ   LYS  59          3HZ       LYS  59   3.018   7.999  -1.458
  469    H    HIS  60           H        HIS  60   2.540   1.297  -4.582
  470    HA   HIS  60           HA       HIS  60   1.742   0.184  -7.183
  471   1HB   HIS  60          2HB       HIS  60   3.123  -1.680  -5.282
  472   2HB   HIS  60          1HB       HIS  60   2.772  -1.911  -6.990
  473    HD1  HIS  60           HD1      HIS  60   4.540  -1.221  -8.633
  474    HD2  HIS  60           HD2      HIS  60   5.244   0.346  -4.834
  475    HE1  HIS  60           HE1      HIS  60   6.812  -0.109  -8.728
  476    H    TYR  61           H        TYR  61   0.033  -1.241  -7.077
  477    HA   TYR  61           HA       TYR  61  -1.208  -1.641  -4.388
  478   1HB   TYR  61          2HB       TYR  61  -2.407  -0.474  -6.885
  479   2HB   TYR  61          1HB       TYR  61  -3.438  -1.406  -5.798
  480    HD1  TYR  61           HD1      TYR  61  -3.325  -0.793  -3.267
  481    HD2  TYR  61           HD2      TYR  61  -1.957   1.786  -6.419
  482    HE1  TYR  61           HE1      TYR  61  -3.473   1.153  -1.738
  483    HE2  TYR  61           HE2      TYR  61  -2.106   3.733  -4.889
  484    HH   TYR  61           HH       TYR  61  -3.527   3.447  -1.684
  485    H    LYS  62           H        LYS  62  -0.655  -3.808  -4.276
  486    HA   LYS  62           HA       LYS  62  -0.594  -5.695  -6.339
  487   1HB   LYS  62          2HB       LYS  62   0.224  -6.092  -4.037
  488   2HB   LYS  62          1HB       LYS  62  -1.438  -6.175  -3.466
  489   1HG   LYS  62          2HG       LYS  62  -0.852  -7.917  -5.772
  490   2HG   LYS  62          1HG       LYS  62   0.040  -8.329  -4.305
  491   1HD   LYS  62          2HD       LYS  62  -2.965  -7.940  -4.461
  492   2HD   LYS  62          1HD       LYS  62  -2.149  -9.502  -4.420
  493   1HE   LYS  62          2HE       LYS  62  -1.693  -9.347  -2.190
  494   2HE   LYS  62          1HE       LYS  62  -1.353  -7.619  -2.281
  495   1HZ   LYS  62          3HZ       LYS  62  -4.068  -8.024  -2.833
  496   2HZ   LYS  62          2HZ       LYS  62  -3.692  -8.875  -1.412
  497   3HZ   LYS  62          1HZ       LYS  62  -3.373  -7.210  -1.518
  498    H    ILE  63           H        ILE  63  -2.142  -6.442  -7.646
  499    HA   ILE  63           HA       ILE  63  -4.979  -5.975  -7.013
  500    HB   ILE  63           HB       ILE  63  -3.432  -6.809  -9.442
  501   1HG1  ILE  63          2HG1      ILE  63  -5.380  -4.609  -8.732
  502   2HG1  ILE  63          1HG1      ILE  63  -3.662  -4.443  -9.098
  503   1HG2  ILE  63          2HG2      ILE  63  -5.388  -8.327  -9.321
  504   2HG2  ILE  63          1HG2      ILE  63  -6.450  -6.932  -9.127
  505   3HG2  ILE  63          3HG2      ILE  63  -5.563  -7.162 -10.634
  506   1HD1  ILE  63          1HD1      ILE  63  -4.609  -5.756 -11.318
  507   2HD1  ILE  63          3HD1      ILE  63  -5.957  -4.694 -10.915
  508   3HD1  ILE  63          2HD1      ILE  63  -4.358  -4.012 -11.214
  509    H    ARG  64           H        ARG  64  -6.426  -7.600  -6.539
  510    HA   ARG  64           HA       ARG  64  -5.389 -10.404  -6.535
  511   1HB   ARG  64          2HB       ARG  64  -6.205  -8.854  -4.305
  512   2HB   ARG  64          1HB       ARG  64  -7.499 -10.013  -4.604
  513   1HG   ARG  64          2HG       ARG  64  -5.672 -10.861  -3.076
  514   2HG   ARG  64          1HG       ARG  64  -5.964 -11.869  -4.494
  515   1HD   ARG  64          2HD       ARG  64  -3.952 -11.331  -5.455
  516   2HD   ARG  64          1HD       ARG  64  -3.968  -9.689  -4.812
  517    HE   ARG  64           HE       ARG  64  -3.030 -10.532  -2.750
  518   1HH1  ARG  64          2HH1      ARG  64  -4.158 -13.115  -4.675
  519   2HH1  ARG  64          1HH1      ARG  64  -2.953 -14.238  -4.138
  520   1HH2  ARG  64          1HH2      ARG  64  -1.232 -11.894  -2.249
  521   2HH2  ARG  64          2HH2      ARG  64  -1.296 -13.546  -2.765
  522    H    LYS  65           H        LYS  65  -6.674 -11.770  -7.731
  523    HA   LYS  65           HA       LYS  65  -9.341 -10.715  -8.540
  524   1HB   LYS  65          2HB       LYS  65  -8.017 -11.086 -10.491
  525   2HB   LYS  65          1HB       LYS  65  -7.430 -12.635  -9.887
  526   1HG   LYS  65          2HG       LYS  65 -10.292 -12.736  -9.922
  527   2HG   LYS  65          1HG       LYS  65  -9.758 -12.128 -11.483
  528   1HD   LYS  65          2HD       LYS  65  -8.104 -14.343 -10.523
  529   2HD   LYS  65          1HD       LYS  65  -9.798 -14.796 -10.713
  530   1HE   LYS  65          2HE       LYS  65  -9.811 -14.277 -13.004
  531   2HE   LYS  65          1HE       LYS  65  -8.394 -13.236 -12.872
  532   1HZ   LYS  65          3HZ       LYS  65  -7.196 -15.370 -12.186
  533   2HZ   LYS  65          2HZ       LYS  65  -8.529 -16.183 -12.857
  534   3HZ   LYS  65          1HZ       LYS  65  -7.575 -15.165 -13.826
  535    H    LEU  66           H        LEU  66 -11.132 -11.870  -8.087
  536    HA   LEU  66           HA       LEU  66 -10.958 -14.018  -6.156
  537   1HB   LEU  66          2HB       LEU  66 -13.174 -12.597  -7.591
  538   2HB   LEU  66          1HB       LEU  66 -13.524 -14.118  -6.776
  539    HG   LEU  66           HG       LEU  66 -12.989 -13.253  -4.663
  540   1HD1  LEU  66          3HD1      LEU  66 -11.440 -11.182  -6.215
  541   2HD1  LEU  66          2HD1      LEU  66 -11.819 -10.966  -4.505
  542   3HD1  LEU  66          1HD1      LEU  66 -10.829 -12.332  -5.024
  543   1HD2  LEU  66          1HD2      LEU  66 -14.702 -11.728  -6.320
  544   2HD2  LEU  66          3HD2      LEU  66 -14.709 -11.805  -4.556
  545   3HD2  LEU  66          2HD2      LEU  66 -13.748 -10.575  -5.381
  546    H    ASP  67           H        ASP  67 -11.493 -16.216  -6.491
  547    HA   ASP  67           HA       ASP  67 -10.853 -17.248  -9.126
  548   1HB   ASP  67          2HB       ASP  67 -11.342 -18.313  -6.453
  549   2HB   ASP  67          1HB       ASP  67 -12.110 -19.296  -7.698
  550    H    ASN  68           H        ASN  68 -13.638 -16.117  -7.517
  551    HA   ASN  68           HA       ASN  68 -15.512 -17.530  -9.322
  552   1HB   ASN  68          2HB       ASN  68 -16.092 -15.389  -7.253
  553   2HB   ASN  68          1HB       ASN  68 -17.260 -16.469  -8.015
  554   1HD2  ASN  68          2HD2      ASN  68 -15.415 -17.697  -4.692
  555   2HD2  ASN  68          1HD2      ASN  68 -15.449 -16.082  -5.212
  556    H    GLY  69           H        GLY  69 -13.528 -14.853  -9.454
  557   1HA   GLY  69          2HA       GLY  69 -13.449 -13.456 -11.426
  558   2HA   GLY  69          1HA       GLY  69 -15.184 -13.683 -11.600
  559    H    GLY  70           H        GLY  70 -12.736 -12.103  -9.585
  560   1HA   GLY  70          2HA       GLY  70 -14.519  -9.841  -9.204
  561   2HA   GLY  70          1HA       GLY  70 -14.072 -10.687  -7.734
  562    H    TYR  71           H        TYR  71 -12.849  -8.718 -10.389
  563    HA   TYR  71           HA       TYR  71 -10.099  -8.768  -9.407
  564   1HB   TYR  71          2HB       TYR  71 -11.584  -7.393 -11.597
  565   2HB   TYR  71          1HB       TYR  71 -10.123  -6.600 -11.005
  566    HD1  TYR  71           HD1      TYR  71  -7.968  -7.985 -10.864
  567    HD2  TYR  71           HD2      TYR  71 -11.447  -9.268 -13.031
  568    HE1  TYR  71           HE1      TYR  71  -6.577  -9.587 -12.148
  569    HE2  TYR  71           HE2      TYR  71 -10.057 -10.872 -14.314
  570    HH   TYR  71           HH       TYR  71  -6.730 -11.507 -13.464
  571    H    TYR  72           H        TYR  72  -9.433  -7.615  -7.657
  572    HA   TYR  72           HA       TYR  72 -10.584  -4.941  -7.124
  573   1HB   TYR  72          2HB       TYR  72 -11.470  -5.495  -4.973
  574   2HB   TYR  72          1HB       TYR  72 -12.085  -6.711  -6.090
  575    HD1  TYR  72           HD1      TYR  72 -10.761  -8.900  -6.329
  576    HD2  TYR  72           HD2      TYR  72 -10.232  -6.179  -3.069
  577    HE1  TYR  72           HE1      TYR  72  -9.700 -10.691  -5.020
  578    HE2  TYR  72           HE2      TYR  72  -9.152  -7.957  -1.748
  579    HH   TYR  72           HH       TYR  72  -9.292 -11.241  -2.638
  580    H    ILE  73           H        ILE  73  -8.900  -3.671  -6.286
  581    HA   ILE  73           HA       ILE  73  -6.463  -5.058  -5.340
  582    HB   ILE  73           HB       ILE  73  -7.053  -2.072  -5.508
  583   1HG1  ILE  73          2HG1      ILE  73  -5.117  -3.433  -7.315
  584   2HG1  ILE  73          1HG1      ILE  73  -6.829  -3.698  -7.644
  585   1HG2  ILE  73          3HG2      ILE  73  -5.167  -3.274  -3.977
  586   2HG2  ILE  73          2HG2      ILE  73  -4.289  -3.134  -5.500
  587   3HG2  ILE  73          1HG2      ILE  73  -4.946  -1.692  -4.725
  588   1HD1  ILE  73          1HD1      ILE  73  -6.851  -1.022  -7.236
  589   2HD1  ILE  73          3HD1      ILE  73  -5.216  -1.212  -7.870
  590   3HD1  ILE  73          2HD1      ILE  73  -6.601  -1.746  -8.823
  591    H    THR  74           H        THR  74  -9.298  -3.477  -4.217
  592    HA   THR  74           HA       THR  74  -8.532  -4.085  -1.417
  593    HB   THR  74           HB       THR  74  -8.440  -1.858  -1.006
  594    HG1  THR  74           HG1      THR  74 -10.472  -2.375  -0.166
  595   1HG2  THR  74          3HG2      THR  74  -8.271  -1.333  -3.411
  596   2HG2  THR  74          2HG2      THR  74 -10.030  -1.387  -3.543
  597   3HG2  THR  74          1HG2      THR  74  -9.256  -0.133  -2.573
  598    H    THR  75           H        THR  75 -10.255  -4.932  -0.245
  599    HA   THR  75           HA       THR  75 -12.302  -6.249  -1.720
  600    HB   THR  75           HB       THR  75 -13.298  -6.727   0.525
  601    HG1  THR  75           HG1      THR  75 -12.887  -5.212   1.922
  602   1HG2  THR  75          1HG2      THR  75 -10.724  -7.387  -0.527
  603   2HG2  THR  75          3HG2      THR  75 -10.595  -7.292   1.232
  604   3HG2  THR  75          2HG2      THR  75 -11.774  -8.375   0.494
  605    H    ARG  76           H        ARG  76 -12.147  -2.992  -0.842
  606    HA   ARG  76           HA       ARG  76 -14.929  -2.477  -0.346
  607   1HB   ARG  76          2HB       ARG  76 -12.982  -0.914   0.149
  608   2HB   ARG  76          1HB       ARG  76 -12.943  -0.553  -1.577
  609   1HG   ARG  76          2HG       ARG  76 -15.655  -0.354  -0.769
  610   2HG   ARG  76          1HG       ARG  76 -14.705   0.505   0.442
  611   1HD   ARG  76          2HD       ARG  76 -13.854   2.026  -1.112
  612   2HD   ARG  76          1HD       ARG  76 -14.118   0.934  -2.472
  613    HE   ARG  76           HE       ARG  76 -16.676   1.450  -1.627
  614   1HH1  ARG  76          2HH1      ARG  76 -14.521   3.866  -0.997
  615   2HH1  ARG  76          1HH1      ARG  76 -15.182   5.024  -2.103
  616   1HH2  ARG  76          1HH2      ARG  76 -17.290   2.743  -3.645
  617   2HH2  ARG  76          2HH2      ARG  76 -16.749   4.387  -3.603
  618    H    ALA  77           H        ALA  77 -13.176  -3.242  -3.237
  619    HA   ALA  77           HA       ALA  77 -15.661  -3.003  -4.779
  620   1HB   ALA  77          2HB       ALA  77 -13.288  -1.213  -5.304
  621   2HB   ALA  77          1HB       ALA  77 -14.495  -1.566  -6.542
  622   3HB   ALA  77          3HB       ALA  77 -14.970  -0.745  -5.054
  623    H    GLN  78           H        GLN  78 -15.717  -4.699  -6.140
  624    HA   GLN  78           HA       GLN  78 -13.186  -5.837  -7.172
  625   1HB   GLN  78          2HB       GLN  78 -15.756  -7.252  -6.416
  626   2HB   GLN  78          1HB       GLN  78 -14.377  -8.014  -7.192
  627   1HG   GLN  78          2HG       GLN  78 -13.347  -8.272  -5.203
  628   2HG   GLN  78          1HG       GLN  78 -13.480  -6.543  -4.885
  629   1HE2  GLN  78          2HE2      GLN  78 -15.440  -7.826  -2.145
  630   2HE2  GLN  78          1HE2      GLN  78 -13.847  -7.439  -2.577
  631    H    PHE  79           H        PHE  79 -13.670  -7.126  -9.273
  632    HA   PHE  79           HA       PHE  79 -15.980  -6.024 -10.782
  633   1HB   PHE  79          2HB       PHE  79 -13.080  -5.548 -11.477
  634   2HB   PHE  79          1HB       PHE  79 -14.356  -5.463 -12.695
  635    HD1  PHE  79           HD1      PHE  79 -13.386  -4.160  -9.339
  636    HD2  PHE  79           HD2      PHE  79 -15.664  -3.507 -12.917
  637    HE1  PHE  79           HE1      PHE  79 -13.991  -1.911  -8.535
  638    HE2  PHE  79           HE2      PHE  79 -16.271  -1.239 -12.114
  639    HZ   PHE  79           HZ       PHE  79 -15.433  -0.437  -9.920
  640    H    GLU  80           H        GLU  80 -15.253  -6.937 -13.314
  641    HA   GLU  80           HA       GLU  80 -15.245  -9.856 -12.790
  642   1HB   GLU  80          2HB       GLU  80 -16.250  -9.982 -15.096
  643   2HB   GLU  80          1HB       GLU  80 -17.219  -9.087 -13.928
  644   1HG   GLU  80          2HG       GLU  80 -17.058  -7.186 -15.117
  645   2HG   GLU  80          1HG       GLU  80 -15.312  -7.351 -15.261
  646    H    THR  81           H        THR  81 -13.564  -7.339 -14.658
  647    HA   THR  81           HA       THR  81 -11.475  -9.385 -15.216
  648    HB   THR  81           HB       THR  81 -12.307  -9.461 -17.359
  649    HG1  THR  81           HG1      THR  81 -11.341  -7.020 -18.057
  650   1HG2  THR  81          1HG2      THR  81 -14.154  -7.783 -16.603
  651   2HG2  THR  81          3HG2      THR  81 -13.115  -6.584 -17.363
  652   3HG2  THR  81          2HG2      THR  81 -13.771  -7.913 -18.315
  653    H    LEU  82           H        LEU  82  -9.523  -8.120 -16.305
  654    HA   LEU  82           HA       LEU  82  -8.785  -6.048 -14.378
  655   1HB   LEU  82          2HB       LEU  82  -7.406  -7.756 -16.335
  656   2HB   LEU  82          1HB       LEU  82  -6.758  -6.118 -16.250
  657    HG   LEU  82           HG       LEU  82  -7.359  -7.437 -13.653
  658   1HD1  LEU  82          3HD1      LEU  82  -6.100  -9.024 -15.442
  659   2HD1  LEU  82          2HD1      LEU  82  -4.717  -8.111 -14.837
  660   3HD1  LEU  82          1HD1      LEU  82  -5.722  -9.037 -13.720
  661   1HD2  LEU  82          1HD2      LEU  82  -5.613  -5.360 -14.792
  662   2HD2  LEU  82          3HD2      LEU  82  -6.274  -5.504 -13.163
  663   3HD2  LEU  82          2HD2      LEU  82  -4.813  -6.388 -13.602
  664    H    GLN  83           H        GLN  83  -9.717  -6.261 -17.752
  665    HA   GLN  83           HA       GLN  83  -9.040  -3.504 -18.354
  666   1HB   GLN  83          2HB       GLN  83  -9.146  -5.053 -20.200
  667   2HB   GLN  83          1HB       GLN  83 -10.782  -5.546 -19.760
  668   1HG   GLN  83          2HG       GLN  83 -11.687  -3.420 -20.374
  669   2HG   GLN  83          1HG       GLN  83 -10.085  -2.692 -20.487
  670   1HE2  GLN  83          2HE2      GLN  83 -10.938  -3.397 -23.981
  671   2HE2  GLN  83          1HE2      GLN  83 -11.329  -2.273 -22.772
  672    H    GLN  84           H        GLN  84 -11.827  -5.251 -17.143
  673    HA   GLN  84           HA       GLN  84 -13.714  -3.086 -17.474
  674   1HB   GLN  84          2HB       GLN  84 -13.688  -5.676 -15.978
  675   2HB   GLN  84          1HB       GLN  84 -14.911  -4.478 -15.590
  676   1HG   GLN  84          2HG       GLN  84 -15.453  -6.242 -17.433
  677   2HG   GLN  84          1HG       GLN  84 -15.872  -4.564 -17.718
  678   1HE2  GLN  84          2HE2      GLN  84 -13.735  -6.278 -20.503
  679   2HE2  GLN  84          1HE2      GLN  84 -14.868  -7.017 -19.478
  680    H    LEU  85           H        LEU  85 -11.515  -4.097 -14.904
  681    HA   LEU  85           HA       LEU  85 -12.585  -2.070 -13.067
  682   1HB   LEU  85          2HB       LEU  85 -11.308  -3.057 -11.448
  683   2HB   LEU  85          1HB       LEU  85 -11.303  -4.395 -12.591
  684    HG   LEU  85           HG       LEU  85  -9.186  -2.825 -13.450
  685   1HD1  LEU  85          3HD1      LEU  85  -9.771  -1.980 -10.850
  686   2HD1  LEU  85          2HD1      LEU  85  -8.419  -3.100 -10.665
  687   3HD1  LEU  85          1HD1      LEU  85  -8.266  -1.701 -11.729
  688   1HD2  LEU  85          2HD2      LEU  85  -9.664  -5.407 -12.705
  689   2HD2  LEU  85          1HD2      LEU  85  -8.094  -4.774 -13.200
  690   3HD2  LEU  85          3HD2      LEU  85  -8.501  -4.886 -11.486
  691    H    VAL  86           H        VAL  86  -9.788  -2.349 -15.244
  692    HA   VAL  86           HA       VAL  86  -8.600   0.100 -14.374
  693    HB   VAL  86           HB       VAL  86  -7.412   0.113 -16.488
  694   1HG1  VAL  86          2HG1      VAL  86  -7.740  -2.325 -14.918
  695   2HG1  VAL  86          1HG1      VAL  86  -7.246  -2.672 -16.575
  696   3HG1  VAL  86          3HG1      VAL  86  -6.267  -1.605 -15.568
  697   1HG2  VAL  86          2HG2      VAL  86  -9.495  -0.280 -17.841
  698   2HG2  VAL  86          1HG2      VAL  86  -8.111  -1.237 -18.373
  699   3HG2  VAL  86          3HG2      VAL  86  -9.385  -1.983 -17.410
  700    H    GLN  87           H        GLN  87 -11.369  -0.759 -16.183
  701    HA   GLN  87           HA       GLN  87 -11.818   1.742 -17.529
  702   1HB   GLN  87          2HB       GLN  87 -12.782  -0.486 -18.179
  703   2HB   GLN  87          1HB       GLN  87 -13.832  -0.374 -16.777
  704   1HG   GLN  87          2HG       GLN  87 -15.052   0.453 -18.702
  705   2HG   GLN  87          1HG       GLN  87 -14.674   1.812 -17.643
  706   1HE2  GLN  87          2HE2      GLN  87 -12.988   3.507 -20.219
  707   2HE2  GLN  87          1HE2      GLN  87 -13.892   3.586 -18.785
  708    H    HIS  88           H        HIS  88 -13.125   0.256 -14.587
  709    HA   HIS  88           HA       HIS  88 -14.873   2.451 -13.979
  710   1HB   HIS  88          2HB       HIS  88 -14.945  -0.015 -13.152
  711   2HB   HIS  88          1HB       HIS  88 -13.801   0.533 -11.932
  712    HD1  HIS  88           HD1      HIS  88 -17.305   1.262 -13.201
  713    HD2  HIS  88           HD2      HIS  88 -14.949   1.990  -9.839
  714    HE1  HIS  88           HE1      HIS  88 -18.832   2.301 -11.468
  715    H    TYR  89           H        TYR  89 -11.698   1.432 -12.887
  716    HA   TYR  89           HA       TYR  89 -11.392   3.639 -11.059
  717   1HB   TYR  89          2HB       TYR  89  -9.497   1.611 -12.204
  718   2HB   TYR  89          1HB       TYR  89  -8.979   2.839 -11.059
  719    HD1  TYR  89           HD1      TYR  89 -11.524   0.159 -11.533
  720    HD2  TYR  89           HD2      TYR  89  -9.168   2.410  -8.748
  721    HE1  TYR  89           HE1      TYR  89 -12.289  -1.307  -9.723
  722    HE2  TYR  89           HE2      TYR  89  -9.952   0.942  -6.907
  723    HH   TYR  89           HH       TYR  89 -11.524  -2.011  -7.462
  724    H    SER  90           H        SER  90 -11.054   3.212 -14.421
  725    HA   SER  90           HA       SER  90  -8.981   5.051 -15.021
  726   1HB   SER  90          2HB       SER  90 -10.955   3.551 -16.473
  727   2HB   SER  90          1HB       SER  90 -10.959   5.216 -17.055
  728    HG   SER  90           HG       SER  90  -8.947   5.018 -17.729
  729    H    GLU  91           H        GLU  91 -12.355   5.433 -14.220
  730    HA   GLU  91           HA       GLU  91 -12.131   8.374 -14.652
  731   1HB   GLU  91          2HB       GLU  91 -14.639   6.803 -14.011
  732   2HB   GLU  91          1HB       GLU  91 -14.527   8.438 -14.661
  733   1HG   GLU  91          2HG       GLU  91 -13.073   6.948 -16.487
  734   2HG   GLU  91          1HG       GLU  91 -14.396   5.864 -16.059
  735    H    ARG  92           H        ARG  92 -12.155   5.926 -12.236
  736    HA   ARG  92           HA       ARG  92 -12.262   8.081 -10.166
  737   1HB   ARG  92          2HB       ARG  92 -13.623   5.447  -9.654
  738   2HB   ARG  92          1HB       ARG  92 -13.861   6.994  -8.840
  739   1HG   ARG  92          2HG       ARG  92 -14.934   7.918 -10.828
  740   2HG   ARG  92          1HG       ARG  92 -14.605   6.437 -11.728
  741   1HD   ARG  92          2HD       ARG  92 -16.593   5.657 -11.006
  742   2HD   ARG  92          1HD       ARG  92 -15.907   5.598  -9.382
  743    HE   ARG  92           HE       ARG  92 -17.439   7.313  -8.899
  744   1HH1  ARG  92          2HH1      ARG  92 -17.207   7.158 -12.258
  745   2HH1  ARG  92          1HH1      ARG  92 -17.603   8.822 -12.533
  746   1HH2  ARG  92          1HH2      ARG  92 -17.523   9.671  -9.172
  747   2HH2  ARG  92          2HH2      ARG  92 -17.781  10.245 -10.785
  748    H    ALA  93           H        ALA  93 -11.325   7.325  -8.059
  749    HA   ALA  93           HA       ALA  93  -9.027   5.538  -8.590
  750   1HB   ALA  93          2HB       ALA  93  -8.950   7.824  -7.320
  751   2HB   ALA  93          1HB       ALA  93  -9.573   6.897  -5.956
  752   3HB   ALA  93          3HB       ALA  93  -8.021   6.471  -6.677
  753    H    ALA  94           H        ALA  94 -11.753   5.834  -6.343
  754    HA   ALA  94           HA       ALA  94 -13.096   4.028  -5.544
  755   1HB   ALA  94          2HB       ALA  94 -11.610   2.579  -7.236
  756   2HB   ALA  94          1HB       ALA  94 -10.869   2.055  -5.724
  757   3HB   ALA  94          3HB       ALA  94 -12.598   1.826  -5.984
  758    H    GLY  95           H        GLY  95 -10.010   5.113  -4.609
  759   1HA   GLY  95          2HA       GLY  95 -10.265   5.594  -2.025
  760   2HA   GLY  95          1HA       GLY  95 -10.252   3.835  -1.940
  761    H    LEU  96           H        LEU  96  -8.290   3.789  -4.280
  762    HA   LEU  96           HA       LEU  96  -5.902   3.929  -2.621
  763   1HB   LEU  96          2HB       LEU  96  -4.803   2.823  -4.386
  764   2HB   LEU  96          1HB       LEU  96  -6.449   2.202  -4.467
  765    HG   LEU  96           HG       LEU  96  -5.295   4.423  -6.167
  766   1HD1  LEU  96          3HD1      LEU  96  -6.147   1.580  -6.747
  767   2HD1  LEU  96          2HD1      LEU  96  -5.768   2.763  -7.999
  768   3HD1  LEU  96          1HD1      LEU  96  -4.515   2.237  -6.873
  769   1HD2  LEU  96          3HD2      LEU  96  -8.059   3.218  -6.042
  770   2HD2  LEU  96          2HD2      LEU  96  -7.620   4.901  -5.749
  771   3HD2  LEU  96          1HD2      LEU  96  -7.492   4.225  -7.373
  772    H    SER  97           H        SER  97  -4.038   5.227  -3.126
  773    HA   SER  97           HA       SER  97  -4.384   7.937  -3.354
  774   1HB   SER  97          2HB       SER  97  -2.136   6.103  -3.844
  775   2HB   SER  97          1HB       SER  97  -1.993   7.656  -4.669
  776    HG   SER  97           HG       SER  97  -2.369   7.172  -1.907
  777    H    SER  98           H        SER  98  -3.979   5.704  -6.092
  778    HA   SER  98           HA       SER  98  -5.319   7.686  -7.816
  779   1HB   SER  98          2HB       SER  98  -2.882   6.655  -9.093
  780   2HB   SER  98          1HB       SER  98  -3.543   8.291  -9.082
  781    HG   SER  98           HG       SER  98  -2.021   8.696  -7.712
  782    H    ARG  99           H        ARG  99  -6.191   6.749  -9.708
  783    HA   ARG  99           HA       ARG  99  -6.786   3.925  -9.515
  784   1HB   ARG  99          2HB       ARG  99  -8.035   4.315 -11.617
  785   2HB   ARG  99          1HB       ARG  99  -8.403   5.544 -10.408
  786   1HG   ARG  99          2HG       ARG  99  -6.116   6.416 -11.885
  787   2HG   ARG  99          1HG       ARG  99  -7.350   5.916 -13.042
  788   1HD   ARG  99          2HD       ARG  99  -8.798   7.582 -12.420
  789   2HD   ARG  99          1HD       ARG  99  -8.296   7.528 -10.731
  790    HE   ARG  99           HE       ARG  99  -6.219   8.590 -12.470
  791   1HH1  ARG  99          2HH1      ARG  99  -6.503   9.623  -9.757
  792   2HH1  ARG  99          1HH1      ARG  99  -7.305  11.142  -9.980
  793   1HH2  ARG  99          1HH2      ARG  99  -8.384  10.401 -13.191
  794   2HH2  ARG  99          2HH2      ARG  99  -8.370  11.583 -11.926
  795    H    LEU 100           H        LEU 100  -6.573   3.985 -12.697
  796    HA   LEU 100           HA       LEU 100  -3.809   2.869 -12.670
  797   1HB   LEU 100          2HB       LEU 100  -4.741   2.091 -15.104
  798   2HB   LEU 100          1HB       LEU 100  -4.887   1.120 -13.646
  799    HG   LEU 100           HG       LEU 100  -7.026   1.301 -14.912
  800   1HD1  LEU 100          3HD1      LEU 100  -6.565   1.719 -12.138
  801   2HD1  LEU 100          2HD1      LEU 100  -7.944   2.704 -12.617
  802   3HD1  LEU 100          1HD1      LEU 100  -7.959   0.964 -12.911
  803   1HD2  LEU 100          3HD2      LEU 100  -6.287   4.054 -14.995
  804   2HD2  LEU 100          2HD2      LEU 100  -7.684   3.277 -15.739
  805   3HD2  LEU 100          1HD2      LEU 100  -7.803   3.927 -14.103
  806    H    VAL 101           H        VAL 101  -3.111   2.989 -15.316
  807    HA   VAL 101           HA       VAL 101  -1.951   5.467 -15.645
  808    HB   VAL 101           HB       VAL 101  -1.893   3.249 -17.111
  809   1HG1  VAL 101          3HG1      VAL 101  -4.200   3.661 -18.021
  810   2HG1  VAL 101          2HG1      VAL 101  -3.572   5.101 -18.825
  811   3HG1  VAL 101          1HG1      VAL 101  -2.963   3.506 -19.269
  812   1HG2  VAL 101          2HG2      VAL 101  -0.937   5.954 -17.402
  813   2HG2  VAL 101          1HG2      VAL 101  -0.143   4.443 -17.846
  814   3HG2  VAL 101          3HG2      VAL 101  -1.219   5.242 -18.993
  815    H    VAL 102           H        VAL 102  -2.795   7.451 -15.692
  816    HA   VAL 102           HA       VAL 102  -5.614   7.861 -16.380
  817    HB   VAL 102           HB       VAL 102  -3.776  10.166 -15.930
  818   1HG1  VAL 102          2HG1      VAL 102  -6.550   9.664 -15.940
  819   2HG1  VAL 102          1HG1      VAL 102  -6.123   9.954 -14.254
  820   3HG1  VAL 102          3HG1      VAL 102  -5.743  11.163 -15.480
  821   1HG2  VAL 102          2HG2      VAL 102  -4.253   7.930 -14.000
  822   2HG2  VAL 102          1HG2      VAL 102  -2.826   8.945 -14.206
  823   3HG2  VAL 102          3HG2      VAL 102  -4.247   9.580 -13.377
  824    HA   PRO 103           HA       PRO 103  -3.594  10.323 -19.938
  825   1HB   PRO 103          2HB       PRO 103  -0.889  10.021 -20.320
  826   2HB   PRO 103          1HB       PRO 103  -1.600  11.278 -19.297
  827   1HG   PRO 103          2HG       PRO 103  -0.175   8.784 -18.501
  828   2HG   PRO 103          1HG       PRO 103  -0.364  10.298 -17.606
  829   1HD   PRO 103          2HD       PRO 103  -1.826   7.892 -17.197
  830   2HD   PRO 103          1HD       PRO 103  -2.179   9.473 -16.475
  831    H    SER 104           H        SER 104  -1.297   7.573 -19.697
  832    HA   SER 104           HA       SER 104  -1.030   5.694 -21.078
  833   1HB   SER 104          2HB       SER 104  -3.168   4.881 -20.662
  834   2HB   SER 104          1HB       SER 104  -3.954   6.318 -21.316
  835    HG   SER 104           HG       SER 104  -3.987   4.324 -22.634
  836    H    HIS 105           H        HIS 105   0.480   6.809 -22.450
  837    HA   HIS 105           HA       HIS 105  -0.580   8.226 -24.811
  838   1HB   HIS 105          2HB       HIS 105   1.834   8.589 -25.337
  839   2HB   HIS 105          1HB       HIS 105   1.402   9.153 -23.722
  840    HD1  HIS 105           HD1      HIS 105   3.571   8.721 -22.486
  841    HD2  HIS 105           HD2      HIS 105   2.260   5.375 -24.600
  842    HE1  HIS 105           HE1      HIS 105   5.075   6.803 -21.797
  843    H    LYS 106           HN       LYS 106  -1.222   5.419 -24.607
  844    HA   LYS 106           HA       LYS 106   0.354   3.575 -25.903
  845   1HB   LYS 106          2HB       LYS 106  -2.316   3.716 -25.267
  846   2HB   LYS 106          1HB       LYS 106  -2.365   3.665 -27.029
  847   1HG   LYS 106          2HG       LYS 106  -0.656   1.716 -26.792
  848   2HG   LYS 106          1HG       LYS 106  -1.205   1.646 -25.117
  849   1HD   LYS 106          2HD       LYS 106  -2.828   0.279 -25.945
  850   2HD   LYS 106          1HD       LYS 106  -3.590   1.786 -26.455
  851   1HE   LYS 106          2HE       LYS 106  -3.031   1.479 -28.661
  852   2HE   LYS 106          1HE       LYS 106  -1.516   0.664 -28.271
  853   1HZ   LYS 106          2HZ       LYS 106  -2.843  -1.267 -27.550
  854   2HZ   LYS 106          1HZ       LYS 106  -4.248  -0.484 -28.100
  855   3HZ   LYS 106          3HZ       LYS 106  -3.031  -0.913 -29.201
  856   1H    GLU 201          1HT       GLU 201   3.140  -4.491   8.932
  857   2H    GLU 201          3HT       GLU 201   4.305  -5.712   9.102
  858   3H    GLU 201          2HT       GLU 201   4.523  -4.219   9.882
  859    HA   GLU 201           HA       GLU 201   5.001  -3.097   7.921
  860   1HB   GLU 201          2HB       GLU 201   6.145  -5.898   7.877
  861   2HB   GLU 201          1HB       GLU 201   6.677  -4.642   6.760
  862   1HG   GLU 201          2HG       GLU 201   6.663  -3.469   9.340
  863   2HG   GLU 201          1HG       GLU 201   7.445  -5.042   9.505
  864    HA   PRO 202           HA       PRO 202   1.900  -4.774   5.006
  865   1HB   PRO 202          2HB       PRO 202   0.793  -2.317   4.463
  866   2HB   PRO 202          1HB       PRO 202   0.276  -3.348   5.808
  867   1HG   PRO 202          2HG       PRO 202   1.922  -0.861   5.874
  868   2HG   PRO 202          1HG       PRO 202   0.882  -1.551   7.131
  869   1HD   PRO 202          2HD       PRO 202   3.706  -1.725   7.034
  870   2HD   PRO 202          1HD       PRO 202   2.636  -2.676   8.088
  871    H    GLN 203           H        GLN 203   3.164  -5.230   3.200
  872    HA   GLN 203           HA       GLN 203   4.989  -3.392   1.978
  873   1HB   GLN 203          2HB       GLN 203   3.895  -6.062   1.384
  874   2HB   GLN 203          1HB       GLN 203   4.308  -5.123  -0.051
  875   1HG   GLN 203          2HG       GLN 203   6.553  -4.657   0.991
  876   2HG   GLN 203          1HG       GLN 203   6.129  -5.786   2.278
  877   1HE2  GLN 203          2HE2      GLN 203   7.754  -7.327  -0.959
  878   2HE2  GLN 203          1HE2      GLN 203   7.977  -5.745  -0.386
  879   1HN   PTR 204          1HN       PTR 204   2.475  -4.721  -0.075
  880    HA   PTR 204           HA       PTR 204   2.129  -2.381  -1.607
  881   1HB   PTR 204          1HB       PTR 204  -0.172  -3.425  -2.147
  882    HD1  PTR 204           HD1      PTR 204   1.218  -2.879  -4.167
  883    HD2  PTR 204           HD2      PTR 204   1.929  -6.367  -1.761
  884    HE1  PTR 204           HE1      PTR 204   2.567  -3.872  -6.000
  885    HE2  PTR 204           HE2      PTR 204   3.281  -7.355  -3.589
  886    H    GLU 205           H        GLU 205   0.029  -1.071  -1.703
  887    HA   GLU 205           HA       GLU 205  -0.640  -0.209   1.065
  888   1HB   GLU 205          2HB       GLU 205  -1.000   1.134  -1.629
  889   2HB   GLU 205          1HB       GLU 205  -1.589   1.811  -0.111
  890   1HG   GLU 205          2HG       GLU 205   0.855   1.478   0.722
  891   2HG   GLU 205          1HG       GLU 205   1.256   1.360  -0.992
  892    H    GLU 206           H        GLU 206  -2.718  -0.387   1.852
  893    HA   GLU 206           HA       GLU 206  -4.786  -1.435  -0.040
  894   1HB   GLU 206          2HB       GLU 206  -5.685  -2.775   1.811
  895   2HB   GLU 206          1HB       GLU 206  -3.991  -3.182   1.536
  896   1HG   GLU 206          2HG       GLU 206  -3.491  -1.368   3.328
  897   2HG   GLU 206          1HG       GLU 206  -5.192  -1.544   3.762
  898    H    ILE 207           H        ILE 207  -7.001  -0.815   0.506
  899    HA   ILE 207           HA       ILE 207  -7.082   1.838   1.836
  900    HB   ILE 207           HB       ILE 207  -9.052   0.393   0.042
  901   1HG1  ILE 207          2HG1      ILE 207  -8.476   2.706  -1.201
  902   2HG1  ILE 207          1HG1      ILE 207  -6.975   2.505  -0.300
  903   1HG2  ILE 207          1HG2      ILE 207 -10.039   1.891   1.897
  904   2HG2  ILE 207          3HG2      ILE 207  -9.297   3.236   1.030
  905   3HG2  ILE 207          2HG2      ILE 207 -10.520   2.243   0.237
  906   1HD1  ILE 207          3HD1      ILE 207  -7.748  -0.021  -1.450
  907   2HD1  ILE 207          2HD1      ILE 207  -7.714   1.215  -2.708
  908   3HD1  ILE 207          1HD1      ILE 207  -6.279   0.914  -1.729
  909    HA   PRO 208           HA       PRO 208  -9.082   0.040   5.336
  910   1HB   PRO 208          2HB       PRO 208  -9.993   2.385   6.447
  911   2HB   PRO 208          1HB       PRO 208  -8.305   1.852   6.532
  912   1HG   PRO 208          2HG       PRO 208  -9.514   3.994   4.845
  913   2HG   PRO 208          1HG       PRO 208  -7.852   3.837   5.438
  914   1HD   PRO 208          2HD       PRO 208  -8.740   3.237   2.819
  915   2HD   PRO 208          1HD       PRO 208  -7.175   2.777   3.521
  916    H    ILE 209           H        ILE 209 -11.387   0.762   6.550
  917    HA   ILE 209           HA       ILE 209 -13.469   1.304   4.536
  918    HB   ILE 209           HB       ILE 209 -12.935  -1.203   4.515
  919   1HG1  ILE 209          2HG1      ILE 209 -15.080  -0.173   3.717
  920   2HG1  ILE 209          1HG1      ILE 209 -15.287  -1.804   4.352
  921   1HG2  ILE 209          2HG2      ILE 209 -14.253  -0.977   7.237
  922   2HG2  ILE 209          1HG2      ILE 209 -13.948  -2.491   6.387
  923   3HG2  ILE 209          3HG2      ILE 209 -12.596  -1.491   6.920
  924   1HD1  ILE 209          2HD1      ILE 209 -15.630  -0.327   6.621
  925   2HD1  ILE 209          1HD1      ILE 209 -16.287   0.771   5.408
  926   3HD1  ILE 209          3HD1      ILE 209 -16.953  -0.854   5.581
  927    H    TYR 210           H        TYR 210 -12.663   0.460   7.880
  928    HA   TYR 210           HA       TYR 210 -15.188   1.359   8.971
  929   1HB   TYR 210          2HB       TYR 210 -12.592   0.413  10.013
  930   2HB   TYR 210          1HB       TYR 210 -13.431   1.558  11.058
  931    HD1  TYR 210           HD1      TYR 210 -14.018  -1.549   9.049
  932    HD2  TYR 210           HD2      TYR 210 -15.171   0.816  12.444
  933    HE1  TYR 210           HE1      TYR 210 -15.569  -3.343   9.772
  934    HE2  TYR 210           HE2      TYR 210 -16.722  -0.979  13.168
  935    HH   TYR 210           HH       TYR 210 -17.151  -3.262  12.879
  936    H    LEU 211           HN       LEU 211 -14.627   3.109  10.972
  937    HA   LEU 211           HA       LEU 211 -13.994   5.576   9.454
  938   1HB   LEU 211          2HB       LEU 211 -16.011   5.041  11.196
  939   2HB   LEU 211          1HB       LEU 211 -14.831   5.761  12.291
  940    HG   LEU 211           HG       LEU 211 -14.647   7.504  10.237
  941   1HD1  LEU 211          2HD1      LEU 211 -16.481   6.154   9.062
  942   2HD1  LEU 211          1HD1      LEU 211 -17.582   6.777  10.291
  943   3HD1  LEU 211          3HD1      LEU 211 -16.760   7.891   9.198
  944   1HD2  LEU 211          3HD2      LEU 211 -16.503   7.404  12.608
  945   2HD2  LEU 211          2HD2      LEU 211 -15.025   8.345  12.402
  946   3HD2  LEU 211          1HD2      LEU 211 -16.492   8.806  11.537
   
  No H/Q in entry =         946
  Start of MODEL    5
    1   1H    SER   1          3HT       SER   1  -8.391 -10.255 -22.499
    2   2H    SER   1          2HT       SER   1  -8.411 -11.202 -23.909
    3   3H    SER   1          1HT       SER   1  -7.167 -11.396 -22.768
    4    HA   SER   1           HA       SER   1  -5.943  -9.862 -23.759
    5   1HB   SER   1          2HB       SER   1  -6.748  -8.949 -25.935
    6   2HB   SER   1          1HB       SER   1  -6.969 -10.695 -25.819
    7    HG   SER   1           HG       SER   1  -8.962 -10.251 -26.269
    8    H    ILE   2           H        ILE   2  -6.403  -8.612 -21.685
    9    HA   ILE   2           HA       ILE   2  -8.303  -6.418 -21.793
   10    HB   ILE   2           HB       ILE   2  -7.410  -5.769 -19.672
   11   1HG1  ILE   2          2HG1      ILE   2  -5.019  -7.515 -20.350
   12   2HG1  ILE   2          1HG1      ILE   2  -5.027  -5.752 -20.337
   13   1HG2  ILE   2          3HG2      ILE   2  -8.445  -8.203 -20.062
   14   2HG2  ILE   2          2HG2      ILE   2  -6.844  -8.698 -19.510
   15   3HG2  ILE   2          1HG2      ILE   2  -7.861  -7.692 -18.478
   16   1HD1  ILE   2          2HD1      ILE   2  -6.086  -6.494 -17.845
   17   2HD1  ILE   2          1HD1      ILE   2  -4.737  -7.600 -18.110
   18   3HD1  ILE   2          3HD1      ILE   2  -4.470  -5.857 -18.152
   19    H    GLN   3           H        GLN   3  -7.491  -4.090 -21.551
   20    HA   GLN   3           HA       GLN   3  -6.189  -3.158 -23.799
   21   1HB   GLN   3          2HB       GLN   3  -7.153  -1.976 -21.521
   22   2HB   GLN   3          1HB       GLN   3  -5.422  -1.666 -21.378
   23   1HG   GLN   3          2HG       GLN   3  -6.308   0.172 -22.623
   24   2HG   GLN   3          1HG       GLN   3  -5.510  -0.865 -23.806
   25   1HE2  GLN   3          2HE2      GLN   3  -9.595  -0.517 -23.849
   26   2HE2  GLN   3          1HE2      GLN   3  -8.713   0.049 -22.514
   27    H    ALA   4           H        ALA   4  -4.582  -3.676 -20.670
   28    HA   ALA   4           HA       ALA   4  -2.279  -3.893 -20.195
   29   1HB   ALA   4          3HB       ALA   4  -2.974  -6.147 -20.957
   30   2HB   ALA   4          2HB       ALA   4  -2.538  -5.700 -22.605
   31   3HB   ALA   4          1HB       ALA   4  -1.292  -5.801 -21.362
   32    H    GLU   5           H        GLU   5  -2.780  -1.613 -21.807
   33    HA   GLU   5           HA       GLU   5  -0.165  -1.440 -23.185
   34   1HB   GLU   5          2HB       GLU   5  -1.107  -0.542 -25.229
   35   2HB   GLU   5          1HB       GLU   5  -1.875  -2.097 -24.907
   36   1HG   GLU   5          2HG       GLU   5  -3.653  -0.646 -23.633
   37   2HG   GLU   5          1HG       GLU   5  -3.009   0.674 -24.609
   38    H    GLU   6           H        GLU   6  -1.951  -0.221 -20.860
   39    HA   GLU   6           HA       GLU   6  -0.796   2.463 -21.153
   40   1HB   GLU   6          2HB       GLU   6  -3.744   2.396 -20.607
   41   2HB   GLU   6          1HB       GLU   6  -2.762   3.708 -21.257
   42   1HG   GLU   6          2HG       GLU   6  -2.502   2.509 -23.373
   43   2HG   GLU   6          1HG       GLU   6  -3.392   1.130 -22.726
   44    H    TRP   7           H        TRP   7  -2.792   0.234 -19.271
   45    HA   TRP   7           HA       TRP   7  -1.684   1.482 -16.800
   46   1HB   TRP   7          2HB       TRP   7  -3.875   0.600 -15.738
   47   2HB   TRP   7          1HB       TRP   7  -3.984   2.054 -16.725
   48    HD1  TRP   7           HD1      TRP   7  -5.540   1.976 -18.772
   49    HE1  TRP   7           HE1      TRP   7  -6.931   0.133 -19.925
   50    HE3  TRP   7           HE3      TRP   7  -3.828  -2.124 -16.263
   51    HZ2  TRP   7           HZ2      TRP   7  -7.269  -2.702 -19.800
   52    HZ3  TRP   7           HZ3      TRP   7  -4.700  -4.381 -16.798
   53    HH2  TRP   7           HH2      TRP   7  -6.414  -4.674 -18.560
   54    H    TYR   8           H        TYR   8  -1.262  -1.044 -18.671
   55    HA   TYR   8           HA       TYR   8  -0.598  -2.853 -16.453
   56   1HB   TYR   8          2HB       TYR   8  -2.752  -3.659 -16.749
   57   2HB   TYR   8          1HB       TYR   8  -2.768  -3.325 -18.473
   58    HD1  TYR   8           HD1      TYR   8  -0.713  -4.792 -19.735
   59    HD2  TYR   8           HD2      TYR   8  -2.877  -5.836 -16.174
   60    HE1  TYR   8           HE1      TYR   8  -0.240  -7.184 -20.147
   61    HE2  TYR   8           HE2      TYR   8  -2.412  -8.225 -16.599
   62    HH   TYR   8           HH       TYR   8  -1.720  -9.531 -19.216
   63    H    PHE   9           H        PHE   9   1.294  -3.839 -16.897
   64    HA   PHE   9           HA       PHE   9   2.387  -3.487 -19.633
   65   1HB   PHE   9          2HB       PHE   9   3.596  -3.892 -16.911
   66   2HB   PHE   9          1HB       PHE   9   4.545  -4.231 -18.356
   67    HD1  PHE   9           HD1      PHE   9   1.932  -1.661 -18.552
   68    HD2  PHE   9           HD2      PHE   9   6.103  -2.363 -17.730
   69    HE1  PHE   9           HE1      PHE   9   2.399   0.755 -18.813
   70    HE2  PHE   9           HE2      PHE   9   6.555   0.056 -17.995
   71    HZ   PHE   9           HZ       PHE   9   4.707   1.615 -18.536
   72    H    GLY  10           H        GLY  10   1.698  -6.002 -17.232
   73   1HA   GLY  10          2HA       GLY  10   0.979  -8.138 -18.575
   74   2HA   GLY  10          1HA       GLY  10   2.620  -8.045 -19.196
   75    H    LYS  11           H        LYS  11   4.184  -8.996 -18.035
   76    HA   LYS  11           HA       LYS  11   3.511  -9.979 -15.295
   77   1HB   LYS  11          2HB       LYS  11   5.727 -11.133 -16.965
   78   2HB   LYS  11          1HB       LYS  11   4.739 -11.919 -15.733
   79   1HG   LYS  11          2HG       LYS  11   2.829 -11.988 -17.199
   80   2HG   LYS  11          1HG       LYS  11   3.629 -10.953 -18.381
   81   1HD   LYS  11          2HD       LYS  11   5.234 -12.671 -18.910
   82   2HD   LYS  11          1HD       LYS  11   4.693 -13.670 -17.561
   83   1HE   LYS  11          2HE       LYS  11   3.384 -14.691 -19.115
   84   2HE   LYS  11          1HE       LYS  11   2.348 -13.274 -18.934
   85   1HZ   LYS  11          2HZ       LYS  11   3.875 -12.241 -20.686
   86   2HZ   LYS  11          1HZ       LYS  11   4.361 -13.836 -21.016
   87   3HZ   LYS  11          3HZ       LYS  11   2.735 -13.392 -21.202
   88    H    LEU  12           H        LEU  12   4.205  -7.719 -14.737
   89    HA   LEU  12           HA       LEU  12   7.188  -7.515 -14.643
   90   1HB   LEU  12          2HB       LEU  12   5.987  -5.804 -16.034
   91   2HB   LEU  12          1HB       LEU  12   5.171  -5.260 -14.572
   92    HG   LEU  12           HG       LEU  12   7.370  -4.801 -13.537
   93   1HD1  LEU  12          3HD1      LEU  12   8.277  -6.414 -15.686
   94   2HD1  LEU  12          2HD1      LEU  12   8.936  -4.800 -15.956
   95   3HD1  LEU  12          1HD1      LEU  12   9.257  -5.641 -14.437
   96   1HD2  LEU  12          3HD2      LEU  12   6.240  -3.462 -15.874
   97   2HD2  LEU  12          2HD2      LEU  12   6.819  -2.775 -14.354
   98   3HD2  LEU  12          1HD2      LEU  12   7.957  -3.118 -15.658
   99    H    GLY  13           H        GLY  13   8.000  -6.272 -12.705
  100   1HA   GLY  13          2HA       GLY  13   6.338  -6.956 -10.317
  101   2HA   GLY  13          1HA       GLY  13   8.100  -6.873 -10.314
  102    H    ARG  14           H        ARG  14   7.571  -5.374  -8.427
  103    HA   ARG  14           HA       ARG  14   6.522  -2.723  -9.146
  104   1HB   ARG  14          2HB       ARG  14   6.831  -2.190  -6.808
  105   2HB   ARG  14          1HB       ARG  14   6.135  -3.805  -6.908
  106   1HG   ARG  14          2HG       ARG  14   8.968  -4.081  -7.044
  107   2HG   ARG  14          1HG       ARG  14   8.603  -3.011  -5.691
  108   1HD   ARG  14          2HD       ARG  14   6.676  -5.029  -5.516
  109   2HD   ARG  14          1HD       ARG  14   8.159  -5.879  -5.945
  110    HE   ARG  14           HE       ARG  14   7.614  -4.881  -3.368
  111   1HH1  ARG  14          2HH1      ARG  14  10.088  -5.158  -5.729
  112   2HH1  ARG  14          1HH1      ARG  14  11.360  -4.677  -4.656
  113   1HH2  ARG  14          1HH2      ARG  14   9.233  -4.035  -1.995
  114   2HH2  ARG  14          2HH2      ARG  14  10.876  -4.042  -2.542
  115    H    LYS  15           H        LYS  15   9.614  -4.273  -8.886
  116    HA   LYS  15           HA       LYS  15  11.190  -1.919  -8.511
  117   1HB   LYS  15          2HB       LYS  15  12.181  -4.065  -8.007
  118   2HB   LYS  15          1HB       LYS  15  11.862  -4.644  -9.642
  119   1HG   LYS  15          2HG       LYS  15  13.326  -2.195  -9.839
  120   2HG   LYS  15          1HG       LYS  15  14.160  -3.239  -8.688
  121   1HD   LYS  15          2HD       LYS  15  14.347  -5.008 -10.283
  122   2HD   LYS  15          1HD       LYS  15  13.208  -4.231 -11.383
  123   1HE   LYS  15          2HE       LYS  15  14.906  -2.276 -11.435
  124   2HE   LYS  15          1HE       LYS  15  16.047  -3.431 -10.745
  125   1HZ   LYS  15          3HZ       LYS  15  15.133  -4.909 -12.691
  126   2HZ   LYS  15          2HZ       LYS  15  14.798  -3.398 -13.391
  127   3HZ   LYS  15          1HZ       LYS  15  16.388  -3.799 -12.949
  128    H    ASP  16           H        ASP  16  10.066  -3.727 -11.332
  129    HA   ASP  16           HA       ASP  16  11.447  -2.003 -13.169
  130   1HB   ASP  16          2HB       ASP  16  10.653  -4.451 -13.516
  131   2HB   ASP  16          1HB       ASP  16   9.098  -3.712 -13.864
  132    H    ALA  17           H        ALA  17   8.122  -2.426 -12.055
  133    HA   ALA  17           HA       ALA  17   6.749  -0.594 -13.591
  134   1HB   ALA  17          3HB       ALA  17   6.537  -0.967 -10.594
  135   2HB   ALA  17          2HB       ALA  17   5.338  -0.133 -11.584
  136   3HB   ALA  17          1HB       ALA  17   5.640  -1.855 -11.826
  137    H    GLU  18           H        GLU  18   8.785   0.147 -10.776
  138    HA   GLU  18           HA       GLU  18   8.403   3.009 -10.997
  139   1HB   GLU  18          2HB       GLU  18  10.404   3.127  -9.492
  140   2HB   GLU  18          1HB       GLU  18   9.152   2.044  -8.884
  141   1HG   GLU  18          2HG       GLU  18  10.352   0.102  -9.684
  142   2HG   GLU  18          1HG       GLU  18  11.525   1.115 -10.524
  143    H    ARG  19           H        ARG  19  10.803   0.700 -12.225
  144    HA   ARG  19           HA       ARG  19  12.651   2.571 -13.297
  145   1HB   ARG  19          2HB       ARG  19  12.460  -0.167 -13.246
  146   2HB   ARG  19          1HB       ARG  19  12.192   0.181 -14.954
  147   1HG   ARG  19          2HG       ARG  19  14.443   0.333 -15.128
  148   2HG   ARG  19          1HG       ARG  19  14.292   1.871 -14.277
  149   1HD   ARG  19          2HD       ARG  19  14.255  -0.503 -12.523
  150   2HD   ARG  19          1HD       ARG  19  15.776  -0.253 -13.379
  151    HE   ARG  19           HE       ARG  19  14.995   2.246 -12.293
  152   1HH1  ARG  19          2HH1      ARG  19  16.691  -0.632 -11.673
  153   2HH1  ARG  19          1HH1      ARG  19  17.070  -0.239 -10.029
  154   1HH2  ARG  19          1HH2      ARG  19  15.151   2.648  -9.998
  155   2HH2  ARG  19          2HH2      ARG  19  16.198   1.617  -9.080
  156    H    GLN  20           H        GLN  20  10.343   0.725 -15.292
  157    HA   GLN  20           HA       GLN  20  10.465   2.261 -17.598
  158   1HB   GLN  20          2HB       GLN  20   8.909   0.159 -16.776
  159   2HB   GLN  20          1HB       GLN  20   7.713   1.449 -16.893
  160   1HG   GLN  20          2HG       GLN  20   7.678   1.049 -19.116
  161   2HG   GLN  20          1HG       GLN  20   9.283   1.778 -19.176
  162   1HE2  GLN  20          2HE2      GLN  20   8.882  -2.182 -19.834
  163   2HE2  GLN  20          1HE2      GLN  20   7.544  -1.153 -19.662
  164    H    LEU  21           H        LEU  21   7.927   2.714 -15.090
  165    HA   LEU  21           HA       LEU  21   6.797   5.059 -16.089
  166   1HB   LEU  21          2HB       LEU  21   6.903   3.722 -13.519
  167   2HB   LEU  21          1HB       LEU  21   6.908   5.472 -13.315
  168    HG   LEU  21           HG       LEU  21   4.890   5.705 -14.607
  169   1HD1  LEU  21          3HD1      LEU  21   5.412   2.813 -15.292
  170   2HD1  LEU  21          2HD1      LEU  21   3.805   3.518 -15.469
  171   3HD1  LEU  21          1HD1      LEU  21   5.161   4.172 -16.388
  172   1HD2  LEU  21          3HD2      LEU  21   4.708   3.343 -12.714
  173   2HD2  LEU  21          2HD2      LEU  21   4.507   5.044 -12.293
  174   3HD2  LEU  21          1HD2      LEU  21   3.318   4.243 -13.320
  175    H    LEU  22           H        LEU  22   9.103   5.202 -13.381
  176    HA   LEU  22           HA       LEU  22   9.753   7.874 -13.454
  177   1HB   LEU  22          2HB       LEU  22  11.667   5.557 -13.050
  178   2HB   LEU  22          1HB       LEU  22  12.032   7.232 -12.641
  179    HG   LEU  22           HG       LEU  22   9.924   5.436 -11.427
  180   1HD1  LEU  22          1HD1      LEU  22  12.537   6.026 -10.711
  181   2HD1  LEU  22          3HD1      LEU  22  11.589   7.134  -9.718
  182   3HD1  LEU  22          2HD1      LEU  22  11.297   5.397  -9.628
  183   1HD2  LEU  22          3HD2      LEU  22  10.126   8.436 -11.481
  184   2HD2  LEU  22          2HD2      LEU  22   8.698   7.418 -11.673
  185   3HD2  LEU  22          1HD2      LEU  22   9.432   7.619 -10.081
  186    H    SER  23           H        SER  23  10.661   5.465 -15.821
  187    HA   SER  23           HA       SER  23  12.824   6.778 -17.085
  188   1HB   SER  23          2HB       SER  23  12.580   5.196 -18.716
  189   2HB   SER  23          1HB       SER  23  11.453   4.478 -17.567
  190    HG   SER  23           HG       SER  23  10.211   4.674 -19.291
  191    H    PHE  24           H        PHE  24  11.972   7.285 -19.730
  192    HA   PHE  24           HA       PHE  24  10.567   9.871 -19.306
  193   1HB   PHE  24          2HB       PHE  24  11.354  10.239 -21.738
  194   2HB   PHE  24          1HB       PHE  24  12.596  10.203 -20.486
  195    HD1  PHE  24           HD1      PHE  24  11.056   8.353 -23.281
  196    HD2  PHE  24           HD2      PHE  24  14.128   8.318 -20.279
  197    HE1  PHE  24           HE1      PHE  24  12.155   6.449 -24.428
  198    HE2  PHE  24           HE2      PHE  24  15.228   6.414 -21.426
  199    HZ   PHE  24           HZ       PHE  24  14.241   5.479 -23.500
  200    H    GLY  25           H        GLY  25   8.375   9.507 -19.423
  201   1HA   GLY  25          2HA       GLY  25   7.262   8.698 -21.993
  202   2HA   GLY  25          1HA       GLY  25   6.947   7.532 -20.710
  203    H    ASN  26           H        ASN  26   6.690   9.407 -18.570
  204    HA   ASN  26           HA       ASN  26   4.804  11.490 -19.181
  205   1HB   ASN  26          2HB       ASN  26   3.710   8.897 -19.245
  206   2HB   ASN  26          1HB       ASN  26   3.222   9.572 -17.691
  207   1HD2  ASN  26          1HD2      ASN  26   0.975   9.753 -18.537
  208   2HD2  ASN  26          2HD2      ASN  26   0.567  11.007 -19.604
  209    HA   PRO  27           HA       PRO  27   5.953  12.406 -15.040
  210   1HB   PRO  27          2HB       PRO  27   4.100  14.382 -14.563
  211   2HB   PRO  27          1HB       PRO  27   5.545  14.612 -15.562
  212   1HG   PRO  27          2HG       PRO  27   2.696  14.295 -16.406
  213   2HG   PRO  27          1HG       PRO  27   4.021  15.132 -17.229
  214   1HD   PRO  27          2HD       PRO  27   3.019  12.558 -17.872
  215   2HD   PRO  27          1HD       PRO  27   4.537  13.263 -18.463
  216    H    ARG  28           H        ARG  28   4.397  13.124 -12.920
  217    HA   ARG  28           HA       ARG  28   3.349  10.771 -11.872
  218   1HB   ARG  28          2HB       ARG  28   2.070  12.194 -10.295
  219   2HB   ARG  28          1HB       ARG  28   3.715  12.793 -10.515
  220   1HG   ARG  28          2HG       ARG  28   2.831  14.376 -12.260
  221   2HG   ARG  28          1HG       ARG  28   1.200  13.857 -11.831
  222   1HD   ARG  28          2HD       ARG  28   1.271  14.886  -9.757
  223   2HD   ARG  28          1HD       ARG  28   3.025  14.751  -9.634
  224    HE   ARG  28           HE       ARG  28   2.185  16.550 -11.764
  225   1HH1  ARG  28          1HH2      ARG  28   4.506  17.564 -10.807
  226   2HH1  ARG  28          2HH2      ARG  28   4.123  18.623  -9.491
  227   1HH2  ARG  28          2HH1      ARG  28   0.944  17.323  -9.022
  228   2HH2  ARG  28          1HH1      ARG  28   2.106  18.487  -8.481
  229    H    GLY  29           H        GLY  29   0.953  10.332 -11.360
  230   1HA   GLY  29          2HA       GLY  29  -1.329  10.254 -12.045
  231   2HA   GLY  29          1HA       GLY  29  -0.939  11.326 -13.387
  232    H    THR  30           H        THR  30   1.413   9.032 -13.440
  233    HA   THR  30           HA       THR  30  -0.055   7.467 -15.501
  234    HB   THR  30           HB       THR  30   2.896   7.205 -15.057
  235    HG1  THR  30           HG1      THR  30   1.514   9.483 -15.856
  236   1HG2  THR  30          3HG2      THR  30   1.299   6.042 -16.822
  237   2HG2  THR  30          2HG2      THR  30   1.513   7.565 -17.687
  238   3HG2  THR  30          1HG2      THR  30   2.915   6.574 -17.287
  239    H    PHE  31           H        PHE  31  -1.075   5.813 -14.378
  240    HA   PHE  31           HA       PHE  31   0.666   4.181 -12.580
  241   1HB   PHE  31          2HB       PHE  31  -2.269   3.801 -12.437
  242   2HB   PHE  31          1HB       PHE  31  -1.082   3.882 -11.138
  243    HD1  PHE  31           HD1      PHE  31   0.101   6.324 -10.949
  244    HD2  PHE  31           HD2      PHE  31  -3.791   5.545 -12.576
  245    HE1  PHE  31           HE1      PHE  31  -0.557   8.670 -10.501
  246    HE2  PHE  31           HE2      PHE  31  -4.451   7.890 -12.129
  247    HZ   PHE  31           HZ       PHE  31  -2.834   9.454 -11.091
  248    H    LEU  32           H        LEU  32   1.146   2.178 -13.297
  249    HA   LEU  32           HA       LEU  32  -0.509   1.069 -15.517
  250   1HB   LEU  32          2HB       LEU  32   1.475  -0.180 -16.193
  251   2HB   LEU  32          1HB       LEU  32   1.885   1.530 -16.048
  252    HG   LEU  32           HG       LEU  32   2.419   0.754 -13.525
  253   1HD1  LEU  32          1HD1      LEU  32   2.598  -1.695 -15.263
  254   2HD1  LEU  32          3HD1      LEU  32   3.716  -1.490 -13.915
  255   3HD1  LEU  32          2HD1      LEU  32   1.978  -1.546 -13.620
  256   1HD2  LEU  32          1HD2      LEU  32   3.868   1.623 -15.665
  257   2HD2  LEU  32          3HD2      LEU  32   4.581   1.205 -14.106
  258   3HD2  LEU  32          2HD2      LEU  32   4.578   0.027 -15.418
  259    H    ILE  33           H        ILE  33   0.239  -1.544 -15.453
  260    HA   ILE  33           HA       ILE  33  -0.386  -2.496 -12.697
  261    HB   ILE  33           HB       ILE  33  -1.851  -3.088 -15.257
  262   1HG1  ILE  33          2HG1      ILE  33  -2.609  -2.581 -12.376
  263   2HG1  ILE  33          1HG1      ILE  33  -2.885  -1.522 -13.761
  264   1HG2  ILE  33          2HG2      ILE  33  -1.025  -5.287 -14.460
  265   2HG2  ILE  33          1HG2      ILE  33  -1.746  -4.963 -12.882
  266   3HG2  ILE  33          3HG2      ILE  33  -2.774  -5.140 -14.303
  267   1HD1  ILE  33          3HD1      ILE  33  -4.370  -3.243 -14.757
  268   2HD1  ILE  33          2HD1      ILE  33  -4.122  -4.261 -13.337
  269   3HD1  ILE  33          1HD1      ILE  33  -4.953  -2.714 -13.179
  270    H    ARG  34           H        ARG  34   0.086  -4.998 -12.653
  271    HA   ARG  34           HA       ARG  34   1.810  -6.217 -14.549
  272   1HB   ARG  34          2HB       ARG  34   3.974  -5.878 -13.134
  273   2HB   ARG  34          1HB       ARG  34   3.477  -4.596 -14.238
  274   1HG   ARG  34          2HG       ARG  34   3.143  -3.148 -12.539
  275   2HG   ARG  34          1HG       ARG  34   2.193  -4.329 -11.637
  276   1HD   ARG  34          2HD       ARG  34   4.939  -5.159 -11.617
  277   2HD   ARG  34          1HD       ARG  34   4.858  -3.469 -11.120
  278    HE   ARG  34           HE       ARG  34   3.645  -5.753  -9.687
  279   1HH1  ARG  34          2HH1      ARG  34   2.319  -2.835 -10.161
  280   2HH1  ARG  34          1HH1      ARG  34   2.531  -2.218  -8.557
  281   1HH2  ARG  34          1HH2      ARG  34   4.675  -4.763  -7.580
  282   2HH2  ARG  34          2HH2      ARG  34   3.868  -3.310  -7.094
  283    H    GLU  35           H        GLU  35   2.085  -8.322 -13.956
  284    HA   GLU  35           HA       GLU  35   0.731  -9.452 -11.782
  285   1HB   GLU  35          2HB       GLU  35   1.691 -11.488 -12.414
  286   2HB   GLU  35          1HB       GLU  35   1.804 -10.547 -13.896
  287   1HG   GLU  35          2HG       GLU  35   4.131 -10.003 -13.424
  288   2HG   GLU  35          1HG       GLU  35   4.031 -10.799 -11.853
  289    H    SER  36           H        SER  36   1.239  -9.887  -9.659
  290    HA   SER  36           HA       SER  36   3.582  -8.572  -8.505
  291   1HB   SER  36          2HB       SER  36   1.384 -10.248  -7.249
  292   2HB   SER  36          1HB       SER  36   2.617  -9.368  -6.359
  293    HG   SER  36           HG       SER  36   1.402  -7.693  -6.530
  294    H    GLU  37           H        GLU  37   5.224  -9.685  -7.348
  295    HA   GLU  37           HA       GLU  37   5.469 -12.588  -8.044
  296   1HB   GLU  37          2HB       GLU  37   7.526 -10.441  -7.531
  297   2HB   GLU  37          1HB       GLU  37   7.930 -12.155  -7.555
  298   1HG   GLU  37          2HG       GLU  37   6.330 -11.508  -9.866
  299   2HG   GLU  37          1HG       GLU  37   7.709 -10.412  -9.780
  300    H    THR  38           H        THR  38   4.218 -10.994  -5.708
  301    HA   THR  38           HA       THR  38   5.846 -11.890  -3.426
  302    HB   THR  38           HB       THR  38   4.422  -9.702  -3.640
  303    HG1  THR  38           HG1      THR  38   4.359  -9.652  -1.459
  304   1HG2  THR  38          1HG2      THR  38   2.331 -10.944  -4.247
  305   2HG2  THR  38          3HG2      THR  38   2.313 -11.615  -2.616
  306   3HG2  THR  38          2HG2      THR  38   2.141  -9.876  -2.856
  307    H    THR  39           H        THR  39   2.757 -12.622  -4.963
  308    HA   THR  39           HA       THR  39   2.578 -15.036  -3.190
  309    HB   THR  39           HB       THR  39   0.698 -13.214  -3.272
  310    HG1  THR  39           HG1      THR  39  -0.853 -14.995  -3.123
  311   1HG2  THR  39          2HG2      THR  39   0.744 -13.641  -5.921
  312   2HG2  THR  39          1HG2      THR  39  -0.447 -14.859  -5.470
  313   3HG2  THR  39          3HG2      THR  39  -0.725 -13.165  -5.069
  314    H    LYS  40           H        LYS  40   0.923 -16.657  -4.592
  315    HA   LYS  40           HA       LYS  40   2.489 -18.058  -6.371
  316   1HB   LYS  40          2HB       LYS  40  -0.456 -17.716  -6.905
  317   2HB   LYS  40          1HB       LYS  40   0.530 -19.163  -7.109
  318   1HG   LYS  40          2HG       LYS  40   0.908 -19.008  -4.550
  319   2HG   LYS  40          1HG       LYS  40  -0.471 -17.908  -4.559
  320   1HD   LYS  40          2HD       LYS  40  -0.718 -20.529  -5.992
  321   2HD   LYS  40          1HD       LYS  40  -0.833 -20.515  -4.233
  322   1HE   LYS  40          2HE       LYS  40  -2.403 -18.344  -5.129
  323   2HE   LYS  40          1HE       LYS  40  -2.805 -19.702  -6.181
  324   1HZ   LYS  40          1HZ       LYS  40  -2.747 -20.903  -3.806
  325   2HZ   LYS  40          3HZ       LYS  40  -3.268 -19.358  -3.338
  326   3HZ   LYS  40          2HZ       LYS  40  -4.156 -20.239  -4.488
  327    H    GLY  41           H        GLY  41   0.426 -15.290  -7.068
  328   1HA   GLY  41          2HA       GLY  41   1.924 -14.096  -9.028
  329   2HA   GLY  41          1HA       GLY  41   1.014 -15.320  -9.917
  330    H    ALA  42           H        ALA  42   0.495 -12.751  -7.514
  331    HA   ALA  42           HA       ALA  42  -2.303 -12.374  -8.317
  332   1HB   ALA  42          3HB       ALA  42  -0.618 -11.633  -6.112
  333   2HB   ALA  42          2HB       ALA  42  -1.306 -10.167  -6.810
  334   3HB   ALA  42          1HB       ALA  42  -2.370 -11.459  -6.251
  335    H    TYR  43           H        TYR  43  -2.285  -9.502  -8.224
  336    HA   TYR  43           HA       TYR  43  -0.585  -8.879 -10.582
  337   1HB   TYR  43          2HB       TYR  43  -3.425  -9.021 -10.625
  338   2HB   TYR  43          1HB       TYR  43  -2.958  -7.323 -10.786
  339    HD1  TYR  43           HD1      TYR  43  -0.503  -7.231 -12.147
  340    HD2  TYR  43           HD2      TYR  43  -3.711 -10.034 -12.734
  341    HE1  TYR  43           HE1      TYR  43   0.319  -7.700 -14.441
  342    HE2  TYR  43           HE2      TYR  43  -2.879 -10.506 -15.021
  343    HH   TYR  43           HH       TYR  43  -0.044 -10.038 -16.073
  344    H    SER  44           H        SER  44  -1.190  -6.201 -10.880
  345    HA   SER  44           HA       SER  44  -1.050  -4.889  -8.276
  346   1HB   SER  44          2HB       SER  44   1.389  -4.823 -10.019
  347   2HB   SER  44          1HB       SER  44   1.199  -4.218  -8.364
  348    HG   SER  44           HG       SER  44   1.253  -6.886  -9.272
  349    H    LEU  45           H        LEU  45  -0.690  -2.561  -8.462
  350    HA   LEU  45           HA       LEU  45  -1.227  -1.455 -11.179
  351   1HB   LEU  45          2HB       LEU  45  -3.405  -1.430 -10.177
  352   2HB   LEU  45          1HB       LEU  45  -2.761  -0.870  -8.634
  353    HG   LEU  45           HG       LEU  45  -2.087   1.257  -9.687
  354   1HD1  LEU  45          1HD1      LEU  45  -2.569  -0.279 -12.086
  355   2HD1  LEU  45          3HD1      LEU  45  -3.536   1.196 -12.112
  356   3HD1  LEU  45          2HD1      LEU  45  -1.785   1.292 -11.918
  357   1HD2  LEU  45          2HD2      LEU  45  -4.902   0.287  -9.734
  358   2HD2  LEU  45          1HD2      LEU  45  -4.181   1.602  -8.806
  359   3HD2  LEU  45          3HD2      LEU  45  -4.574   1.836 -10.509
  360    H    SER  46           H        SER  46   0.923  -0.702 -11.260
  361    HA   SER  46           HA       SER  46   2.136   0.773  -9.085
  362   1HB   SER  46          2HB       SER  46   3.219   1.279 -11.765
  363   2HB   SER  46          1HB       SER  46   4.016   0.620 -10.337
  364    HG   SER  46           HG       SER  46   3.730  -1.290 -11.113
  365    H    ILE  47           H        ILE  47   2.572   3.034  -9.017
  366    HA   ILE  47           HA       ILE  47   0.924   4.697 -10.866
  367    HB   ILE  47           HB       ILE  47  -0.042   5.908  -9.141
  368   1HG1  ILE  47          2HG1      ILE  47   2.137   4.976  -7.243
  369   2HG1  ILE  47          1HG1      ILE  47   2.173   6.512  -8.109
  370   1HG2  ILE  47          3HG2      ILE  47  -0.747   3.531  -8.975
  371   2HG2  ILE  47          2HG2      ILE  47   0.525   3.257  -7.785
  372   3HG2  ILE  47          1HG2      ILE  47  -0.806   4.353  -7.416
  373   1HD1  ILE  47          1HD1      ILE  47  -0.129   5.696  -6.324
  374   2HD1  ILE  47          3HD1      ILE  47   1.253   6.623  -5.740
  375   3HD1  ILE  47          2HD1      ILE  47   0.207   7.295  -6.991
  376    H    ARG  48           H        ARG  48   1.872   6.688 -11.450
  377    HA   ARG  48           HA       ARG  48   4.759   6.913 -10.730
  378   1HB   ARG  48          2HB       ARG  48   4.344   6.718 -13.130
  379   2HB   ARG  48          1HB       ARG  48   3.190   8.051 -13.066
  380   1HG   ARG  48          2HG       ARG  48   4.993   9.326 -13.630
  381   2HG   ARG  48          1HG       ARG  48   5.385   9.205 -11.915
  382   1HD   ARG  48          2HD       ARG  48   6.912   7.414 -12.286
  383   2HD   ARG  48          1HD       ARG  48   6.310   7.141 -13.921
  384    HE   ARG  48           HE       ARG  48   8.107   8.586 -14.460
  385   1HH1  ARG  48          1HH1      ARG  48   7.523  11.107 -11.491
  386   2HH1  ARG  48          2HH1      ARG  48   7.152   9.423 -11.335
  387   1HH2  ARG  48          1HH2      ARG  48   8.200  10.915 -14.886
  388   2HH2  ARG  48          2HH2      ARG  48   8.117  11.952 -13.501
  389    H    ASP  49           H        ASP  49   5.434   8.673  -9.568
  390    HA   ASP  49           HA       ASP  49   3.849  11.143  -9.565
  391   1HB   ASP  49          2HB       ASP  49   2.647   9.850  -7.880
  392   2HB   ASP  49          1HB       ASP  49   4.160   9.470  -7.055
  393    H    TRP  50           H        TRP  50   5.259  12.813  -9.424
  394    HA   TRP  50           HA       TRP  50   7.984  12.260  -8.315
  395   1HB   TRP  50          2HB       TRP  50   8.295  12.897 -10.569
  396   2HB   TRP  50          1HB       TRP  50   6.980  14.067 -10.512
  397    HD1  TRP  50           HD1      TRP  50  10.662  13.809 -10.115
  398    HE1  TRP  50           HE1      TRP  50  11.623  16.045  -9.249
  399    HE3  TRP  50           HE3      TRP  50   6.354  16.127  -8.861
  400    HZ2  TRP  50           HZ2      TRP  50  10.646  18.533  -8.210
  401    HZ3  TRP  50           HZ3      TRP  50   6.361  18.429  -7.937
  402    HH2  TRP  50           HH2      TRP  50   8.503  19.638  -7.609
  403    H    ASP  51           H        ASP  51   8.988  14.138  -7.192
  404    HA   ASP  51           HA       ASP  51   7.068  16.086  -6.049
  405   1HB   ASP  51          2HB       ASP  51   7.973  13.764  -4.662
  406   2HB   ASP  51          1HB       ASP  51   8.762  15.160  -3.930
  407    H    ASP  52           H        ASP  52   8.171  17.944  -5.095
  408    HA   ASP  52           HA       ASP  52  10.789  18.442  -6.367
  409   1HB   ASP  52          2HB       ASP  52   8.563  20.036  -5.779
  410   2HB   ASP  52          1HB       ASP  52   9.807  20.575  -4.652
  411    H    MET  53           H        MET  53  10.824  16.521  -4.264
  412    HA   MET  53           HA       MET  53  12.698  17.878  -2.461
  413   1HB   MET  53          2HB       MET  53  10.425  16.130  -1.483
  414   2HB   MET  53          1HB       MET  53  11.728  16.753  -0.475
  415   1HG   MET  53          2HG       MET  53  10.728  18.764  -0.275
  416   2HG   MET  53          1HG       MET  53  10.454  18.875  -2.011
  417   1HE   MET  53          3HE       MET  53   9.323  16.713  -2.862
  418   2HE   MET  53          2HE       MET  53   8.005  15.863  -2.060
  419   3HE   MET  53          1HE       MET  53   7.659  17.296  -3.024
  420    H    LYS  54           H        LYS  54  12.394  15.612  -4.664
  421    HA   LYS  54           HA       LYS  54  14.614  14.083  -3.724
  422   1HB   LYS  54          2HB       LYS  54  13.325  11.872  -3.614
  423   2HB   LYS  54          1HB       LYS  54  13.127  12.968  -2.248
  424   1HG   LYS  54          2HG       LYS  54  11.040  13.837  -3.255
  425   2HG   LYS  54          1HG       LYS  54  11.233  12.724  -4.609
  426   1HD   LYS  54          2HD       LYS  54  10.002  11.280  -3.366
  427   2HD   LYS  54          1HD       LYS  54  11.473  11.054  -2.421
  428   1HE   LYS  54          2HE       LYS  54  10.772  12.942  -0.947
  429   2HE   LYS  54          1HE       LYS  54   9.265  13.056  -1.856
  430   1HZ   LYS  54          1HZ       LYS  54   9.115  10.541  -1.303
  431   2HZ   LYS  54          3HZ       LYS  54  10.189  10.930  -0.049
  432   3HZ   LYS  54          2HZ       LYS  54   8.672  11.689  -0.132
  433    H    GLY  55           H        GLY  55  11.967  14.439  -6.024
  434   1HA   GLY  55          2HA       GLY  55  12.783  14.410  -8.409
  435   2HA   GLY  55          1HA       GLY  55  13.597  12.919  -7.962
  436    H    ASP  56           H        ASP  56  12.203  12.103  -9.824
  437    HA   ASP  56           HA       ASP  56   9.351  11.938  -9.441
  438   1HB   ASP  56          2HB       ASP  56   9.528  10.177 -11.246
  439   2HB   ASP  56          1HB       ASP  56  10.240  11.728 -11.674
  440    H    HIS  57           H        HIS  57   8.325   9.612  -9.349
  441    HA   HIS  57           HA       HIS  57   9.817   7.610  -7.857
  442   1HB   HIS  57          2HB       HIS  57   7.923   9.481  -6.480
  443   2HB   HIS  57          1HB       HIS  57   7.968   7.795  -5.967
  444    HD1  HIS  57           HD1      HIS  57   9.998  10.936  -6.004
  445    HD2  HIS  57           HD2      HIS  57  10.452   6.974  -4.791
  446    HE1  HIS  57           HE1      HIS  57  12.097  10.856  -4.590
  447    H    VAL  58           H        VAL  58   7.939   5.992  -6.953
  448    HA   VAL  58           HA       VAL  58   5.597   5.903  -8.686
  449    HB   VAL  58           HB       VAL  58   8.068   4.378  -9.274
  450   1HG1  VAL  58          1HG1      VAL  58   5.318   3.093  -9.438
  451   2HG1  VAL  58          3HG1      VAL  58   6.767   2.460 -10.222
  452   3HG1  VAL  58          2HG1      VAL  58   6.675   2.529  -8.462
  453   1HG2  VAL  58          2HG2      VAL  58   5.636   5.288 -10.811
  454   2HG2  VAL  58          1HG2      VAL  58   7.252   5.994 -10.843
  455   3HG2  VAL  58          3HG2      VAL  58   6.973   4.399 -11.544
  456    H    LYS  59           H        LYS  59   4.027   5.090  -7.416
  457    HA   LYS  59           HA       LYS  59   4.778   3.425  -5.070
  458   1HB   LYS  59          2HB       LYS  59   2.996   5.508  -5.323
  459   2HB   LYS  59          1HB       LYS  59   1.937   4.104  -5.461
  460   1HG   LYS  59          2HG       LYS  59   2.020   4.459  -3.140
  461   2HG   LYS  59          1HG       LYS  59   3.249   3.217  -3.384
  462   1HD   LYS  59          2HD       LYS  59   5.011   4.901  -3.383
  463   2HD   LYS  59          1HD       LYS  59   3.818   6.195  -3.282
  464   1HE   LYS  59          2HE       LYS  59   3.018   5.040  -1.119
  465   2HE   LYS  59          1HE       LYS  59   4.534   4.141  -1.187
  466   1HZ   LYS  59          2HZ       LYS  59   4.280   7.101  -1.170
  467   2HZ   LYS  59          1HZ       LYS  59   4.749   6.141   0.151
  468   3HZ   LYS  59          3HZ       LYS  59   5.737   6.230  -1.224
  469    H    HIS  60           H        HIS  60   2.495   1.901  -4.741
  470    HA   HIS  60           HA       HIS  60   1.867   0.565  -7.274
  471   1HB   HIS  60          2HB       HIS  60   3.195  -1.127  -5.172
  472   2HB   HIS  60          1HB       HIS  60   2.902  -1.509  -6.865
  473    HD1  HIS  60           HD1      HIS  60   4.589  -0.668  -8.595
  474    HD2  HIS  60           HD2      HIS  60   5.415   0.677  -4.736
  475    HE1  HIS  60           HE1      HIS  60   6.890   0.385  -8.681
  476    H    TYR  61           H        TYR  61   0.179  -0.960  -7.074
  477    HA   TYR  61           HA       TYR  61  -1.121  -1.145  -4.398
  478   1HB   TYR  61          2HB       TYR  61  -2.288  -0.121  -6.972
  479   2HB   TYR  61          1HB       TYR  61  -3.328  -1.017  -5.865
  480    HD1  TYR  61           HD1      TYR  61  -3.797  -0.179  -3.607
  481    HD2  TYR  61           HD2      TYR  61  -1.401   2.062  -6.379
  482    HE1  TYR  61           HE1      TYR  61  -4.046   1.842  -2.189
  483    HE2  TYR  61           HE2      TYR  61  -1.651   4.082  -4.963
  484    HH   TYR  61           HH       TYR  61  -3.001   3.937  -1.777
  485    H    LYS  62           H        LYS  62  -0.496  -3.308  -4.204
  486    HA   LYS  62           HA       LYS  62  -0.464  -5.282  -6.183
  487   1HB   LYS  62          2HB       LYS  62   0.359  -5.515  -3.823
  488   2HB   LYS  62          1HB       LYS  62  -1.309  -5.721  -3.305
  489   1HG   LYS  62          2HG       LYS  62  -0.739  -7.458  -5.546
  490   2HG   LYS  62          1HG       LYS  62   0.448  -7.712  -4.265
  491   1HD   LYS  62          2HD       LYS  62  -2.404  -7.469  -3.433
  492   2HD   LYS  62          1HD       LYS  62  -1.941  -8.950  -4.270
  493   1HE   LYS  62          2HE       LYS  62  -1.077  -9.712  -2.334
  494   2HE   LYS  62          1HE       LYS  62   0.123  -8.421  -2.409
  495   1HZ   LYS  62          3HZ       LYS  62  -2.237  -7.261  -1.546
  496   2HZ   LYS  62          2HZ       LYS  62  -2.073  -8.699  -0.657
  497   3HZ   LYS  62          1HZ       LYS  62  -0.832  -7.538  -0.637
  498    H    ILE  63           H        ILE  63  -2.067  -5.862  -7.518
  499    HA   ILE  63           HA       ILE  63  -4.869  -5.429  -6.826
  500    HB   ILE  63           HB       ILE  63  -3.354  -6.318  -9.246
  501   1HG1  ILE  63          2HG1      ILE  63  -5.708  -4.665  -9.610
  502   2HG1  ILE  63          1HG1      ILE  63  -4.674  -4.010  -8.341
  503   1HG2  ILE  63          2HG2      ILE  63  -6.297  -6.885  -8.770
  504   2HG2  ILE  63          1HG2      ILE  63  -5.538  -6.892 -10.361
  505   3HG2  ILE  63          3HG2      ILE  63  -5.040  -8.064  -9.141
  506   1HD1  ILE  63          1HD1      ILE  63  -2.997  -4.895 -10.478
  507   2HD1  ILE  63          3HD1      ILE  63  -4.278  -3.896 -11.166
  508   3HD1  ILE  63          2HD1      ILE  63  -3.244  -3.250  -9.894
  509    H    ARG  64           H        ARG  64  -6.455  -7.115  -6.745
  510    HA   ARG  64           HA       ARG  64  -5.379  -9.828  -6.106
  511   1HB   ARG  64          2HB       ARG  64  -7.684  -8.425  -4.718
  512   2HB   ARG  64          1HB       ARG  64  -7.044 -10.021  -4.325
  513   1HG   ARG  64          2HG       ARG  64  -5.642  -7.350  -4.033
  514   2HG   ARG  64          1HG       ARG  64  -6.096  -8.467  -2.746
  515   1HD   ARG  64          2HD       ARG  64  -4.571 -10.047  -4.437
  516   2HD   ARG  64          1HD       ARG  64  -3.744  -8.491  -4.490
  517    HE   ARG  64           HE       ARG  64  -3.513  -8.627  -2.028
  518   1HH1  ARG  64          1HH2      ARG  64  -5.405 -10.428  -0.978
  519   2HH1  ARG  64          2HH2      ARG  64  -4.610 -11.966  -0.929
  520   1HH2  ARG  64          2HH1      ARG  64  -2.118 -11.045  -3.157
  521   2HH2  ARG  64          1HH1      ARG  64  -2.749 -12.316  -2.163
  522    H    LYS  65           H        LYS  65  -7.351 -11.455  -6.192
  523    HA   LYS  65           HA       LYS  65  -9.502 -10.644  -7.997
  524   1HB   LYS  65          2HB       LYS  65  -7.737 -10.983  -9.633
  525   2HB   LYS  65          1HB       LYS  65  -7.342 -12.553  -8.934
  526   1HG   LYS  65          2HG       LYS  65  -9.741 -13.244  -9.439
  527   2HG   LYS  65          1HG       LYS  65  -9.880 -11.760 -10.382
  528   1HD   LYS  65          2HD       LYS  65  -9.002 -12.908 -12.116
  529   2HD   LYS  65          1HD       LYS  65  -7.474 -12.905 -11.235
  530   1HE   LYS  65          2HE       LYS  65  -9.250 -14.947 -10.194
  531   2HE   LYS  65          1HE       LYS  65  -9.014 -15.154 -11.930
  532   1HZ   LYS  65          1HZ       LYS  65  -6.537 -14.528 -10.907
  533   2HZ   LYS  65          3HZ       LYS  65  -7.196 -15.635  -9.803
  534   3HZ   LYS  65          2HZ       LYS  65  -7.063 -16.051 -11.445
  535    H    LEU  66           H        LEU  66 -11.255 -11.873  -7.631
  536    HA   LEU  66           HA       LEU  66 -11.152 -14.013  -5.665
  537   1HB   LEU  66          2HB       LEU  66 -13.317 -12.707  -7.289
  538   2HB   LEU  66          1HB       LEU  66 -13.650 -14.201  -6.418
  539    HG   LEU  66           HG       LEU  66 -13.309 -13.207  -4.328
  540   1HD1  LEU  66          2HD1      LEU  66 -11.714 -11.150  -5.858
  541   2HD1  LEU  66          1HD1      LEU  66 -12.184 -10.915  -4.174
  542   3HD1  LEU  66          3HD1      LEU  66 -11.136 -12.264  -4.615
  543   1HD2  LEU  66          1HD2      LEU  66 -14.896 -11.770  -6.202
  544   2HD2  LEU  66          3HD2      LEU  66 -15.083 -11.831  -4.448
  545   3HD2  LEU  66          2HD2      LEU  66 -14.069 -10.586  -5.184
  546    H    ASP  67           H        ASP  67 -11.542 -16.222  -6.037
  547    HA   ASP  67           HA       ASP  67 -10.721 -17.220  -8.636
  548   1HB   ASP  67          2HB       ASP  67 -11.302 -18.317  -5.989
  549   2HB   ASP  67          1HB       ASP  67 -11.944 -19.332  -7.278
  550    H    ASN  68           H        ASN  68 -13.638 -16.242  -7.156
  551    HA   ASN  68           HA       ASN  68 -15.365 -17.740  -9.030
  552   1HB   ASN  68          2HB       ASN  68 -16.108 -15.547  -7.068
  553   2HB   ASN  68          1HB       ASN  68 -17.209 -16.679  -7.854
  554   1HD2  ASN  68          2HD2      ASN  68 -15.143 -17.834  -4.543
  555   2HD2  ASN  68          1HD2      ASN  68 -14.916 -16.296  -5.222
  556    H    GLY  69           H        GLY  69 -13.497 -14.955  -9.066
  557   1HA   GLY  69          2HA       GLY  69 -13.330 -13.674 -11.139
  558   2HA   GLY  69          1HA       GLY  69 -15.062 -13.892 -11.341
  559    H    GLY  70           H        GLY  70 -12.651 -12.280  -9.289
  560   1HA   GLY  70          2HA       GLY  70 -14.430  -9.989  -9.041
  561   2HA   GLY  70          1HA       GLY  70 -14.026 -10.789  -7.534
  562    H    TYR  71           H        TYR  71 -12.571  -9.155 -10.354
  563    HA   TYR  71           HA       TYR  71  -9.926  -9.053  -9.153
  564   1HB   TYR  71          2HB       TYR  71 -11.248  -7.928 -11.564
  565   2HB   TYR  71          1HB       TYR  71  -9.854  -7.038 -10.954
  566    HD1  TYR  71           HD1      TYR  71  -7.736  -8.494 -10.357
  567    HD2  TYR  71           HD2      TYR  71 -10.913  -9.778 -12.946
  568    HE1  TYR  71           HE1      TYR  71  -6.221 -10.162 -11.388
  569    HE2  TYR  71           HE2      TYR  71  -9.400 -11.453 -13.973
  570    HH   TYR  71           HH       TYR  71  -7.297 -12.190 -14.107
  571    H    TYR  72           H        TYR  72  -9.430  -7.795  -7.410
  572    HA   TYR  72           HA       TYR  72 -10.563  -5.045  -7.271
  573   1HB   TYR  72          2HB       TYR  72 -11.198  -5.299  -4.937
  574   2HB   TYR  72          1HB       TYR  72 -12.012  -6.546  -5.872
  575    HD1  TYR  72           HD1      TYR  72 -11.208  -8.885  -5.821
  576    HD2  TYR  72           HD2      TYR  72  -9.466  -5.859  -3.339
  577    HE1  TYR  72           HE1      TYR  72 -10.109 -10.627  -4.472
  578    HE2  TYR  72           HE2      TYR  72  -8.373  -7.588  -1.975
  579    HH   TYR  72           HH       TYR  72  -8.975 -10.209  -1.499
  580    H    ILE  73           H        ILE  73  -8.879  -3.643  -6.797
  581    HA   ILE  73           HA       ILE  73  -6.323  -4.763  -5.866
  582    HB   ILE  73           HB       ILE  73  -6.895  -1.805  -5.930
  583   1HG1  ILE  73          2HG1      ILE  73  -6.610  -3.655  -8.312
  584   2HG1  ILE  73          1HG1      ILE  73  -7.884  -2.476  -8.007
  585   1HG2  ILE  73          1HG2      ILE  73  -4.542  -3.629  -6.423
  586   2HG2  ILE  73          3HG2      ILE  73  -4.517  -1.941  -6.933
  587   3HG2  ILE  73          2HG2      ILE  73  -4.703  -2.342  -5.227
  588   1HD1  ILE  73          1HD1      ILE  73  -4.977  -1.705  -8.373
  589   2HD1  ILE  73          3HD1      ILE  73  -6.135  -1.755  -9.701
  590   3HD1  ILE  73          2HD1      ILE  73  -6.379  -0.637  -8.360
  591    H    THR  74           H        THR  74  -9.171  -3.294  -4.648
  592    HA   THR  74           HA       THR  74  -8.128  -3.556  -1.883
  593    HB   THR  74           HB       THR  74  -8.292  -1.310  -1.664
  594    HG1  THR  74           HG1      THR  74 -10.689  -0.666  -1.699
  595   1HG2  THR  74          3HG2      THR  74  -8.452  -1.187  -4.216
  596   2HG2  THR  74          2HG2      THR  74 -10.200  -1.085  -3.993
  597   3HG2  THR  74          1HG2      THR  74  -9.152   0.168  -3.327
  598    H    THR  75           H        THR  75  -9.587  -4.562  -0.546
  599    HA   THR  75           HA       THR  75 -11.599  -6.172  -1.747
  600    HB   THR  75           HB       THR  75 -12.241  -6.750   0.561
  601    HG1  THR  75           HG1      THR  75 -12.115  -4.952   1.731
  602   1HG2  THR  75          3HG2      THR  75  -9.670  -6.919  -0.660
  603   2HG2  THR  75          2HG2      THR  75  -9.432  -6.705   1.079
  604   3HG2  THR  75          1HG2      THR  75 -10.409  -8.047   0.482
  605    H    ARG  76           H        ARG  76 -11.752  -2.883  -1.049
  606    HA   ARG  76           HA       ARG  76 -14.497  -2.661  -0.237
  607   1HB   ARG  76          2HB       ARG  76 -12.429  -0.899  -0.447
  608   2HB   ARG  76          1HB       ARG  76 -13.363  -0.476  -1.882
  609   1HG   ARG  76          2HG       ARG  76 -14.738   0.704  -0.539
  610   2HG   ARG  76          1HG       ARG  76 -15.266  -0.828   0.158
  611   1HD   ARG  76          2HD       ARG  76 -12.814  -0.339   1.394
  612   2HD   ARG  76          1HD       ARG  76 -13.576   1.250   1.321
  613    HE   ARG  76           HE       ARG  76 -14.883  -1.135   2.570
  614   1HH1  ARG  76          2HH1      ARG  76 -13.379   1.659   3.449
  615   2HH1  ARG  76          1HH1      ARG  76 -14.718   2.360   4.293
  616   1HH2  ARG  76          1HH2      ARG  76 -17.004   0.012   3.160
  617   2HH2  ARG  76          2HH2      ARG  76 -16.771   1.428   4.129
  618    H    ALA  77           H        ALA  77 -12.988  -3.356  -3.299
  619    HA   ALA  77           HA       ALA  77 -15.623  -3.662  -4.522
  620   1HB   ALA  77          3HB       ALA  77 -13.895  -1.305  -5.138
  621   2HB   ALA  77          2HB       ALA  77 -14.805  -2.044  -6.457
  622   3HB   ALA  77          1HB       ALA  77 -15.653  -1.412  -5.045
  623    H    GLN  78           H        GLN  78 -15.528  -5.227  -6.044
  624    HA   GLN  78           HA       GLN  78 -12.898  -5.890  -7.284
  625   1HB   GLN  78          2HB       GLN  78 -14.310  -8.234  -7.432
  626   2HB   GLN  78          1HB       GLN  78 -13.151  -7.875  -6.161
  627   1HG   GLN  78          2HG       GLN  78 -16.047  -7.078  -5.926
  628   2HG   GLN  78          1HG       GLN  78 -15.480  -8.667  -5.416
  629   1HE2  GLN  78          2HE2      GLN  78 -13.294  -7.126  -2.858
  630   2HE2  GLN  78          1HE2      GLN  78 -13.125  -8.234  -4.132
  631    H    PHE  79           H        PHE  79 -13.383  -7.298  -9.366
  632    HA   PHE  79           HA       PHE  79 -15.871  -6.388 -10.709
  633   1HB   PHE  79          2HB       PHE  79 -13.058  -5.781 -11.635
  634   2HB   PHE  79          1HB       PHE  79 -14.443  -5.751 -12.731
  635    HD1  PHE  79           HD1      PHE  79 -13.263  -4.413  -9.445
  636    HD2  PHE  79           HD2      PHE  79 -15.807  -3.833 -12.854
  637    HE1  PHE  79           HE1      PHE  79 -13.883  -2.176  -8.596
  638    HE2  PHE  79           HE2      PHE  79 -16.433  -1.588 -12.002
  639    HZ   PHE  79           HZ       PHE  79 -15.469  -0.757  -9.871
  640    H    GLU  80           H        GLU  80 -15.257  -7.334 -13.268
  641    HA   GLU  80           HA       GLU  80 -15.195 -10.221 -12.649
  642   1HB   GLU  80          2HB       GLU  80 -16.030 -10.454 -15.015
  643   2HB   GLU  80          1HB       GLU  80 -17.074  -9.490 -13.974
  644   1HG   GLU  80          2HG       GLU  80 -15.177  -7.709 -15.101
  645   2HG   GLU  80          1HG       GLU  80 -15.786  -8.710 -16.418
  646    H    THR  81           H        THR  81 -13.410  -7.839 -14.615
  647    HA   THR  81           HA       THR  81 -11.234  -9.858 -14.781
  648    HB   THR  81           HB       THR  81 -11.796 -10.273 -16.953
  649    HG1  THR  81           HG1      THR  81 -11.203  -7.727 -17.817
  650   1HG2  THR  81          1HG2      THR  81 -13.963  -9.043 -16.552
  651   2HG2  THR  81          3HG2      THR  81 -13.148  -7.597 -17.144
  652   3HG2  THR  81          2HG2      THR  81 -13.370  -8.984 -18.212
  653    H    LEU  82           H        LEU  82  -9.309  -8.605 -16.014
  654    HA   LEU  82           HA       LEU  82  -8.756  -6.325 -14.295
  655   1HB   LEU  82          2HB       LEU  82  -7.219  -7.955 -16.260
  656   2HB   LEU  82          1HB       LEU  82  -6.654  -6.310 -15.960
  657    HG   LEU  82           HG       LEU  82  -7.392  -7.804 -13.525
  658   1HD1  LEU  82          3HD1      LEU  82  -6.134  -9.371 -15.332
  659   2HD1  LEU  82          2HD1      LEU  82  -4.737  -8.573 -14.610
  660   3HD1  LEU  82          1HD1      LEU  82  -5.849  -9.492 -13.595
  661   1HD2  LEU  82          3HD2      LEU  82  -6.277  -5.562 -13.609
  662   2HD2  LEU  82          2HD2      LEU  82  -5.362  -6.761 -12.693
  663   3HD2  LEU  82          1HD2      LEU  82  -4.866  -6.337 -14.331
  664    H    GLN  83           H        GLN  83  -9.571  -6.894 -17.663
  665    HA   GLN  83           HA       GLN  83  -9.156  -4.160 -18.491
  666   1HB   GLN  83          2HB       GLN  83  -9.277  -6.246 -19.992
  667   2HB   GLN  83          1HB       GLN  83 -11.027  -6.123 -19.815
  668   1HG   GLN  83          2HG       GLN  83 -10.076  -3.515 -20.417
  669   2HG   GLN  83          1HG       GLN  83  -9.291  -4.619 -21.547
  670   1HE2  GLN  83          2HE2      GLN  83 -12.446  -5.703 -22.981
  671   2HE2  GLN  83          1HE2      GLN  83 -10.920  -6.308 -22.549
  672    H    GLN  84           H        GLN  84 -12.024  -6.052 -17.522
  673    HA   GLN  84           HA       GLN  84 -13.898  -3.941 -17.904
  674   1HB   GLN  84          2HB       GLN  84 -13.916  -6.363 -16.113
  675   2HB   GLN  84          1HB       GLN  84 -15.218  -5.191 -16.062
  676   1HG   GLN  84          2HG       GLN  84 -14.567  -7.174 -18.178
  677   2HG   GLN  84          1HG       GLN  84 -16.123  -6.563 -17.660
  678   1HE2  GLN  84          2HE2      GLN  84 -14.040  -4.591 -20.592
  679   2HE2  GLN  84          1HE2      GLN  84 -13.227  -5.667 -19.566
  680    H    LEU  85           H        LEU  85 -11.702  -4.653 -15.238
  681    HA   LEU  85           HA       LEU  85 -12.939  -2.624 -13.544
  682   1HB   LEU  85          2HB       LEU  85 -11.496  -3.299 -11.914
  683   2HB   LEU  85          1HB       LEU  85 -11.284  -4.691 -12.967
  684    HG   LEU  85           HG       LEU  85  -9.457  -2.900 -13.994
  685   1HD1  LEU  85          1HD1      LEU  85  -9.832  -2.432 -11.062
  686   2HD1  LEU  85          3HD1      LEU  85  -8.206  -2.375 -11.738
  687   3HD1  LEU  85          2HD1      LEU  85  -9.446  -1.272 -12.332
  688   1HD2  LEU  85          1HD2      LEU  85  -9.532  -5.409 -12.793
  689   2HD2  LEU  85          3HD2      LEU  85  -8.173  -4.682 -13.650
  690   3HD2  LEU  85          2HD2      LEU  85  -8.306  -4.506 -11.899
  691    H    VAL  86           H        VAL  86 -10.122  -2.705 -15.733
  692    HA   VAL  86           HA       VAL  86  -9.241  -0.103 -15.167
  693    HB   VAL  86           HB       VAL  86  -8.160  -0.110 -17.285
  694   1HG1  VAL  86          1HG1      VAL  86  -8.281  -2.465 -15.675
  695   2HG1  VAL  86          3HG1      VAL  86  -8.136  -2.965 -17.359
  696   3HG1  VAL  86          2HG1      VAL  86  -6.936  -1.886 -16.651
  697   1HG2  VAL  86          2HG2      VAL  86 -10.650  -1.173 -18.173
  698   2HG2  VAL  86          1HG2      VAL  86  -9.295  -0.628 -19.155
  699   3HG2  VAL  86          3HG2      VAL  86  -9.391  -2.311 -18.641
  700    H    GLN  87           H        GLN  87 -12.087  -1.273 -16.658
  701    HA   GLN  87           HA       GLN  87 -12.888   1.130 -18.024
  702   1HB   GLN  87          2HB       GLN  87 -13.758  -1.200 -18.467
  703   2HB   GLN  87          1HB       GLN  87 -14.667  -1.066 -16.969
  704   1HG   GLN  87          2HG       GLN  87 -16.094  -0.424 -18.845
  705   2HG   GLN  87          1HG       GLN  87 -15.762   0.977 -17.825
  706   1HE2  GLN  87          2HE2      GLN  87 -15.000   2.491 -20.991
  707   2HE2  GLN  87          1HE2      GLN  87 -16.227   2.299 -19.834
  708    H    HIS  88           H        HIS  88 -13.745  -0.328 -14.913
  709    HA   HIS  88           HA       HIS  88 -15.507   1.828 -14.160
  710   1HB   HIS  88          2HB       HIS  88 -15.491  -0.590 -13.261
  711   2HB   HIS  88          1HB       HIS  88 -14.156  -0.063 -12.239
  712    HD1  HIS  88           HD1      HIS  88 -14.682   1.780 -10.441
  713    HD2  HIS  88           HD2      HIS  88 -18.030   0.401 -12.508
  714    HE1  HIS  88           HE1      HIS  88 -16.705   2.594  -9.152
  715    H    TYR  89           H        TYR  89 -12.275   0.832 -13.192
  716    HA   TYR  89           HA       TYR  89 -11.720   3.122 -11.580
  717   1HB   TYR  89          2HB       TYR  89  -9.951   1.089 -12.946
  718   2HB   TYR  89          1HB       TYR  89  -9.369   2.278 -11.808
  719    HD1  TYR  89           HD1      TYR  89 -11.573  -0.645 -12.226
  720    HD2  TYR  89           HD2      TYR  89  -9.715   1.965  -9.377
  721    HE1  TYR  89           HE1      TYR  89 -12.199  -2.186 -10.411
  722    HE2  TYR  89           HE2      TYR  89 -10.330   0.423  -7.558
  723    HH   TYR  89           HH       TYR  89 -11.068  -1.687  -7.105
  724    H    SER  90           H        SER  90 -11.966   2.631 -14.910
  725    HA   SER  90           HA       SER  90  -9.987   4.319 -15.996
  726   1HB   SER  90          2HB       SER  90 -12.273   2.915 -16.920
  727   2HB   SER  90          1HB       SER  90 -12.401   4.576 -17.494
  728    HG   SER  90           HG       SER  90 -10.947   4.071 -18.898
  729    H    GLU  91           H        GLU  91 -12.912   5.022 -14.298
  730    HA   GLU  91           HA       GLU  91 -12.420   7.924 -14.799
  731   1HB   GLU  91          2HB       GLU  91 -15.138   6.614 -14.496
  732   2HB   GLU  91          1HB       GLU  91 -14.822   8.319 -14.824
  733   1HG   GLU  91          2HG       GLU  91 -13.395   6.834 -16.777
  734   2HG   GLU  91          1HG       GLU  91 -15.012   6.136 -16.692
  735    H    ARG  92           H        ARG  92 -12.710   5.404 -12.536
  736    HA   ARG  92           HA       ARG  92 -13.036   7.495 -10.402
  737   1HB   ARG  92          2HB       ARG  92 -13.968   4.825  -9.627
  738   2HB   ARG  92          1HB       ARG  92 -14.705   6.399  -9.348
  739   1HG   ARG  92          2HG       ARG  92 -15.194   6.289 -11.944
  740   2HG   ARG  92          1HG       ARG  92 -15.021   4.553 -11.688
  741   1HD   ARG  92          2HD       ARG  92 -17.088   4.461 -10.805
  742   2HD   ARG  92          1HD       ARG  92 -16.620   5.627  -9.567
  743    HE   ARG  92           HE       ARG  92 -17.339   6.737 -12.211
  744   1HH1  ARG  92          1HH2      ARG  92 -17.450   8.680 -10.172
  745   2HH1  ARG  92          2HH2      ARG  92 -19.075   8.631  -9.570
  746   1HH2  ARG  92          2HH1      ARG  92 -19.758   5.508 -10.914
  747   2HH2  ARG  92          1HH1      ARG  92 -20.381   6.836  -9.991
  748    H    ALA  93           H        ALA  93 -11.627   7.368  -8.719
  749    HA   ALA  93           HA       ALA  93  -9.234   5.802  -8.930
  750   1HB   ALA  93          1HB       ALA  93  -9.411   7.929  -7.633
  751   2HB   ALA  93          3HB       ALA  93 -10.430   7.100  -6.456
  752   3HB   ALA  93          2HB       ALA  93  -8.749   6.610  -6.667
  753    H    ALA  94           H        ALA  94 -12.122   5.522  -6.880
  754    HA   ALA  94           HA       ALA  94 -13.229   3.507  -6.257
  755   1HB   ALA  94          3HB       ALA  94 -11.745   2.323  -7.994
  756   2HB   ALA  94          2HB       ALA  94 -10.640   2.015  -6.654
  757   3HB   ALA  94          1HB       ALA  94 -12.280   1.369  -6.610
  758    H    GLY  95           H        GLY  95 -10.320   4.872  -5.106
  759   1HA   GLY  95          2HA       GLY  95 -10.777   5.103  -2.497
  760   2HA   GLY  95          1HA       GLY  95 -10.489   3.369  -2.562
  761    H    LEU  96           H        LEU  96  -8.453   3.700  -4.735
  762    HA   LEU  96           HA       LEU  96  -6.187   4.198  -2.966
  763   1HB   LEU  96          2HB       LEU  96  -4.848   3.324  -4.701
  764   2HB   LEU  96          1HB       LEU  96  -6.362   2.438  -4.855
  765    HG   LEU  96           HG       LEU  96  -5.499   4.832  -6.489
  766   1HD1  LEU  96          1HD1      LEU  96  -5.939   1.905  -7.104
  767   2HD1  LEU  96          3HD1      LEU  96  -5.758   3.138  -8.353
  768   3HD1  LEU  96          2HD1      LEU  96  -4.429   2.808  -7.241
  769   1HD2  LEU  96          3HD2      LEU  96  -8.083   3.269  -6.556
  770   2HD2  LEU  96          2HD2      LEU  96  -7.896   4.944  -6.027
  771   3HD2  LEU  96          1HD2      LEU  96  -7.611   4.515  -7.713
  772    H    SER  97           H        SER  97  -4.402   5.715  -3.692
  773    HA   SER  97           HA       SER  97  -5.595   8.327  -4.296
  774   1HB   SER  97          2HB       SER  97  -3.231   9.137  -3.941
  775   2HB   SER  97          1HB       SER  97  -3.912   8.265  -2.568
  776    HG   SER  97           HG       SER  97  -2.573   6.781  -4.502
  777    H    SER  98           H        SER  98  -4.053   5.822  -6.067
  778    HA   SER  98           HA       SER  98  -3.785   7.699  -8.379
  779   1HB   SER  98          2HB       SER  98  -1.781   5.935  -7.168
  780   2HB   SER  98          1HB       SER  98  -1.962   5.690  -8.905
  781    HG   SER  98           HG       SER  98  -1.982   8.212  -8.735
  782    H    ARG  99           H        ARG  99  -5.774   7.048  -9.295
  783    HA   ARG  99           HA       ARG  99  -6.706   4.401  -9.551
  784   1HB   ARG  99          2HB       ARG  99  -7.849   6.696 -10.030
  785   2HB   ARG  99          1HB       ARG  99  -7.167   6.528 -11.641
  786   1HG   ARG  99          2HG       ARG  99  -9.601   5.634 -11.078
  787   2HG   ARG  99          1HG       ARG  99  -8.560   4.772 -12.194
  788   1HD   ARG  99          2HD       ARG  99  -8.568   4.122  -9.258
  789   2HD   ARG  99          1HD       ARG  99  -9.732   3.405 -10.372
  790    HE   ARG  99           HE       ARG  99  -7.194   3.018 -11.524
  791   1HH1  ARG  99          2HH1      ARG  99  -7.911   2.564  -8.271
  792   2HH1  ARG  99          1HH1      ARG  99  -7.498   0.886  -8.243
  793   1HH2  ARG  99          1HH2      ARG  99  -7.085   0.667 -11.676
  794   2HH2  ARG  99          2HH2      ARG  99  -7.039  -0.190 -10.173
  795    H    LEU 100           H        LEU 100  -6.937   4.796 -12.676
  796    HA   LEU 100           HA       LEU 100  -4.371   3.392 -13.249
  797   1HB   LEU 100          2HB       LEU 100  -5.846   2.878 -15.454
  798   2HB   LEU 100          1HB       LEU 100  -5.920   1.872 -14.010
  799    HG   LEU 100           HG       LEU 100  -7.839   3.346 -13.213
  800   1HD1  LEU 100          3HD1      LEU 100  -7.094   5.154 -14.951
  801   2HD1  LEU 100          2HD1      LEU 100  -8.043   4.203 -16.091
  802   3HD1  LEU 100          1HD1      LEU 100  -8.814   4.907 -14.673
  803   1HD2  LEU 100          2HD2      LEU 100  -8.029   1.661 -15.706
  804   2HD2  LEU 100          1HD2      LEU 100  -8.465   1.226 -14.052
  805   3HD2  LEU 100          3HD2      LEU 100  -9.460   2.367 -14.957
  806    H    VAL 101           H        VAL 101  -3.760   3.798 -15.775
  807    HA   VAL 101           HA       VAL 101  -2.834   6.406 -16.005
  808    HB   VAL 101           HB       VAL 101  -3.167   5.918 -18.605
  809   1HG1  VAL 101          3HG1      VAL 101  -1.089   5.843 -17.006
  810   2HG1  VAL 101          2HG1      VAL 101  -1.310   4.095 -17.102
  811   3HG1  VAL 101          1HG1      VAL 101  -1.003   5.026 -18.568
  812   1HG2  VAL 101          3HG2      VAL 101  -4.565   3.796 -17.533
  813   2HG2  VAL 101          2HG2      VAL 101  -3.888   3.848 -19.161
  814   3HG2  VAL 101          1HG2      VAL 101  -2.979   3.095 -17.852
  815    H    VAL 102           H        VAL 102  -3.797   8.319 -16.185
  816    HA   VAL 102           HA       VAL 102  -6.675   8.495 -16.626
  817    HB   VAL 102           HB       VAL 102  -4.976  10.944 -16.627
  818   1HG1  VAL 102          2HG1      VAL 102  -7.687  10.177 -16.107
  819   2HG1  VAL 102          1HG1      VAL 102  -7.013  10.880 -14.636
  820   3HG1  VAL 102          3HG1      VAL 102  -6.997  11.800 -16.141
  821   1HG2  VAL 102          1HG2      VAL 102  -5.133   8.954 -14.371
  822   2HG2  VAL 102          3HG2      VAL 102  -3.727   9.835 -14.969
  823   3HG2  VAL 102          2HG2      VAL 102  -4.964  10.677 -14.035
  824    HA   PRO 103           HA       PRO 103  -5.226  10.676 -20.621
  825   1HB   PRO 103          2HB       PRO 103  -2.564  10.487 -21.278
  826   2HB   PRO 103          1HB       PRO 103  -3.245  11.807 -20.315
  827   1HG   PRO 103          2HG       PRO 103  -1.581   9.493 -19.435
  828   2HG   PRO 103          1HG       PRO 103  -1.763  11.087 -18.688
  829   1HD   PRO 103          2HD       PRO 103  -3.012   8.676 -17.850
  830   2HD   PRO 103          1HD       PRO 103  -3.396  10.310 -17.277
  831    H    SER 104           H        SER 104  -2.838   8.018 -20.243
  832    HA   SER 104           HA       SER 104  -2.597   6.015 -21.440
  833   1HB   SER 104          2HB       SER 104  -5.551   6.545 -21.831
  834   2HB   SER 104          1HB       SER 104  -4.755   5.096 -22.442
  835    HG   SER 104           HG       SER 104  -5.279   4.432 -20.495
  836    H    HIS 105           H        HIS 105  -1.589   8.136 -22.773
  837    HA   HIS 105           HA       HIS 105  -2.677   8.801 -25.295
  838   1HB   HIS 105          2HB       HIS 105  -0.452   9.487 -25.920
  839   2HB   HIS 105          1HB       HIS 105  -0.643   9.840 -24.203
  840    HD1  HIS 105           HD1      HIS 105   1.392   7.892 -26.575
  841    HD2  HIS 105           HD2      HIS 105   0.651   7.842 -22.472
  842    HE1  HIS 105           HE1      HIS 105   3.208   6.463 -25.536
  843    H    LYS 106           HN       LYS 106  -0.562   6.078 -24.389
  844    HA   LYS 106           HA       LYS 106   0.018   4.939 -26.825
  845   1HB   LYS 106          2HB       LYS 106   0.277   4.062 -24.307
  846   2HB   LYS 106          1HB       LYS 106  -1.106   3.077 -24.783
  847   1HG   LYS 106          2HG       LYS 106   0.530   1.681 -25.574
  848   2HG   LYS 106          1HG       LYS 106   0.462   2.759 -26.970
  849   1HD   LYS 106          2HD       LYS 106   2.368   3.975 -26.264
  850   2HD   LYS 106          1HD       LYS 106   2.268   3.342 -24.622
  851   1HE   LYS 106          2HE       LYS 106   2.535   1.017 -25.949
  852   2HE   LYS 106          1HE       LYS 106   3.380   2.076 -27.078
  853   1HZ   LYS 106          2HZ       LYS 106   4.310   2.867 -24.660
  854   2HZ   LYS 106          1HZ       LYS 106   4.170   1.185 -24.468
  855   3HZ   LYS 106          3HZ       LYS 106   5.114   1.816 -25.727
  856   1H    GLU 201          1HT       GLU 201   6.263  -4.534   6.382
  857   2H    GLU 201          3HT       GLU 201   6.332  -4.868   8.043
  858   3H    GLU 201          2HT       GLU 201   7.400  -5.647   6.976
  859    HA   GLU 201           HA       GLU 201   5.943  -7.220   6.445
  860   1HB   GLU 201          2HB       GLU 201   5.260  -6.125   9.034
  861   2HB   GLU 201          1HB       GLU 201   3.823  -6.782   8.250
  862   1HG   GLU 201          2HG       GLU 201   6.455  -8.255   8.582
  863   2HG   GLU 201          1HG       GLU 201   5.018  -8.509   9.572
  864    HA   PRO 202           HA       PRO 202   1.867  -4.985   5.355
  865   1HB   PRO 202          2HB       PRO 202   1.608  -2.358   6.123
  866   2HB   PRO 202          1HB       PRO 202   1.100  -3.726   7.129
  867   1HG   PRO 202          2HG       PRO 202   3.481  -1.958   7.431
  868   2HG   PRO 202          1HG       PRO 202   2.604  -2.879   8.664
  869   1HD   PRO 202          2HD       PRO 202   5.070  -3.612   7.482
  870   2HD   PRO 202          1HD       PRO 202   4.030  -4.660   8.470
  871    H    GLN 203           H        GLN 203   2.650  -4.994   3.204
  872    HA   GLN 203           HA       GLN 203   3.999  -2.489   2.282
  873   1HB   GLN 203          2HB       GLN 203   4.000  -5.261   1.046
  874   2HB   GLN 203          1HB       GLN 203   4.820  -3.849   0.378
  875   1HG   GLN 203          2HG       GLN 203   5.751  -3.841   2.954
  876   2HG   GLN 203          1HG       GLN 203   5.591  -5.571   2.646
  877   1HE2  GLN 203          2HE2      GLN 203   8.924  -4.948   1.350
  878   2HE2  GLN 203          1HE2      GLN 203   8.120  -5.270   2.811
  879   1HN   PTR 204          1HN       PTR 204   3.466  -2.149  -0.201
  880    HA   PTR 204           HA       PTR 204   1.825  -1.573  -1.776
  881   1HB   PTR 204          1HB       PTR 204  -0.229  -3.189  -1.742
  882    HD1  PTR 204           HD1      PTR 204   1.329  -2.296  -3.816
  883    HD2  PTR 204           HD2      PTR 204   1.984  -5.838  -1.473
  884    HE1  PTR 204           HE1      PTR 204   2.661  -3.277  -5.665
  885    HE2  PTR 204           HE2      PTR 204   3.315  -6.817  -3.320
  886    H    GLU 205           H        GLU 205   0.755   0.302  -1.398
  887    HA   GLU 205           HA       GLU 205  -0.537   0.928   1.085
  888   1HB   GLU 205          2HB       GLU 205  -0.651   2.187  -1.664
  889   2HB   GLU 205          1HB       GLU 205  -1.536   2.845  -0.287
  890   1HG   GLU 205          2HG       GLU 205   1.394   2.243  -0.009
  891   2HG   GLU 205          1HG       GLU 205   0.883   3.731  -0.808
  892    H    GLU 206           H        GLU 206  -2.365  -0.079   1.766
  893    HA   GLU 206           HA       GLU 206  -4.297  -1.100  -0.230
  894   1HB   GLU 206          2HB       GLU 206  -4.007  -1.433   2.762
  895   2HB   GLU 206          1HB       GLU 206  -5.426  -2.007   1.888
  896   1HG   GLU 206          2HG       GLU 206  -4.306  -3.854   1.270
  897   2HG   GLU 206          1HG       GLU 206  -3.105  -2.854   0.452
  898    H    ILE 207           H        ILE 207  -6.222  -0.085  -0.645
  899    HA   ILE 207           HA       ILE 207  -6.730   2.564   0.072
  900    HB   ILE 207           HB       ILE 207  -8.553   0.333  -0.803
  901   1HG1  ILE 207          2HG1      ILE 207  -8.770   1.982  -2.747
  902   2HG1  ILE 207          1HG1      ILE 207  -7.454   2.884  -1.992
  903   1HG2  ILE 207          1HG2      ILE 207  -9.362   3.190  -0.184
  904   2HG2  ILE 207          3HG2      ILE 207 -10.374   2.000  -1.004
  905   3HG2  ILE 207          2HG2      ILE 207  -9.911   1.754   0.681
  906   1HD1  ILE 207          1HD1      ILE 207  -7.084  -0.055  -2.375
  907   2HD1  ILE 207          3HD1      ILE 207  -6.969   0.981  -3.798
  908   3HD1  ILE 207          2HD1      ILE 207  -5.890   1.242  -2.428
  909    HA   PRO 208           HA       PRO 208  -9.334   1.079   3.794
  910   1HB   PRO 208          2HB       PRO 208  -9.079  -1.550   4.553
  911   2HB   PRO 208          1HB       PRO 208 -10.311  -0.976   3.416
  912   1HG   PRO 208          2HG       PRO 208  -7.817  -2.511   2.862
  913   2HG   PRO 208          1HG       PRO 208  -9.328  -2.455   1.940
  914   1HD   PRO 208          2HD       PRO 208  -6.940  -1.088   1.296
  915   2HD   PRO 208          1HD       PRO 208  -8.537  -0.796   0.581
  916    H    ILE 209           H        ILE 209  -8.715   0.513   6.138
  917    HA   ILE 209           HA       ILE 209  -5.810   0.079   6.534
  918    HB   ILE 209           HB       ILE 209  -7.324   2.530   7.474
  919   1HG1  ILE 209          2HG1      ILE 209  -4.680   2.515   6.049
  920   2HG1  ILE 209          1HG1      ILE 209  -6.157   2.269   5.115
  921   1HG2  ILE 209          2HG2      ILE 209  -4.565   1.511   8.220
  922   2HG2  ILE 209          1HG2      ILE 209  -5.174   3.120   8.607
  923   3HG2  ILE 209          3HG2      ILE 209  -5.944   1.696   9.305
  924   1HD1  ILE 209          3HD1      ILE 209  -7.082   4.361   6.180
  925   2HD1  ILE 209          2HD1      ILE 209  -5.488   4.637   6.882
  926   3HD1  ILE 209          1HD1      ILE 209  -5.693   4.640   5.131
  927    H    TYR 210           H        TYR 210  -9.007   0.556   7.981
  928    HA   TYR 210           HA       TYR 210  -8.296  -0.451  10.584
  929   1HB   TYR 210          2HB       TYR 210 -10.769   0.269   9.143
  930   2HB   TYR 210          1HB       TYR 210 -10.972  -0.995  10.354
  931    HD1  TYR 210           HD1      TYR 210  -8.921   2.143  10.074
  932    HD2  TYR 210           HD2      TYR 210 -11.665  -0.185  12.421
  933    HE1  TYR 210           HE1      TYR 210  -8.831   3.849  11.871
  934    HE2  TYR 210           HE2      TYR 210 -11.575   1.522  14.218
  935    HH   TYR 210           HH       TYR 210 -10.770   3.488  14.845
  936    H    LEU 211           HN       LEU 211 -10.007  -2.476  11.192
  937    HA   LEU 211           HA       LEU 211  -9.913  -4.835  11.223
  938   1HB   LEU 211          2HB       LEU 211 -11.516  -3.955   9.269
  939   2HB   LEU 211          1HB       LEU 211 -10.333  -4.802   8.271
  940    HG   LEU 211           HG       LEU 211 -12.045  -6.400   8.825
  941   1HD1  LEU 211          3HD1      LEU 211  -9.613  -6.738  10.605
  942   2HD1  LEU 211          2HD1      LEU 211 -10.757  -8.027  10.229
  943   3HD1  LEU 211          1HD1      LEU 211  -9.788  -7.304   8.945
  944   1HD2  LEU 211          3HD2      LEU 211 -12.611  -4.889  10.958
  945   2HD2  LEU 211          2HD2      LEU 211 -13.066  -6.592  10.887
  946   3HD2  LEU 211          1HD2      LEU 211 -11.618  -6.102  11.766
   
  No H/Q in entry =         946
  Start of MODEL    6
    1   1H    SER   1          3HT       SER   1  -9.451  -4.036 -25.284
    2   2H    SER   1          2HT       SER   1  -9.599  -5.515 -26.108
    3   3H    SER   1          1HT       SER   1 -10.931  -4.864 -25.278
    4    HA   SER   1           HA       SER   1 -10.299  -5.707 -23.330
    5   1HB   SER   1          2HB       SER   1  -9.264  -7.300 -25.458
    6   2HB   SER   1          1HB       SER   1  -8.084  -7.329 -24.147
    7    HG   SER   1           HG       SER   1  -9.953  -8.883 -24.135
    8    H    ILE   2           H        ILE   2  -8.162  -6.351 -21.955
    9    HA   ILE   2           HA       ILE   2  -6.896  -4.043 -21.123
   10    HB   ILE   2           HB       ILE   2  -6.587  -6.060 -19.866
   11   1HG1  ILE   2          2HG1      ILE   2  -3.821  -5.724 -20.960
   12   2HG1  ILE   2          1HG1      ILE   2  -4.602  -4.329 -20.215
   13   1HG2  ILE   2          3HG2      ILE   2  -6.597  -7.434 -22.101
   14   2HG2  ILE   2          2HG2      ILE   2  -4.846  -7.248 -22.008
   15   3HG2  ILE   2          1HG2      ILE   2  -5.717  -8.058 -20.705
   16   1HD1  ILE   2          2HD1      ILE   2  -5.135  -6.502 -18.501
   17   2HD1  ILE   2          1HD1      ILE   2  -3.436  -6.656 -18.946
   18   3HD1  ILE   2          3HD1      ILE   2  -4.022  -5.167 -18.205
   19    H    GLN   3           H        GLN   3  -5.005  -2.888 -21.720
   20    HA   GLN   3           HA       GLN   3  -4.214  -3.265 -24.532
   21   1HB   GLN   3          2HB       GLN   3  -3.866  -1.086 -22.489
   22   2HB   GLN   3          1HB       GLN   3  -2.869  -1.104 -23.942
   23   1HG   GLN   3          2HG       GLN   3  -5.901  -1.106 -23.854
   24   2HG   GLN   3          1HG       GLN   3  -4.875   0.247 -24.332
   25   1HE2  GLN   3          2HE2      GLN   3  -5.967  -2.285 -27.163
   26   2HE2  GLN   3          1HE2      GLN   3  -6.797  -2.019 -25.707
   27    H    ALA   4           H        ALA   4  -1.733  -1.840 -22.667
   28    HA   ALA   4           HA       ALA   4  -0.241  -3.934 -21.623
   29   1HB   ALA   4          2HB       ALA   4  -0.397  -3.933 -24.556
   30   2HB   ALA   4          1HB       ALA   4   1.236  -4.072 -23.906
   31   3HB   ALA   4          3HB       ALA   4   0.003  -5.252 -23.456
   32    H    GLU   5           H        GLU   5  -0.520  -1.010 -21.515
   33    HA   GLU   5           HA       GLU   5   2.214  -0.306 -21.081
   34   1HB   GLU   5          2HB       GLU   5   2.190   1.490 -23.008
   35   2HB   GLU   5          1HB       GLU   5   2.689  -0.166 -23.354
   36   1HG   GLU   5          2HG       GLU   5   0.790  -0.627 -24.558
   37   2HG   GLU   5          1HG       GLU   5  -0.223   0.406 -23.550
   38    H    GLU   6           H        GLU   6  -1.059   0.837 -21.814
   39    HA   GLU   6           HA       GLU   6  -0.709   3.481 -20.756
   40   1HB   GLU   6          2HB       GLU   6  -3.094   1.702 -21.217
   41   2HB   GLU   6          1HB       GLU   6  -3.279   3.247 -20.384
   42   1HG   GLU   6          2HG       GLU   6  -1.715   3.935 -22.547
   43   2HG   GLU   6          1HG       GLU   6  -2.772   2.700 -23.231
   44    H    TRP   7           H        TRP   7  -2.459   0.766 -19.265
   45    HA   TRP   7           HA       TRP   7  -1.445   1.688 -16.612
   46   1HB   TRP   7          2HB       TRP   7  -3.686   0.763 -15.759
   47   2HB   TRP   7          1HB       TRP   7  -3.760   2.274 -16.670
   48    HD1  TRP   7           HD1      TRP   7  -4.963   2.261 -18.979
   49    HE1  TRP   7           HE1      TRP   7  -6.321   0.491 -20.272
   50    HE3  TRP   7           HE3      TRP   7  -3.862  -1.888 -16.213
   51    HZ2  TRP   7           HZ2      TRP   7  -6.863  -2.315 -20.152
   52    HZ3  TRP   7           HZ3      TRP   7  -4.809  -4.095 -16.826
   53    HH2  TRP   7           HH2      TRP   7  -6.306  -4.313 -18.791
   54    H    TYR   8           H        TYR   8  -1.256  -0.737 -18.835
   55    HA   TYR   8           HA       TYR   8  -0.544  -2.705 -16.757
   56   1HB   TYR   8          2HB       TYR   8  -2.631  -3.596 -17.062
   57   2HB   TYR   8          1HB       TYR   8  -2.806  -2.918 -18.672
   58    HD1  TYR   8           HD1      TYR   8  -1.785  -4.026 -20.625
   59    HD2  TYR   8           HD2      TYR   8  -1.673  -5.796 -16.712
   60    HE1  TYR   8           HE1      TYR   8  -1.178  -6.209 -21.632
   61    HE2  TYR   8           HE2      TYR   8  -1.057  -7.972 -17.718
   62    HH   TYR   8           HH       TYR   8  -0.428  -9.021 -19.596
   63    H    PHE   9           H        PHE   9   1.329  -3.655 -17.237
   64    HA   PHE   9           HA       PHE   9   2.433  -3.320 -19.974
   65   1HB   PHE   9          2HB       PHE   9   3.638  -3.836 -17.261
   66   2HB   PHE   9          1HB       PHE   9   4.560  -4.167 -18.725
   67    HD1  PHE   9           HD1      PHE   9   2.060  -1.490 -18.768
   68    HD2  PHE   9           HD2      PHE   9   6.210  -2.399 -18.092
   69    HE1  PHE   9           HE1      PHE   9   2.623   0.914 -18.947
   70    HE2  PHE   9           HE2      PHE   9   6.763   0.007 -18.276
   71    HZ   PHE   9           HZ       PHE   9   4.971   1.665 -18.704
   72    H    GLY  10           H        GLY  10   1.845  -5.810 -17.502
   73   1HA   GLY  10          2HA       GLY  10   0.938  -7.915 -18.861
   74   2HA   GLY  10          1HA       GLY  10   2.604  -7.924 -19.432
   75    H    LYS  11           H        LYS  11   3.945  -9.181 -18.261
   76    HA   LYS  11           HA       LYS  11   3.164  -9.884 -15.469
   77   1HB   LYS  11          2HB       LYS  11   5.313 -11.318 -17.002
   78   2HB   LYS  11          1HB       LYS  11   4.217 -11.945 -15.770
   79   1HG   LYS  11          2HG       LYS  11   2.518 -11.068 -17.805
   80   2HG   LYS  11          1HG       LYS  11   3.865 -11.817 -18.664
   81   1HD   LYS  11          2HD       LYS  11   3.295 -13.515 -16.478
   82   2HD   LYS  11          1HD       LYS  11   1.736 -13.087 -17.181
   83   1HE   LYS  11          2HE       LYS  11   3.941 -13.805 -19.060
   84   2HE   LYS  11          1HE       LYS  11   3.204 -15.114 -18.138
   85   1HZ   LYS  11          2HZ       LYS  11   1.023 -13.896 -18.909
   86   2HZ   LYS  11          1HZ       LYS  11   2.028 -13.383 -20.179
   87   3HZ   LYS  11          3HZ       LYS  11   1.795 -15.040 -19.899
   88    H    LEU  12           H        LEU  12   4.054  -7.619 -15.103
   89    HA   LEU  12           HA       LEU  12   7.032  -7.611 -14.973
   90   1HB   LEU  12          2HB       LEU  12   5.803  -5.769 -16.207
   91   2HB   LEU  12          1HB       LEU  12   5.152  -5.262 -14.650
   92    HG   LEU  12           HG       LEU  12   7.402  -4.912 -13.784
   93   1HD1  LEU  12          1HD1      LEU  12   8.082  -6.551 -16.077
   94   2HD1  LEU  12          3HD1      LEU  12   9.016  -5.053 -16.088
   95   3HD1  LEU  12          2HD1      LEU  12   9.080  -6.120 -14.684
   96   1HD2  LEU  12          3HD2      LEU  12   6.488  -3.592 -16.282
   97   2HD2  LEU  12          2HD2      LEU  12   6.811  -2.899 -14.692
   98   3HD2  LEU  12          1HD2      LEU  12   8.148  -3.271 -15.781
   99    H    GLY  13           H        GLY  13   7.944  -6.455 -13.014
  100   1HA   GLY  13          2HA       GLY  13   6.367  -7.224 -10.595
  101   2HA   GLY  13          1HA       GLY  13   8.129  -7.187 -10.660
  102    H    ARG  14           H        ARG  14   7.898  -5.737  -8.745
  103    HA   ARG  14           HA       ARG  14   6.832  -3.039  -9.299
  104   1HB   ARG  14          2HB       ARG  14   6.977  -2.653  -6.991
  105   2HB   ARG  14          1HB       ARG  14   6.614  -4.373  -7.074
  106   1HG   ARG  14          2HG       ARG  14   9.434  -3.283  -6.863
  107   2HG   ARG  14          1HG       ARG  14   8.473  -3.766  -5.468
  108   1HD   ARG  14          2HD       ARG  14   8.150  -5.984  -6.905
  109   2HD   ARG  14          1HD       ARG  14   9.672  -5.458  -7.622
  110    HE   ARG  14           HE       ARG  14  10.256  -5.271  -4.978
  111   1HH1  ARG  14          2HH1      ARG  14   9.711  -7.737  -7.206
  112   2HH1  ARG  14          1HH1      ARG  14   9.739  -9.024  -6.046
  113   1HH2  ARG  14          1HH2      ARG  14   9.837  -6.905  -3.303
  114   2HH2  ARG  14          2HH2      ARG  14   9.810  -8.552  -3.836
  115    H    LYS  15           H        LYS  15   9.843  -4.699  -9.322
  116    HA   LYS  15           HA       LYS  15  11.539  -2.430  -8.886
  117   1HB   LYS  15          2HB       LYS  15  11.995  -5.159 -10.093
  118   2HB   LYS  15          1HB       LYS  15  13.277  -3.951  -9.999
  119   1HG   LYS  15          2HG       LYS  15  12.969  -3.817  -7.551
  120   2HG   LYS  15          1HG       LYS  15  11.688  -5.025  -7.647
  121   1HD   LYS  15          2HD       LYS  15  13.365  -6.597  -8.691
  122   2HD   LYS  15          1HD       LYS  15  14.614  -5.403  -8.340
  123   1HE   LYS  15          2HE       LYS  15  12.944  -5.921  -6.010
  124   2HE   LYS  15          1HE       LYS  15  13.699  -7.399  -6.608
  125   1HZ   LYS  15          2HZ       LYS  15  15.559  -5.281  -6.674
  126   2HZ   LYS  15          1HZ       LYS  15  14.880  -5.381  -5.120
  127   3HZ   LYS  15          3HZ       LYS  15  15.635  -6.737  -5.803
  128    H    ASP  16           H        ASP  16  10.230  -4.060 -11.741
  129    HA   ASP  16           HA       ASP  16  11.586  -2.271 -13.540
  130   1HB   ASP  16          2HB       ASP  16  10.748  -4.690 -13.985
  131   2HB   ASP  16          1HB       ASP  16   9.192  -3.915 -14.249
  132    H    ALA  17           H        ALA  17   8.281  -2.720 -12.368
  133    HA   ALA  17           HA       ALA  17   6.916  -0.760 -13.756
  134   1HB   ALA  17          1HB       ALA  17   6.740  -1.670 -10.900
  135   2HB   ALA  17          3HB       ALA  17   5.729  -0.335 -11.457
  136   3HB   ALA  17          2HB       ALA  17   5.594  -1.921 -12.219
  137    H    GLU  18           H        GLU  18   9.000  -0.270 -10.919
  138    HA   GLU  18           HA       GLU  18   8.650   2.600 -10.891
  139   1HB   GLU  18          2HB       GLU  18  10.693   2.579  -9.446
  140   2HB   GLU  18          1HB       GLU  18   9.459   1.445  -8.895
  141   1HG   GLU  18          2HG       GLU  18  10.628  -0.414  -9.919
  142   2HG   GLU  18          1HG       GLU  18  11.788   0.677 -10.678
  143    H    ARG  19           H        ARG  19  10.999   0.391 -12.379
  144    HA   ARG  19           HA       ARG  19  12.787   2.380 -13.373
  145   1HB   ARG  19          2HB       ARG  19  12.447  -0.441 -13.622
  146   2HB   ARG  19          1HB       ARG  19  12.604   0.228 -15.245
  147   1HG   ARG  19          2HG       ARG  19  14.489   1.509 -13.470
  148   2HG   ARG  19          1HG       ARG  19  14.678  -0.243 -13.383
  149   1HD   ARG  19          2HD       ARG  19  14.549   1.311 -15.983
  150   2HD   ARG  19          1HD       ARG  19  16.055   0.842 -15.194
  151    HE   ARG  19           HE       ARG  19  14.222  -0.954 -16.618
  152   1HH1  ARG  19          2HH1      ARG  19  14.782  -2.203 -13.949
  153   2HH1  ARG  19          1HH1      ARG  19  16.224  -3.108 -14.268
  154   1HH2  ARG  19          1HH2      ARG  19  16.950  -1.419 -17.209
  155   2HH2  ARG  19          2HH2      ARG  19  17.451  -2.663 -16.113
  156    H    GLN  20           H        GLN  20  10.586   0.522 -15.466
  157    HA   GLN  20           HA       GLN  20  10.573   2.174 -17.673
  158   1HB   GLN  20          2HB       GLN  20   9.078  -0.005 -16.882
  159   2HB   GLN  20          1HB       GLN  20   7.858   1.263 -17.003
  160   1HG   GLN  20          2HG       GLN  20   7.984   1.286 -19.259
  161   2HG   GLN  20          1HG       GLN  20   9.746   1.350 -19.227
  162   1HE2  GLN  20          1HE2      GLN  20   7.713  -0.416 -20.793
  163   2HE2  GLN  20          2HE2      GLN  20   8.286  -1.993 -20.542
  164    H    LEU  21           H        LEU  21   8.073   2.423 -15.106
  165    HA   LEU  21           HA       LEU  21   6.844   4.767 -15.965
  166   1HB   LEU  21          2HB       LEU  21   7.436   3.903 -13.124
  167   2HB   LEU  21          1HB       LEU  21   6.307   5.187 -13.557
  168    HG   LEU  21           HG       LEU  21   6.116   2.240 -14.219
  169   1HD1  LEU  21          1HD1      LEU  21   4.298   4.223 -12.816
  170   2HD1  LEU  21          3HD1      LEU  21   3.868   2.548 -13.167
  171   3HD1  LEU  21          2HD1      LEU  21   5.194   2.905 -12.061
  172   1HD2  LEU  21          2HD2      LEU  21   4.628   4.591 -15.413
  173   2HD2  LEU  21          1HD2      LEU  21   5.564   3.364 -16.268
  174   3HD2  LEU  21          3HD2      LEU  21   4.037   2.931 -15.499
  175    H    LEU  22           H        LEU  22   9.230   4.851 -13.314
  176    HA   LEU  22           HA       LEU  22   9.750   7.554 -13.244
  177   1HB   LEU  22          2HB       LEU  22  11.562   5.185 -12.874
  178   2HB   LEU  22          1HB       LEU  22  12.222   6.818 -12.775
  179    HG   LEU  22           HG       LEU  22   9.731   6.590 -11.290
  180   1HD1  LEU  22          3HD1      LEU  22  11.845   4.522 -10.895
  181   2HD1  LEU  22          2HD1      LEU  22  11.128   5.235  -9.450
  182   3HD1  LEU  22          1HD1      LEU  22  10.106   4.414 -10.630
  183   1HD2  LEU  22          2HD2      LEU  22  11.643   8.319 -11.179
  184   2HD2  LEU  22          1HD2      LEU  22  10.972   7.766  -9.645
  185   3HD2  LEU  22          3HD2      LEU  22  12.506   7.116 -10.221
  186    H    SER  23           H        SER  23  10.691   5.336 -15.780
  187    HA   SER  23           HA       SER  23  12.753   6.755 -17.050
  188   1HB   SER  23          2HB       SER  23  11.556   4.503 -17.689
  189   2HB   SER  23          1HB       SER  23  10.538   5.545 -18.685
  190    HG   SER  23           HG       SER  23  13.343   5.753 -18.761
  191    H    PHE  24           H        PHE  24  12.386   7.978 -19.241
  192    HA   PHE  24           HA       PHE  24  10.681  10.286 -18.621
  193   1HB   PHE  24          2HB       PHE  24  12.994  10.476 -19.632
  194   2HB   PHE  24          1HB       PHE  24  12.330   9.790 -21.115
  195    HD1  PHE  24           HD1      PHE  24  11.384  12.427 -18.606
  196    HD2  PHE  24           HD2      PHE  24  11.693  11.319 -22.745
  197    HE1  PHE  24           HE1      PHE  24  10.548  14.667 -19.268
  198    HE2  PHE  24           HE2      PHE  24  10.857  13.559 -23.407
  199    HZ   PHE  24           HZ       PHE  24  10.285  15.232 -21.668
  200    H    GLY  25           H        GLY  25   8.701   8.801 -18.781
  201   1HA   GLY  25          2HA       GLY  25   7.791   8.710 -21.628
  202   2HA   GLY  25          1HA       GLY  25   7.363   7.449 -20.474
  203    H    ASN  26           H        ASN  26   6.902   9.225 -18.246
  204    HA   ASN  26           HA       ASN  26   4.944  11.230 -19.002
  205   1HB   ASN  26          2HB       ASN  26   4.058   8.471 -18.219
  206   2HB   ASN  26          1HB       ASN  26   3.092   9.858 -17.717
  207   1HD2  ASN  26          2HD2      ASN  26   2.983   8.635 -21.575
  208   2HD2  ASN  26          1HD2      ASN  26   3.880   7.802 -20.400
  209    HA   PRO  27           HA       PRO  27   5.954  12.419 -14.893
  210   1HB   PRO  27          2HB       PRO  27   3.966  14.287 -14.544
  211   2HB   PRO  27          1HB       PRO  27   5.412  14.566 -15.529
  212   1HG   PRO  27          2HG       PRO  27   2.606  14.018 -16.401
  213   2HG   PRO  27          1HG       PRO  27   3.887  14.902 -17.243
  214   1HD   PRO  27          2HD       PRO  27   3.072  12.241 -17.777
  215   2HD   PRO  27          1HD       PRO  27   4.551  13.016 -18.376
  216    H    ARG  28           H        ARG  28   4.288  13.148 -12.847
  217    HA   ARG  28           HA       ARG  28   3.342  10.730 -11.768
  218   1HB   ARG  28          2HB       ARG  28   2.242  12.063 -10.080
  219   2HB   ARG  28          1HB       ARG  28   3.739  12.888 -10.513
  220   1HG   ARG  28          2HG       ARG  28   2.551  14.717 -11.070
  221   2HG   ARG  28          1HG       ARG  28   1.724  13.783 -12.317
  222   1HD   ARG  28          2HD       ARG  28  -0.130  14.269 -11.069
  223   2HD   ARG  28          1HD       ARG  28   0.418  12.897 -10.105
  224    HE   ARG  28           HE       ARG  28   1.762  15.078  -9.024
  225   1HH1  ARG  28          1HH2      ARG  28  -0.225  17.003  -9.437
  226   2HH1  ARG  28          2HH2      ARG  28  -1.442  16.699  -8.242
  227   1HH2  ARG  28          2HH1      ARG  28  -0.361  13.471  -7.580
  228   2HH2  ARG  28          1HH1      ARG  28  -1.518  14.700  -7.191
  229    H    GLY  29           H        GLY  29   0.884  10.475 -11.107
  230   1HA   GLY  29          2HA       GLY  29  -1.366  10.237 -11.779
  231   2HA   GLY  29          1HA       GLY  29  -1.062  11.415 -13.056
  232    H    THR  30           H        THR  30   1.267   8.966 -13.090
  233    HA   THR  30           HA       THR  30  -0.098   7.696 -15.410
  234    HB   THR  30           HB       THR  30   2.802   7.442 -14.560
  235    HG1  THR  30           HG1      THR  30   1.416   9.392 -15.958
  236   1HG2  THR  30          1HG2      THR  30   1.246   6.738 -17.054
  237   2HG2  THR  30          3HG2      THR  30   3.006   6.846 -17.031
  238   3HG2  THR  30          2HG2      THR  30   2.182   5.658 -16.021
  239    H    PHE  31           H        PHE  31  -0.761   5.579 -15.261
  240    HA   PHE  31           HA       PHE  31   0.088   4.103 -12.805
  241   1HB   PHE  31          2HB       PHE  31  -2.567   4.326 -14.179
  242   2HB   PHE  31          1HB       PHE  31  -2.182   2.870 -13.265
  243    HD1  PHE  31           HD1      PHE  31  -1.758   6.585 -12.877
  244    HD2  PHE  31           HD2      PHE  31  -2.856   2.860 -11.043
  245    HE1  PHE  31           HE1      PHE  31  -2.265   7.777 -10.763
  246    HE2  PHE  31           HE2      PHE  31  -3.362   4.052  -8.928
  247    HZ   PHE  31           HZ       PHE  31  -3.067   6.509  -8.787
  248    H    LEU  32           H        LEU  32   0.368   1.842 -13.012
  249    HA   LEU  32           HA       LEU  32   0.451   0.719 -15.760
  250   1HB   LEU  32          2HB       LEU  32   2.713   1.361 -15.584
  251   2HB   LEU  32          1HB       LEU  32   2.763   1.055 -13.851
  252    HG   LEU  32           HG       LEU  32   2.294  -1.213 -15.775
  253   1HD1  LEU  32          2HD1      LEU  32   4.396   0.187 -16.347
  254   2HD1  LEU  32          1HD1      LEU  32   5.038  -0.401 -14.813
  255   3HD1  LEU  32          3HD1      LEU  32   4.617  -1.544 -16.090
  256   1HD2  LEU  32          3HD2      LEU  32   2.691  -0.849 -12.933
  257   2HD2  LEU  32          2HD2      LEU  32   2.248  -2.314 -13.808
  258   3HD2  LEU  32          1HD2      LEU  32   3.948  -1.896 -13.591
  259    H    ILE  33           H        ILE  33   0.507  -1.691 -15.657
  260    HA   ILE  33           HA       ILE  33  -0.266  -2.753 -12.975
  261    HB   ILE  33           HB       ILE  33  -1.736  -2.984 -15.582
  262   1HG1  ILE  33          2HG1      ILE  33  -2.483  -2.630 -12.677
  263   2HG1  ILE  33          1HG1      ILE  33  -2.637  -1.453 -13.979
  264   1HG2  ILE  33          2HG2      ILE  33  -1.146  -5.321 -14.962
  265   2HG2  ILE  33          1HG2      ILE  33  -1.888  -5.059 -13.382
  266   3HG2  ILE  33          3HG2      ILE  33  -2.877  -5.006 -14.840
  267   1HD1  ILE  33          3HD1      ILE  33  -4.116  -3.360 -15.080
  268   2HD1  ILE  33          2HD1      ILE  33  -4.306  -3.871 -13.403
  269   3HD1  ILE  33          1HD1      ILE  33  -4.811  -2.254 -13.895
  270    H    ARG  34           H        ARG  34  -0.076  -5.256 -13.011
  271    HA   ARG  34           HA       ARG  34   1.415  -6.661 -14.941
  272   1HB   ARG  34          2HB       ARG  34   3.690  -6.553 -13.645
  273   2HB   ARG  34          1HB       ARG  34   3.289  -5.275 -14.792
  274   1HG   ARG  34          2HG       ARG  34   3.295  -3.729 -13.153
  275   2HG   ARG  34          1HG       ARG  34   2.172  -4.684 -12.187
  276   1HD   ARG  34          2HD       ARG  34   4.038  -6.045 -11.339
  277   2HD   ARG  34          1HD       ARG  34   5.170  -5.127 -12.332
  278    HE   ARG  34           HE       ARG  34   4.511  -3.116 -10.940
  279   1HH1  ARG  34          2HH1      ARG  34   5.035  -6.223  -9.736
  280   2HH1  ARG  34          1HH1      ARG  34   4.557  -5.857  -8.112
  281   1HH2  ARG  34          1HH2      ARG  34   3.422  -2.673  -8.882
  282   2HH2  ARG  34          2HH2      ARG  34   3.644  -3.847  -7.629
  283    H    GLU  35           H        GLU  35   2.277  -8.706 -14.113
  284    HA   GLU  35           HA       GLU  35   0.660  -9.878 -12.096
  285   1HB   GLU  35          2HB       GLU  35   3.063 -10.655 -13.660
  286   2HB   GLU  35          1HB       GLU  35   2.744 -11.578 -12.195
  287   1HG   GLU  35          2HG       GLU  35   0.333 -11.779 -13.033
  288   2HG   GLU  35          1HG       GLU  35   0.936 -11.178 -14.579
  289    H    SER  36           H        SER  36   0.875  -9.950  -9.897
  290    HA   SER  36           HA       SER  36   3.121  -8.514  -8.658
  291   1HB   SER  36          2HB       SER  36   0.638  -9.834  -7.528
  292   2HB   SER  36          1HB       SER  36   1.861  -9.052  -6.539
  293    HG   SER  36           HG       SER  36   1.194  -7.164  -7.155
  294    H    GLU  37           H        GLU  37   4.782  -9.474  -7.564
  295    HA   GLU  37           HA       GLU  37   4.928 -12.434  -7.619
  296   1HB   GLU  37          2HB       GLU  37   6.951 -10.359  -6.729
  297   2HB   GLU  37          1HB       GLU  37   7.253 -12.090  -6.866
  298   1HG   GLU  37          2HG       GLU  37   7.229 -12.049  -9.188
  299   2HG   GLU  37          1HG       GLU  37   6.175 -10.637  -9.254
  300    H    THR  38           H        THR  38   3.353 -10.408  -5.774
  301    HA   THR  38           HA       THR  38   4.353 -10.898  -3.110
  302    HB   THR  38           HB       THR  38   2.732  -9.035  -3.941
  303    HG1  THR  38           HG1      THR  38   2.504  -8.748  -1.889
  304   1HG2  THR  38          3HG2      THR  38   1.087 -10.552  -4.968
  305   2HG2  THR  38          2HG2      THR  38   0.765 -11.270  -3.390
  306   3HG2  THR  38          1HG2      THR  38   0.349  -9.582  -3.693
  307    H    THR  39           H        THR  39   1.780 -12.289  -5.098
  308    HA   THR  39           HA       THR  39   1.682 -14.572  -3.151
  309    HB   THR  39           HB       THR  39  -0.415 -13.048  -3.666
  310    HG1  THR  39           HG1      THR  39  -1.498 -14.671  -2.846
  311   1HG2  THR  39          1HG2      THR  39  -0.027 -13.622  -6.204
  312   2HG2  THR  39          3HG2      THR  39  -0.875 -15.113  -5.792
  313   3HG2  THR  39          2HG2      THR  39  -1.667 -13.555  -5.560
  314    H    LYS  40           H        LYS  40   0.471 -16.492  -4.668
  315    HA   LYS  40           HA       LYS  40   2.463 -17.757  -6.081
  316   1HB   LYS  40          2HB       LYS  40  -0.357 -17.827  -7.132
  317   2HB   LYS  40          1HB       LYS  40   0.808 -19.145  -7.039
  318   1HG   LYS  40          2HG       LYS  40  -0.751 -17.862  -4.794
  319   2HG   LYS  40          1HG       LYS  40  -0.745 -19.555  -5.283
  320   1HD   LYS  40          2HD       LYS  40   1.787 -19.491  -4.709
  321   2HD   LYS  40          1HD       LYS  40   1.399 -18.011  -3.829
  322   1HE   LYS  40          2HE       LYS  40  -0.087 -19.149  -2.362
  323   2HE   LYS  40          1HE       LYS  40  -0.145 -20.574  -3.400
  324   1HZ   LYS  40          1HZ       LYS  40   2.350 -19.630  -2.112
  325   2HZ   LYS  40          3HZ       LYS  40   1.306 -20.747  -1.375
  326   3HZ   LYS  40          2HZ       LYS  40   2.057 -21.134  -2.849
  327    H    GLY  41           H        GLY  41   0.237 -15.308  -7.266
  328   1HA   GLY  41          2HA       GLY  41   1.885 -14.019  -9.042
  329   2HA   GLY  41          1HA       GLY  41   1.258 -15.373  -9.985
  330    H    ALA  42           H        ALA  42   0.132 -12.758  -7.851
  331    HA   ALA  42           HA       ALA  42  -2.535 -12.761  -9.103
  332   1HB   ALA  42          3HB       ALA  42  -1.566 -12.026  -6.603
  333   2HB   ALA  42          2HB       ALA  42  -1.860 -10.483  -7.400
  334   3HB   ALA  42          1HB       ALA  42  -3.170 -11.652  -7.232
  335    H    TYR  43           H        TYR  43  -2.767  -9.866  -8.902
  336    HA   TYR  43           HA       TYR  43  -1.034  -9.122 -11.212
  337   1HB   TYR  43          2HB       TYR  43  -3.903  -9.141 -11.033
  338   2HB   TYR  43          1HB       TYR  43  -3.336  -7.481 -11.242
  339    HD1  TYR  43           HD1      TYR  43  -0.899  -7.742 -12.774
  340    HD2  TYR  43           HD2      TYR  43  -4.588  -9.923 -13.143
  341    HE1  TYR  43           HE1      TYR  43  -0.381  -8.234 -15.156
  342    HE2  TYR  43           HE2      TYR  43  -4.069 -10.409 -15.517
  343    HH   TYR  43           HH       TYR  43  -2.245 -10.506 -17.010
  344    H    SER  44           H        SER  44  -1.167  -6.521 -11.396
  345    HA   SER  44           HA       SER  44  -1.133  -5.282  -8.715
  346   1HB   SER  44          2HB       SER  44   1.072  -5.941  -8.642
  347   2HB   SER  44          1HB       SER  44   1.262  -5.823 -10.392
  348    HG   SER  44           HG       SER  44   1.547  -3.708 -10.250
  349    H    LEU  45           H        LEU  45  -0.393  -2.932  -8.973
  350    HA   LEU  45           HA       LEU  45  -0.986  -1.748 -11.595
  351   1HB   LEU  45          2HB       LEU  45  -3.230  -1.866 -10.804
  352   2HB   LEU  45          1HB       LEU  45  -2.758  -1.363  -9.180
  353    HG   LEU  45           HG       LEU  45  -2.327   0.870  -9.884
  354   1HD1  LEU  45          1HD1      LEU  45  -2.043  -0.425 -12.534
  355   2HD1  LEU  45          3HD1      LEU  45  -2.777   1.179 -12.551
  356   3HD1  LEU  45          2HD1      LEU  45  -1.173   0.950 -11.855
  357   1HD2  LEU  45          3HD2      LEU  45  -4.809  -0.416 -10.811
  358   2HD2  LEU  45          2HD2      LEU  45  -4.590   1.008  -9.796
  359   3HD2  LEU  45          1HD2      LEU  45  -4.474   1.148 -11.551
  360    H    SER  46           H        SER  46   1.232  -1.044 -11.313
  361    HA   SER  46           HA       SER  46   2.218   0.420  -9.103
  362   1HB   SER  46          2HB       SER  46   2.978   0.761 -12.013
  363   2HB   SER  46          1HB       SER  46   3.953   1.200 -10.616
  364    HG   SER  46           HG       SER  46   3.048  -1.420 -11.188
  365    H    ILE  47           H        ILE  47   2.727   2.797  -9.135
  366    HA   ILE  47           HA       ILE  47   0.905   4.490 -10.733
  367    HB   ILE  47           HB       ILE  47  -0.578   3.998  -8.925
  368   1HG1  ILE  47          2HG1      ILE  47   0.890   6.608  -8.441
  369   2HG1  ILE  47          1HG1      ILE  47  -0.553   6.364  -9.421
  370   1HG2  ILE  47          1HG2      ILE  47   1.862   4.423  -7.184
  371   2HG2  ILE  47          3HG2      ILE  47   0.225   4.359  -6.531
  372   3HG2  ILE  47          2HG2      ILE  47   0.902   2.954  -7.357
  373   1HD1  ILE  47          1HD1      ILE  47  -0.451   5.751  -6.460
  374   2HD1  ILE  47          3HD1      ILE  47  -0.959   7.315  -7.099
  375   3HD1  ILE  47          2HD1      ILE  47  -1.880   5.862  -7.489
  376    H    ARG  48           H        ARG  48   2.775   5.516 -11.543
  377    HA   ARG  48           HA       ARG  48   4.994   6.412 -10.024
  378   1HB   ARG  48          2HB       ARG  48   4.312   6.517 -12.669
  379   2HB   ARG  48          1HB       ARG  48   4.131   8.210 -12.207
  380   1HG   ARG  48          2HG       ARG  48   6.550   6.962 -11.107
  381   2HG   ARG  48          1HG       ARG  48   6.522   6.985 -12.870
  382   1HD   ARG  48          2HD       ARG  48   5.740   9.465 -11.372
  383   2HD   ARG  48          1HD       ARG  48   7.451   9.065 -11.528
  384    HE   ARG  48           HE       ARG  48   6.182   8.877 -14.095
  385   1HH1  ARG  48          2HH1      ARG  48   5.717  11.465 -12.128
  386   2HH1  ARG  48          1HH1      ARG  48   6.650  12.600 -13.047
  387   1HH2  ARG  48          1HH2      ARG  48   8.045  10.186 -15.109
  388   2HH2  ARG  48          2HH2      ARG  48   7.967  11.875 -14.734
  389    H    ASP  49           H        ASP  49   5.319   8.209  -8.726
  390    HA   ASP  49           HA       ASP  49   3.198  10.287  -8.666
  391   1HB   ASP  49          2HB       ASP  49   2.891   8.362  -6.904
  392   2HB   ASP  49          1HB       ASP  49   4.200   9.187  -6.058
  393    H    TRP  50           H        TRP  50   5.596  10.826  -9.789
  394    HA   TRP  50           HA       TRP  50   7.778  11.579  -8.189
  395   1HB   TRP  50          2HB       TRP  50   8.047  11.835 -10.539
  396   2HB   TRP  50          1HB       TRP  50   6.588  12.810 -10.684
  397    HD1  TRP  50           HD1      TRP  50  10.273  13.079 -10.009
  398    HE1  TRP  50           HE1      TRP  50  10.902  15.544  -9.593
  399    HE3  TRP  50           HE3      TRP  50   5.636  15.082  -9.699
  400    HZ2  TRP  50           HZ2      TRP  50   9.578  18.063  -9.232
  401    HZ3  TRP  50           HZ3      TRP  50   5.317  17.517  -9.331
  402    HH2  TRP  50           HH2      TRP  50   7.285  19.010  -9.096
  403    H    ASP  51           H        ASP  51   8.332  13.901  -7.529
  404    HA   ASP  51           HA       ASP  51   6.008  15.566  -6.801
  405   1HB   ASP  51          2HB       ASP  51   6.970  13.699  -4.973
  406   2HB   ASP  51          1HB       ASP  51   7.764  15.196  -4.492
  407    H    ASP  52           H        ASP  52   6.649  17.737  -6.232
  408    HA   ASP  52           HA       ASP  52   9.255  18.496  -7.374
  409   1HB   ASP  52          2HB       ASP  52   6.776  19.698  -7.354
  410   2HB   ASP  52          1HB       ASP  52   7.642  20.609  -6.116
  411    H    MET  53           H        MET  53   9.538  17.012  -4.990
  412    HA   MET  53           HA       MET  53  11.097  18.890  -3.449
  413   1HB   MET  53          2HB       MET  53   9.952  18.739  -1.361
  414   2HB   MET  53          1HB       MET  53   8.714  19.123  -2.557
  415   1HG   MET  53          2HG       MET  53   8.991  16.280  -2.470
  416   2HG   MET  53          1HG       MET  53   8.843  16.859  -0.812
  417   1HE   MET  53          1HE       MET  53   7.687  17.052  -4.336
  418   2HE   MET  53          3HE       MET  53   5.995  17.572  -4.314
  419   3HE   MET  53          2HE       MET  53   7.283  18.738  -4.019
  420    H    LYS  54           H        LYS  54  11.255  16.231  -4.928
  421    HA   LYS  54           HA       LYS  54  13.155  15.015  -3.188
  422   1HB   LYS  54          2HB       LYS  54  11.847  12.829  -2.900
  423   2HB   LYS  54          1HB       LYS  54  11.358  14.184  -1.880
  424   1HG   LYS  54          2HG       LYS  54   9.857  14.566  -4.176
  425   2HG   LYS  54          1HG       LYS  54   9.866  12.812  -4.002
  426   1HD   LYS  54          2HD       LYS  54   9.392  14.417  -1.534
  427   2HD   LYS  54          1HD       LYS  54   8.086  14.362  -2.718
  428   1HE   LYS  54          2HE       LYS  54   7.528  12.308  -1.985
  429   2HE   LYS  54          1HE       LYS  54   9.120  11.718  -2.464
  430   1HZ   LYS  54          3HZ       LYS  54   9.577  13.096  -0.154
  431   2HZ   LYS  54          2HZ       LYS  54   8.107  12.297   0.144
  432   3HZ   LYS  54          1HZ       LYS  54   9.483  11.410  -0.308
  433    H    GLY  55           H        GLY  55  11.114  14.759  -6.054
  434   1HA   GLY  55          2HA       GLY  55  12.468  14.268  -8.121
  435   2HA   GLY  55          1HA       GLY  55  13.148  12.942  -7.189
  436    H    ASP  56           H        ASP  56  12.218  11.729  -9.146
  437    HA   ASP  56           HA       ASP  56   9.313  11.472  -9.245
  438   1HB   ASP  56          2HB       ASP  56  11.645  10.242 -10.655
  439   2HB   ASP  56          1HB       ASP  56  10.130   9.341 -10.653
  440    H    HIS  57           H        HIS  57   8.401   9.130  -9.078
  441    HA   HIS  57           HA       HIS  57   9.711   7.317  -7.228
  442   1HB   HIS  57          2HB       HIS  57   7.499   9.138  -6.268
  443   2HB   HIS  57          1HB       HIS  57   7.781   7.566  -5.524
  444    HD1  HIS  57           HD1      HIS  57   9.184  11.006  -5.785
  445    HD2  HIS  57           HD2      HIS  57  10.327   7.334  -4.175
  446    HE1  HIS  57           HE1      HIS  57  11.153  11.473  -4.263
  447    H    VAL  58           H        VAL  58   7.861   5.642  -6.507
  448    HA   VAL  58           HA       VAL  58   5.677   5.440  -8.429
  449    HB   VAL  58           HB       VAL  58   8.229   3.966  -8.770
  450   1HG1  VAL  58          3HG1      VAL  58   5.510   2.648  -9.041
  451   2HG1  VAL  58          2HG1      VAL  58   6.937   2.076  -9.908
  452   3HG1  VAL  58          1HG1      VAL  58   6.910   2.057  -8.145
  453   1HG2  VAL  58          2HG2      VAL  58   5.942   4.894 -10.507
  454   2HG2  VAL  58          1HG2      VAL  58   7.580   5.546 -10.432
  455   3HG2  VAL  58          3HG2      VAL  58   7.296   3.952 -11.138
  456    H    LYS  59           H        LYS  59   4.051   4.693  -7.246
  457    HA   LYS  59           HA       LYS  59   4.594   2.979  -4.878
  458   1HB   LYS  59          2HB       LYS  59   2.667   5.035  -5.509
  459   2HB   LYS  59          1HB       LYS  59   1.822   3.536  -5.125
  460   1HG   LYS  59          2HG       LYS  59   2.125   4.172  -2.961
  461   2HG   LYS  59          1HG       LYS  59   3.769   3.580  -3.193
  462   1HD   LYS  59          2HD       LYS  59   4.300   5.942  -4.083
  463   2HD   LYS  59          1HD       LYS  59   2.760   6.421  -3.369
  464   1HE   LYS  59          2HE       LYS  59   3.867   6.672  -1.416
  465   2HE   LYS  59          1HE       LYS  59   4.020   4.916  -1.373
  466   1HZ   LYS  59          3HZ       LYS  59   5.927   6.288  -3.067
  467   2HZ   LYS  59          2HZ       LYS  59   6.095   6.591  -1.404
  468   3HZ   LYS  59          1HZ       LYS  59   6.161   4.997  -1.991
  469    H    HIS  60           H        HIS  60   2.290   1.477  -4.733
  470    HA   HIS  60           HA       HIS  60   1.739   0.292  -7.350
  471   1HB   HIS  60          2HB       HIS  60   3.031  -1.505  -5.314
  472   2HB   HIS  60          1HB       HIS  60   2.708  -1.841  -7.009
  473    HD1  HIS  60           HD1      HIS  60   4.440  -1.103  -8.711
  474    HD2  HIS  60           HD2      HIS  60   5.237   0.361  -4.890
  475    HE1  HIS  60           HE1      HIS  60   6.753  -0.076  -8.805
  476    H    TYR  61           H        TYR  61   0.061  -1.179  -7.334
  477    HA   TYR  61           HA       TYR  61  -1.330  -1.617  -4.732
  478   1HB   TYR  61          2HB       TYR  61  -2.657  -0.837  -7.359
  479   2HB   TYR  61          1HB       TYR  61  -3.508  -1.232  -5.866
  480    HD1  TYR  61           HD1      TYR  61  -3.170   0.222  -3.828
  481    HD2  TYR  61           HD2      TYR  61  -1.705   1.320  -7.714
  482    HE1  TYR  61           HE1      TYR  61  -2.923   2.571  -3.072
  483    HE2  TYR  61           HE2      TYR  61  -1.459   3.669  -6.958
  484    HH   TYR  61           HH       TYR  61  -1.976   5.136  -5.324
  485    H    LYS  62           H        LYS  62  -1.114  -3.763  -4.485
  486    HA   LYS  62           HA       LYS  62  -0.820  -5.546  -6.735
  487   1HB   LYS  62          2HB       LYS  62  -0.417  -7.215  -5.137
  488   2HB   LYS  62          1HB       LYS  62   0.143  -5.758  -4.340
  489   1HG   LYS  62          2HG       LYS  62  -2.244  -5.594  -3.378
  490   2HG   LYS  62          1HG       LYS  62  -2.402  -7.285  -3.856
  491   1HD   LYS  62          2HD       LYS  62   0.117  -6.972  -2.546
  492   2HD   LYS  62          1HD       LYS  62  -1.116  -6.221  -1.534
  493   1HE   LYS  62          2HE       LYS  62  -2.388  -8.517  -2.307
  494   2HE   LYS  62          1HE       LYS  62  -0.715  -9.067  -2.218
  495   1HZ   LYS  62          2HZ       LYS  62  -1.925  -7.468  -0.049
  496   2HZ   LYS  62          1HZ       LYS  62  -2.108  -9.156  -0.104
  497   3HZ   LYS  62          3HZ       LYS  62  -0.559  -8.476   0.010
  498    H    ILE  63           H        ILE  63  -2.491  -6.019  -7.998
  499    HA   ILE  63           HA       ILE  63  -5.250  -5.891  -7.061
  500    HB   ILE  63           HB       ILE  63  -3.950  -6.656  -9.682
  501   1HG1  ILE  63          2HG1      ILE  63  -4.958  -4.625 -10.485
  502   2HG1  ILE  63          1HG1      ILE  63  -5.931  -4.460  -9.026
  503   1HG2  ILE  63          2HG2      ILE  63  -6.788  -7.004  -8.762
  504   2HG2  ILE  63          1HG2      ILE  63  -6.474  -6.561 -10.441
  505   3HG2  ILE  63          3HG2      ILE  63  -5.810  -8.058  -9.785
  506   1HD1  ILE  63          1HD1      ILE  63  -2.902  -4.379  -9.089
  507   2HD1  ILE  63          3HD1      ILE  63  -3.935  -2.953  -9.036
  508   3HD1  ILE  63          2HD1      ILE  63  -3.925  -4.086  -7.686
  509    H    ARG  64           H        ARG  64  -5.775  -7.524  -5.639
  510    HA   ARG  64           HA       ARG  64  -4.784 -10.245  -5.999
  511   1HB   ARG  64          2HB       ARG  64  -5.995  -8.786  -3.901
  512   2HB   ARG  64          1HB       ARG  64  -7.129 -10.073  -4.310
  513   1HG   ARG  64          2HG       ARG  64  -5.400 -10.717  -2.580
  514   2HG   ARG  64          1HG       ARG  64  -5.438 -11.764  -3.999
  515   1HD   ARG  64          2HD       ARG  64  -3.447 -10.896  -4.857
  516   2HD   ARG  64          1HD       ARG  64  -3.608  -9.381  -3.968
  517    HE   ARG  64           HE       ARG  64  -2.075 -11.492  -3.033
  518   1HH1  ARG  64          2HH1      ARG  64  -4.142  -9.078  -1.901
  519   2HH1  ARG  64          1HH1      ARG  64  -4.191  -9.652  -0.267
  520   1HH2  ARG  64          1HH2      ARG  64  -2.462 -12.576  -0.963
  521   2HH2  ARG  64          2HH2      ARG  64  -3.240 -11.633   0.264
  522    H    LYS  65           H        LYS  65  -6.795 -11.975  -5.861
  523    HA   LYS  65           HA       LYS  65  -8.883 -11.108  -7.777
  524   1HB   LYS  65          2HB       LYS  65  -6.950 -12.075  -9.077
  525   2HB   LYS  65          1HB       LYS  65  -7.229 -13.603  -8.239
  526   1HG   LYS  65          2HG       LYS  65  -9.537 -13.663  -9.109
  527   2HG   LYS  65          1HG       LYS  65  -9.267 -12.131  -9.939
  528   1HD   LYS  65          2HD       LYS  65  -8.845 -13.688 -11.638
  529   2HD   LYS  65          1HD       LYS  65  -7.225 -13.377 -11.013
  530   1HE   LYS  65          2HE       LYS  65  -7.724 -15.366  -9.402
  531   2HE   LYS  65          1HE       LYS  65  -8.998 -15.769 -10.553
  532   1HZ   LYS  65          3HZ       LYS  65  -6.960 -15.342 -12.202
  533   2HZ   LYS  65          2HZ       LYS  65  -6.114 -15.920 -10.846
  534   3HZ   LYS  65          1HZ       LYS  65  -7.331 -16.867 -11.558
  535    H    LEU  66           H        LEU  66 -10.785 -11.765  -7.038
  536    HA   LEU  66           HA       LEU  66 -11.148 -13.472  -4.784
  537   1HB   LEU  66          2HB       LEU  66 -12.954 -12.482  -6.971
  538   2HB   LEU  66          1HB       LEU  66 -13.539 -13.714  -5.857
  539    HG   LEU  66           HG       LEU  66 -14.200 -11.644  -4.900
  540   1HD1  LEU  66          2HD1      LEU  66 -12.537 -13.334  -3.543
  541   2HD1  LEU  66          1HD1      LEU  66 -11.691 -11.796  -3.352
  542   3HD1  LEU  66          3HD1      LEU  66 -13.363 -11.958  -2.809
  543   1HD2  LEU  66          3HD2      LEU  66 -11.407 -10.737  -5.606
  544   2HD2  LEU  66          2HD2      LEU  66 -12.940 -10.070  -6.166
  545   3HD2  LEU  66          1HD2      LEU  66 -12.438  -9.840  -4.492
  546    H    ASP  67           H        ASP  67 -11.877 -15.655  -4.674
  547    HA   ASP  67           HA       ASP  67 -10.727 -17.385  -6.704
  548   1HB   ASP  67          2HB       ASP  67 -11.959 -17.665  -4.074
  549   2HB   ASP  67          1HB       ASP  67 -12.512 -18.914  -5.187
  550    H    ASN  68           H        ASN  68 -13.672 -15.740  -6.227
  551    HA   ASN  68           HA       ASN  68 -15.195 -17.507  -8.064
  552   1HB   ASN  68          2HB       ASN  68 -15.992 -14.935  -6.661
  553   2HB   ASN  68          1HB       ASN  68 -17.077 -15.993  -7.564
  554   1HD2  ASN  68          2HD2      ASN  68 -16.728 -16.772  -3.744
  555   2HD2  ASN  68          1HD2      ASN  68 -16.608 -15.254  -4.493
  556    H    GLY  69           H        GLY  69 -12.955 -15.108  -8.342
  557   1HA   GLY  69          2HA       GLY  69 -12.274 -14.157 -10.434
  558   2HA   GLY  69          1HA       GLY  69 -13.910 -14.402 -11.030
  559    H    GLY  70           H        GLY  70 -11.932 -12.371  -8.922
  560   1HA   GLY  70          2HA       GLY  70 -13.647 -10.108  -9.501
  561   2HA   GLY  70          1HA       GLY  70 -13.619 -10.580  -7.819
  562    H    TYR  71           H        TYR  71 -11.655  -9.221 -10.449
  563    HA   TYR  71           HA       TYR  71  -9.212  -9.087  -8.917
  564   1HB   TYR  71          2HB       TYR  71 -10.247  -7.661 -11.364
  565   2HB   TYR  71          1HB       TYR  71  -8.787  -7.074 -10.578
  566    HD1  TYR  71           HD1      TYR  71  -7.836  -9.914  -9.647
  567    HD2  TYR  71           HD2      TYR  71  -9.169  -8.332 -13.420
  568    HE1  TYR  71           HE1      TYR  71  -6.529 -11.643 -10.848
  569    HE2  TYR  71           HE2      TYR  71  -7.870 -10.053 -14.610
  570    HH   TYR  71           HH       TYR  71  -5.893 -11.493 -14.174
  571    H    TYR  72           H        TYR  72  -8.770  -7.739  -7.199
  572    HA   TYR  72           HA       TYR  72 -10.105  -5.085  -7.083
  573   1HB   TYR  72          2HB       TYR  72 -10.892  -5.415  -4.807
  574   2HB   TYR  72          1HB       TYR  72 -11.566  -6.679  -5.827
  575    HD1  TYR  72           HD1      TYR  72 -10.748  -8.976  -5.690
  576    HD2  TYR  72           HD2      TYR  72  -9.167  -5.918  -3.146
  577    HE1  TYR  72           HE1      TYR  72  -9.677 -10.710  -4.287
  578    HE2  TYR  72           HE2      TYR  72  -8.100  -7.628  -1.733
  579    HH   TYR  72           HH       TYR  72  -8.825 -10.992  -2.055
  580    H    ILE  73           H        ILE  73  -8.619  -3.564  -6.348
  581    HA   ILE  73           HA       ILE  73  -6.027  -4.509  -5.319
  582    HB   ILE  73           HB       ILE  73  -7.195  -1.771  -5.888
  583   1HG1  ILE  73          2HG1      ILE  73  -4.512  -2.478  -6.832
  584   2HG1  ILE  73          1HG1      ILE  73  -5.761  -3.578  -7.409
  585   1HG2  ILE  73          3HG2      ILE  73  -5.943  -1.687  -3.729
  586   2HG2  ILE  73          2HG2      ILE  73  -4.528  -2.328  -4.565
  587   3HG2  ILE  73          1HG2      ILE  73  -5.172  -0.747  -5.006
  588   1HD1  ILE  73          1HD1      ILE  73  -6.663  -0.822  -7.550
  589   2HD1  ILE  73          3HD1      ILE  73  -5.158  -1.037  -8.443
  590   3HD1  ILE  73          2HD1      ILE  73  -6.564  -2.026  -8.835
  591    H    THR  74           H        THR  74  -9.057  -3.266  -4.247
  592    HA   THR  74           HA       THR  74  -8.253  -3.720  -1.423
  593    HB   THR  74           HB       THR  74  -8.572  -1.507  -1.061
  594    HG1  THR  74           HG1      THR  74 -10.577  -1.113  -0.457
  595   1HG2  THR  74          1HG2      THR  74  -8.523  -1.195  -3.600
  596   2HG2  THR  74          3HG2      THR  74 -10.286  -1.214  -3.532
  597   3HG2  THR  74          2HG2      THR  74  -9.384   0.043  -2.686
  598    H    THR  75           H        THR  75  -9.792  -4.875  -0.288
  599    HA   THR  75           HA       THR  75 -11.582  -6.488  -1.820
  600    HB   THR  75           HB       THR  75 -12.324  -7.392   0.302
  601    HG1  THR  75           HG1      THR  75 -12.564  -5.428   1.417
  602   1HG2  THR  75          3HG2      THR  75  -9.632  -7.126  -0.557
  603   2HG2  THR  75          2HG2      THR  75  -9.625  -7.011   1.207
  604   3HG2  THR  75          1HG2      THR  75 -10.331  -8.423   0.419
  605    H    ARG  76           H        ARG  76 -11.974  -3.297  -0.870
  606    HA   ARG  76           HA       ARG  76 -14.793  -3.290  -0.282
  607   1HB   ARG  76          2HB       ARG  76 -12.872  -1.157  -1.237
  608   2HB   ARG  76          1HB       ARG  76 -14.581  -0.828  -0.952
  609   1HG   ARG  76          2HG       ARG  76 -13.592  -2.278   1.299
  610   2HG   ARG  76          1HG       ARG  76 -12.460  -0.966   0.967
  611   1HD   ARG  76          2HD       ARG  76 -13.933   0.319   2.128
  612   2HD   ARG  76          1HD       ARG  76 -14.883   0.290   0.642
  613    HE   ARG  76           HE       ARG  76 -15.721  -1.989   1.913
  614   1HH1  ARG  76          2HH1      ARG  76 -14.867  -0.680   4.485
  615   2HH1  ARG  76          1HH1      ARG  76 -16.314   0.143   4.963
  616   1HH2  ARG  76          1HH2      ARG  76 -17.789  -0.076   1.832
  617   2HH2  ARG  76          2HH2      ARG  76 -17.968   0.485   3.461
  618    H    ALA  77           H        ALA  77 -12.977  -3.656  -3.205
  619    HA   ALA  77           HA       ALA  77 -15.466  -3.904  -4.724
  620   1HB   ALA  77          1HB       ALA  77 -13.643  -1.545  -5.056
  621   2HB   ALA  77          3HB       ALA  77 -14.489  -2.190  -6.464
  622   3HB   ALA  77          2HB       ALA  77 -15.406  -1.604  -5.076
  623    H    GLN  78           H        GLN  78 -15.180  -5.412  -6.275
  624    HA   GLN  78           HA       GLN  78 -12.435  -5.964  -7.273
  625   1HB   GLN  78          2HB       GLN  78 -13.600  -8.357  -7.630
  626   2HB   GLN  78          1HB       GLN  78 -12.757  -7.959  -6.141
  627   1HG   GLN  78          2HG       GLN  78 -15.585  -7.133  -6.222
  628   2HG   GLN  78          1HG       GLN  78 -15.324  -8.869  -6.251
  629   1HE2  GLN  78          2HE2      GLN  78 -13.393  -7.204  -3.065
  630   2HE2  GLN  78          1HE2      GLN  78 -13.011  -6.718  -4.644
  631    H    PHE  79           H        PHE  79 -12.766  -7.392  -9.431
  632    HA   PHE  79           HA       PHE  79 -15.134  -6.452 -10.948
  633   1HB   PHE  79          2HB       PHE  79 -12.264  -5.784 -11.625
  634   2HB   PHE  79          1HB       PHE  79 -13.559  -5.730 -12.824
  635    HD1  PHE  79           HD1      PHE  79 -12.611  -4.465  -9.445
  636    HD2  PHE  79           HD2      PHE  79 -14.967  -3.845 -12.977
  637    HE1  PHE  79           HE1      PHE  79 -13.310  -2.258  -8.583
  638    HE2  PHE  79           HE2      PHE  79 -15.672  -1.626 -12.116
  639    HZ   PHE  79           HZ       PHE  79 -14.841  -0.829  -9.916
  640    H    GLU  80           H        GLU  80 -14.596  -7.374 -13.434
  641    HA   GLU  80           HA       GLU  80 -14.154 -10.243 -12.869
  642   1HB   GLU  80          2HB       GLU  80 -15.099 -10.488 -15.227
  643   2HB   GLU  80          1HB       GLU  80 -16.193  -9.821 -14.018
  644   1HG   GLU  80          2HG       GLU  80 -16.193  -7.735 -14.958
  645   2HG   GLU  80          1HG       GLU  80 -14.524  -7.869 -15.512
  646    H    THR  81           H        THR  81 -12.713  -7.576 -14.659
  647    HA   THR  81           HA       THR  81 -10.402  -9.348 -15.213
  648    HB   THR  81           HB       THR  81 -11.167  -9.679 -17.345
  649    HG1  THR  81           HG1      THR  81 -10.821  -7.080 -18.127
  650   1HG2  THR  81          2HG2      THR  81 -13.356  -8.662 -16.694
  651   2HG2  THR  81          1HG2      THR  81 -12.701  -7.095 -17.174
  652   3HG2  THR  81          3HG2      THR  81 -12.910  -8.372 -18.375
  653    H    LEU  82           H        LEU  82  -8.734  -7.791 -16.528
  654    HA   LEU  82           HA       LEU  82  -8.300  -5.555 -14.686
  655   1HB   LEU  82          2HB       LEU  82  -6.653  -6.521 -17.038
  656   2HB   LEU  82          1HB       LEU  82  -6.145  -5.313 -15.855
  657    HG   LEU  82           HG       LEU  82  -7.154  -7.722 -14.567
  658   1HD1  LEU  82          2HD1      LEU  82  -6.092  -8.506 -16.833
  659   2HD1  LEU  82          1HD1      LEU  82  -4.563  -8.139 -16.024
  660   3HD1  LEU  82          3HD1      LEU  82  -5.670  -9.333 -15.332
  661   1HD2  LEU  82          3HD2      LEU  82  -5.642  -5.755 -13.742
  662   2HD2  LEU  82          2HD2      LEU  82  -5.312  -7.389 -13.168
  663   3HD2  LEU  82          1HD2      LEU  82  -4.332  -6.693 -14.459
  664    H    GLN  83           H        GLN  83  -9.342  -6.059 -17.982
  665    HA   GLN  83           HA       GLN  83  -9.086  -3.275 -18.756
  666   1HB   GLN  83          2HB       GLN  83  -9.269  -5.363 -20.300
  667   2HB   GLN  83          1HB       GLN  83 -11.005  -5.231 -20.015
  668   1HG   GLN  83          2HG       GLN  83  -9.529  -2.748 -20.783
  669   2HG   GLN  83          1HG       GLN  83  -9.825  -3.947 -22.040
  670   1HE2  GLN  83          2HE2      GLN  83 -13.305  -3.304 -22.209
  671   2HE2  GLN  83          1HE2      GLN  83 -12.025  -4.288 -22.733
  672    H    GLN  84           H        GLN  84 -11.541  -5.327 -17.313
  673    HA   GLN  84           HA       GLN  84 -13.702  -3.424 -17.511
  674   1HB   GLN  84          2HB       GLN  84 -13.235  -5.921 -15.906
  675   2HB   GLN  84          1HB       GLN  84 -14.655  -4.924 -15.633
  676   1HG   GLN  84          2HG       GLN  84 -14.711  -6.911 -17.400
  677   2HG   GLN  84          1HG       GLN  84 -15.578  -5.412 -17.700
  678   1HE2  GLN  84          2HE2      GLN  84 -13.365  -4.352 -20.308
  679   2HE2  GLN  84          1HE2      GLN  84 -14.488  -3.806 -19.159
  680    H    LEU  85           H        LEU  85 -11.331  -4.213 -15.002
  681    HA   LEU  85           HA       LEU  85 -12.465  -2.236 -13.147
  682   1HB   LEU  85          2HB       LEU  85 -11.008  -3.079 -11.592
  683   2HB   LEU  85          1HB       LEU  85 -10.949  -4.432 -12.717
  684    HG   LEU  85           HG       LEU  85  -9.055  -2.754 -13.775
  685   1HD1  LEU  85          3HD1      LEU  85  -9.569  -1.632 -11.312
  686   2HD1  LEU  85          2HD1      LEU  85  -8.196  -2.689 -10.969
  687   3HD1  LEU  85          1HD1      LEU  85  -8.064  -1.446 -12.215
  688   1HD2  LEU  85          1HD2      LEU  85  -9.125  -5.265 -13.032
  689   2HD2  LEU  85          3HD2      LEU  85  -7.585  -4.432 -13.228
  690   3HD2  LEU  85          2HD2      LEU  85  -8.268  -4.653 -11.615
  691    H    VAL  86           H        VAL  86  -9.914  -2.262 -15.575
  692    HA   VAL  86           HA       VAL  86  -8.852   0.254 -14.682
  693    HB   VAL  86           HB       VAL  86  -7.816   0.414 -16.927
  694   1HG1  VAL  86          3HG1      VAL  86  -7.590  -1.876 -15.123
  695   2HG1  VAL  86          2HG1      VAL  86  -7.068  -2.257 -16.764
  696   3HG1  VAL  86          1HG1      VAL  86  -6.317  -0.923 -15.888
  697   1HG2  VAL  86          1HG2      VAL  86  -9.507  -2.030 -17.468
  698   2HG2  VAL  86          3HG2      VAL  86  -9.710  -0.450 -18.215
  699   3HG2  VAL  86          2HG2      VAL  86  -8.267  -1.409 -18.554
  700    H    GLN  87           H        GLN  87 -11.586  -0.857 -16.372
  701    HA   GLN  87           HA       GLN  87 -12.307   1.553 -17.763
  702   1HB   GLN  87          2HB       GLN  87 -13.189  -0.747 -18.255
  703   2HB   GLN  87          1HB       GLN  87 -14.108  -0.657 -16.762
  704   1HG   GLN  87          2HG       GLN  87 -15.568   0.028 -18.559
  705   2HG   GLN  87          1HG       GLN  87 -15.157   1.457 -17.610
  706   1HE2  GLN  87          2HE2      GLN  87 -14.645   2.406 -21.161
  707   2HE2  GLN  87          1HE2      GLN  87 -15.966   2.003 -20.174
  708    H    HIS  88           H        HIS  88 -13.205   0.111 -14.670
  709    HA   HIS  88           HA       HIS  88 -15.029   2.215 -13.935
  710   1HB   HIS  88          2HB       HIS  88 -14.870  -0.228 -13.054
  711   2HB   HIS  88          1HB       HIS  88 -13.638   0.414 -11.974
  712    HD1  HIS  88           HD1      HIS  88 -14.410   1.861 -10.021
  713    HD2  HIS  88           HD2      HIS  88 -17.509   0.923 -12.647
  714    HE1  HIS  88           HE1      HIS  88 -16.552   2.615  -8.899
  715    H    TYR  89           H        TYR  89 -11.705   1.397 -13.174
  716    HA   TYR  89           HA       TYR  89 -11.316   3.644 -11.415
  717   1HB   TYR  89          2HB       TYR  89  -9.393   1.771 -12.802
  718   2HB   TYR  89          1HB       TYR  89  -8.865   3.049 -11.719
  719    HD1  TYR  89           HD1      TYR  89 -11.546   0.418 -11.717
  720    HD2  TYR  89           HD2      TYR  89  -8.376   2.327  -9.548
  721    HE1  TYR  89           HE1      TYR  89 -11.945  -1.097  -9.832
  722    HE2  TYR  89           HE2      TYR  89  -8.782   0.807  -7.635
  723    HH   TYR  89           HH       TYR  89 -11.372  -0.759  -7.049
  724    H    SER  90           H        SER  90 -11.449   3.248 -14.790
  725    HA   SER  90           HA       SER  90  -9.595   5.220 -15.649
  726   1HB   SER  90          2HB       SER  90 -11.693   3.615 -16.830
  727   2HB   SER  90          1HB       SER  90 -11.757   5.266 -17.448
  728    HG   SER  90           HG       SER  90 -10.146   4.698 -18.643
  729    H    GLU  91           H        GLU  91 -12.958   5.372 -14.623
  730    HA   GLU  91           HA       GLU  91 -12.902   8.330 -14.944
  731   1HB   GLU  91          2HB       GLU  91 -15.262   6.577 -14.208
  732   2HB   GLU  91          1HB       GLU  91 -15.304   8.256 -14.748
  733   1HG   GLU  91          2HG       GLU  91 -13.855   6.731 -16.689
  734   2HG   GLU  91          1HG       GLU  91 -15.368   5.891 -16.349
  735    H    ARG  92           H        ARG  92 -12.367   5.932 -12.615
  736    HA   ARG  92           HA       ARG  92 -12.625   7.999 -10.482
  737   1HB   ARG  92          2HB       ARG  92 -13.652   5.209  -9.985
  738   2HB   ARG  92          1HB       ARG  92 -13.949   6.674  -9.050
  739   1HG   ARG  92          2HG       ARG  92 -15.316   7.599 -10.827
  740   2HG   ARG  92          1HG       ARG  92 -14.903   6.260 -11.898
  741   1HD   ARG  92          2HD       ARG  92 -16.374   4.835 -10.890
  742   2HD   ARG  92          1HD       ARG  92 -16.037   5.471  -9.280
  743    HE   ARG  92           HE       ARG  92 -17.820   6.878 -11.229
  744   1HH1  ARG  92          1HH2      ARG  92 -17.618   8.755  -9.259
  745   2HH1  ARG  92          2HH2      ARG  92 -18.633   8.247  -7.950
  746   1HH2  ARG  92          2HH1      ARG  92 -18.827   4.957  -9.028
  747   2HH2  ARG  92          1HH1      ARG  92 -19.316   6.096  -7.819
  748    H    ALA  93           H        ALA  93 -11.494   7.282  -8.445
  749    HA   ALA  93           HA       ALA  93  -9.000   5.870  -9.164
  750   1HB   ALA  93          1HB       ALA  93  -9.195   8.060  -7.753
  751   2HB   ALA  93          3HB       ALA  93  -9.630   6.975  -6.433
  752   3HB   ALA  93          2HB       ALA  93  -8.061   6.816  -7.223
  753    H    ALA  94           H        ALA  94 -11.776   5.537  -7.022
  754    HA   ALA  94           HA       ALA  94 -12.748   3.465  -6.346
  755   1HB   ALA  94          1HB       ALA  94 -10.878   2.426  -7.963
  756   2HB   ALA  94          3HB       ALA  94 -10.149   2.008  -6.412
  757   3HB   ALA  94          2HB       ALA  94 -11.770   1.437  -6.806
  758    H    GLY  95           H        GLY  95  -9.946   5.075  -5.205
  759   1HA   GLY  95          2HA       GLY  95 -10.432   5.485  -2.651
  760   2HA   GLY  95          1HA       GLY  95 -10.181   3.746  -2.559
  761    H    LEU  96           H        LEU  96  -8.063   4.137  -4.815
  762    HA   LEU  96           HA       LEU  96  -5.850   4.469  -2.950
  763   1HB   LEU  96          2HB       LEU  96  -4.462   3.699  -4.693
  764   2HB   LEU  96          1HB       LEU  96  -5.978   2.837  -4.940
  765    HG   LEU  96           HG       LEU  96  -5.094   5.337  -6.400
  766   1HD1  LEU  96          2HD1      LEU  96  -5.332   2.424  -7.154
  767   2HD1  LEU  96          1HD1      LEU  96  -5.233   3.706  -8.360
  768   3HD1  LEU  96          3HD1      LEU  96  -3.896   3.446  -7.240
  769   1HD2  LEU  96          2HD2      LEU  96  -7.613   3.683  -6.562
  770   2HD2  LEU  96          1HD2      LEU  96  -7.489   5.394  -6.158
  771   3HD2  LEU  96          3HD2      LEU  96  -7.136   4.848  -7.798
  772    H    SER  97           H        SER  97  -3.969   5.921  -3.664
  773    HA   SER  97           HA       SER  97  -4.647   8.607  -3.452
  774   1HB   SER  97          2HB       SER  97  -2.269   7.114  -3.920
  775   2HB   SER  97          1HB       SER  97  -2.292   8.454  -5.065
  776    HG   SER  97           HG       SER  97  -1.496   9.403  -3.323
  777    H    SER  98           H        SER  98  -4.062   6.822  -6.477
  778    HA   SER  98           HA       SER  98  -5.689   8.871  -7.876
  779   1HB   SER  98          2HB       SER  98  -3.682   8.402  -9.712
  780   2HB   SER  98          1HB       SER  98  -3.805   9.834  -8.690
  781    HG   SER  98           HG       SER  98  -2.302   9.073  -7.388
  782    H    ARG  99           H        ARG  99  -6.416   8.110 -10.012
  783    HA   ARG  99           HA       ARG  99  -6.893   5.208  -9.955
  784   1HB   ARG  99          2HB       ARG  99  -8.634   5.613 -11.476
  785   2HB   ARG  99          1HB       ARG  99  -8.620   7.078 -10.498
  786   1HG   ARG  99          2HG       ARG  99  -6.971   7.984 -12.308
  787   2HG   ARG  99          1HG       ARG  99  -7.618   6.683 -13.308
  788   1HD   ARG  99          2HD       ARG  99  -9.296   8.113 -13.819
  789   2HD   ARG  99          1HD       ARG  99  -9.892   7.815 -12.187
  790    HE   ARG  99           HE       ARG  99  -7.880   9.961 -12.486
  791   1HH1  ARG  99          1HH2      ARG  99  -9.255  10.227 -10.066
  792   2HH1  ARG  99          2HH2      ARG  99 -10.643  11.206 -10.409
  793   1HH2  ARG  99          2HH1      ARG  99 -10.495  10.685 -13.833
  794   2HH2  ARG  99          1HH1      ARG  99 -11.345  11.465 -12.541
  795    H    LEU 100           H        LEU 100  -6.896   4.188 -12.284
  796    HA   LEU 100           HA       LEU 100  -4.279   3.757 -13.140
  797   1HB   LEU 100          2HB       LEU 100  -5.390   3.098 -15.379
  798   2HB   LEU 100          1HB       LEU 100  -5.892   2.232 -13.930
  799    HG   LEU 100           HG       LEU 100  -7.663   4.289 -13.869
  800   1HD1  LEU 100          3HD1      LEU 100  -6.494   4.357 -16.493
  801   2HD1  LEU 100          2HD1      LEU 100  -8.192   3.893 -16.612
  802   3HD1  LEU 100          1HD1      LEU 100  -7.744   5.399 -15.810
  803   1HD2  LEU 100          3HD2      LEU 100  -7.892   1.683 -13.975
  804   2HD2  LEU 100          2HD2      LEU 100  -9.256   2.690 -14.454
  805   3HD2  LEU 100          1HD2      LEU 100  -8.220   1.968 -15.683
  806    H    VAL 101           H        VAL 101  -3.844   4.219 -15.761
  807    HA   VAL 101           HA       VAL 101  -2.863   6.832 -15.920
  808    HB   VAL 101           HB       VAL 101  -3.205   6.414 -18.504
  809   1HG1  VAL 101          1HG1      VAL 101  -1.105   6.177 -17.065
  810   2HG1  VAL 101          3HG1      VAL 101  -1.509   4.465 -16.933
  811   3HG1  VAL 101          2HG1      VAL 101  -1.163   5.170 -18.512
  812   1HG2  VAL 101          2HG2      VAL 101  -4.741   4.337 -17.461
  813   2HG2  VAL 101          1HG2      VAL 101  -4.163   4.466 -19.122
  814   3HG2  VAL 101          3HG2      VAL 101  -3.232   3.555 -17.933
  815    H    VAL 102           H        VAL 102  -3.823   8.762 -16.062
  816    HA   VAL 102           HA       VAL 102  -6.714   8.950 -16.406
  817    HB   VAL 102           HB       VAL 102  -4.998  11.388 -16.445
  818   1HG1  VAL 102          1HG1      VAL 102  -7.680  10.521 -15.583
  819   2HG1  VAL 102          3HG1      VAL 102  -6.879  11.628 -14.467
  820   3HG1  VAL 102          2HG1      VAL 102  -7.136  12.101 -16.146
  821   1HG2  VAL 102          3HG2      VAL 102  -5.179   9.430 -14.154
  822   2HG2  VAL 102          2HG2      VAL 102  -3.737  10.188 -14.832
  823   3HG2  VAL 102          1HG2      VAL 102  -4.874  11.146 -13.882
  824    HA   PRO 103           HA       PRO 103  -5.386  11.135 -20.440
  825   1HB   PRO 103          2HB       PRO 103  -2.746  10.946 -21.179
  826   2HB   PRO 103          1HB       PRO 103  -3.394  12.264 -20.191
  827   1HG   PRO 103          2HG       PRO 103  -1.704   9.947 -19.369
  828   2HG   PRO 103          1HG       PRO 103  -1.865  11.539 -18.613
  829   1HD   PRO 103          2HD       PRO 103  -3.089   9.124 -17.746
  830   2HD   PRO 103          1HD       PRO 103  -3.450  10.755 -17.154
  831    H    SER 104           H        SER 104  -4.382  10.298 -22.703
  832    HA   SER 104           HA       SER 104  -4.397   7.309 -22.670
  833   1HB   SER 104          2HB       SER 104  -6.525   8.736 -23.541
  834   2HB   SER 104          1HB       SER 104  -5.576   8.683 -25.027
  835    HG   SER 104           HG       SER 104  -6.790   6.856 -25.015
  836    H    HIS 105           H        HIS 105  -2.470   6.638 -23.463
  837    HA   HIS 105           HA       HIS 105  -0.433   8.083 -24.584
  838   1HB   HIS 105          2HB       HIS 105  -1.266   5.262 -24.732
  839   2HB   HIS 105          1HB       HIS 105  -0.224   5.779 -26.059
  840    HD1  HIS 105           HD1      HIS 105   1.279   3.948 -24.394
  841    HD2  HIS 105           HD2      HIS 105   0.843   7.925 -23.233
  842    HE1  HIS 105           HE1      HIS 105   3.147   4.419 -22.748
  843    H    LYS 106           HN       LYS 106  -0.001   9.076 -26.494
  844    HA   LYS 106           HA       LYS 106  -1.021   8.389 -29.027
  845   1HB   LYS 106          2HB       LYS 106  -3.196   9.095 -27.944
  846   2HB   LYS 106          1HB       LYS 106  -2.523  10.719 -27.808
  847   1HG   LYS 106          2HG       LYS 106  -2.174  10.749 -30.272
  848   2HG   LYS 106          1HG       LYS 106  -2.928   9.159 -30.379
  849   1HD   LYS 106          2HD       LYS 106  -4.671  10.806 -28.851
  850   2HD   LYS 106          1HD       LYS 106  -4.197  11.734 -30.273
  851   1HE   LYS 106          2HE       LYS 106  -4.909   8.870 -30.696
  852   2HE   LYS 106          1HE       LYS 106  -6.230   9.981 -30.331
  853   1HZ   LYS 106          2HZ       LYS 106  -4.415  11.086 -32.228
  854   2HZ   LYS 106          1HZ       LYS 106  -5.044   9.605 -32.771
  855   3HZ   LYS 106          3HZ       LYS 106  -6.095  10.866 -32.345
  856   1H    GLU 201          3HT       GLU 201   5.933  -7.043   5.959
  857   2H    GLU 201          2HT       GLU 201   5.989  -8.523   6.791
  858   3H    GLU 201          1HT       GLU 201   7.242  -8.096   5.726
  859    HA   GLU 201           HA       GLU 201   6.153  -9.386   4.271
  860   1HB   GLU 201          2HB       GLU 201   3.666  -9.802   4.513
  861   2HB   GLU 201          1HB       GLU 201   4.633 -10.319   5.895
  862   1HG   GLU 201          2HG       GLU 201   4.127  -7.808   6.686
  863   2HG   GLU 201          1HG       GLU 201   2.706  -8.054   5.670
  864    HA   PRO 202           HA       PRO 202   4.902  -6.208   1.511
  865   1HB   PRO 202          2HB       PRO 202   3.972  -7.781  -0.543
  866   2HB   PRO 202          1HB       PRO 202   5.692  -7.558  -0.182
  867   1HG   PRO 202          2HG       PRO 202   3.956  -9.924   0.346
  868   2HG   PRO 202          1HG       PRO 202   5.708  -9.852   0.093
  869   1HD   PRO 202          2HD       PRO 202   4.404 -10.114   2.592
  870   2HD   PRO 202          1HD       PRO 202   6.116  -9.709   2.345
  871    H    GLN 203           H        GLN 203   3.079  -4.982   1.837
  872    HA   GLN 203           HA       GLN 203   0.432  -6.376   1.759
  873   1HB   GLN 203          2HB       GLN 203   1.194  -3.882   3.311
  874   2HB   GLN 203          1HB       GLN 203  -0.397  -4.645   3.300
  875   1HG   GLN 203          2HG       GLN 203   1.605  -6.625   3.901
  876   2HG   GLN 203          1HG       GLN 203   1.789  -5.254   4.996
  877   1HE2  GLN 203          2HE2      GLN 203  -0.873  -7.708   6.219
  878   2HE2  GLN 203          1HE2      GLN 203   0.699  -7.970   5.638
  879   1HN   PTR 204          1HN       PTR 204   2.383  -3.715   0.620
  880    HA   PTR 204           HA       PTR 204   2.002  -2.171  -1.106
  881   1HB   PTR 204          1HB       PTR 204  -0.061  -2.866  -2.608
  882    HD1  PTR 204           HD1      PTR 204   3.073  -4.285  -1.230
  883    HD2  PTR 204           HD2      PTR 204   0.677  -3.691  -4.743
  884    HE1  PTR 204           HE1      PTR 204   4.975  -5.004  -2.648
  885    HE2  PTR 204           HE2      PTR 204   2.580  -4.409  -6.163
  886    H    GLU 205           H        GLU 205   0.650  -0.330  -1.558
  887    HA   GLU 205           HA       GLU 205  -0.760   0.795   0.551
  888   1HB   GLU 205          2HB       GLU 205  -0.920   1.178  -2.423
  889   2HB   GLU 205          1HB       GLU 205  -2.074   2.015  -1.384
  890   1HG   GLU 205          2HG       GLU 205   0.120   2.623  -0.014
  891   2HG   GLU 205          1HG       GLU 205   0.893   2.351  -1.577
  892    H    GLU 206           H        GLU 206  -2.858   0.662   1.338
  893    HA   GLU 206           HA       GLU 206  -4.723  -1.170  -0.109
  894   1HB   GLU 206          2HB       GLU 206  -4.432  -1.038   2.903
  895   2HB   GLU 206          1HB       GLU 206  -5.382  -2.194   1.968
  896   1HG   GLU 206          2HG       GLU 206  -3.023  -2.677   0.833
  897   2HG   GLU 206          1HG       GLU 206  -2.423  -2.060   2.373
  898    H    ILE 207           H        ILE 207  -6.359   0.139  -0.759
  899    HA   ILE 207           HA       ILE 207  -7.056   2.670   0.091
  900    HB   ILE 207           HB       ILE 207  -8.793   0.398  -0.879
  901   1HG1  ILE 207          2HG1      ILE 207  -8.931   2.134  -2.825
  902   2HG1  ILE 207          1HG1      ILE 207  -7.527   2.869  -2.051
  903   1HG2  ILE 207          2HG2      ILE 207  -9.586   3.233  -0.170
  904   2HG2  ILE 207          1HG2      ILE 207 -10.529   2.222  -1.265
  905   3HG2  ILE 207          3HG2      ILE 207 -10.307   1.733   0.415
  906   1HD1  ILE 207          3HD1      ILE 207  -7.341  -0.057  -2.340
  907   2HD1  ILE 207          2HD1      ILE 207  -7.403   0.815  -3.872
  908   3HD1  ILE 207          1HD1      ILE 207  -6.143   1.187  -2.694
  909    HA   PRO 208           HA       PRO 208  -8.172   1.522   4.322
  910   1HB   PRO 208          2HB       PRO 208  -7.690   4.030   5.336
  911   2HB   PRO 208          1HB       PRO 208  -6.426   2.812   5.097
  912   1HG   PRO 208          2HG       PRO 208  -6.996   5.263   3.496
  913   2HG   PRO 208          1HG       PRO 208  -5.468   4.392   3.710
  914   1HD   PRO 208          2HD       PRO 208  -7.164   4.238   1.448
  915   2HD   PRO 208          1HD       PRO 208  -5.816   3.143   1.819
  916    H    ILE 209           H        ILE 209  -9.914   2.368   5.767
  917    HA   ILE 209           HA       ILE 209 -11.631   4.528   5.100
  918    HB   ILE 209           HB       ILE 209 -12.031   3.072   3.071
  919   1HG1  ILE 209          2HG1      ILE 209 -14.591   3.119   4.610
  920   2HG1  ILE 209          1HG1      ILE 209 -13.744   4.652   4.395
  921   1HG2  ILE 209          3HG2      ILE 209 -12.224   1.076   5.070
  922   2HG2  ILE 209          2HG2      ILE 209 -13.838   1.249   4.380
  923   3HG2  ILE 209          1HG2      ILE 209 -12.468   0.881   3.334
  924   1HD1  ILE 209          3HD1      ILE 209 -13.568   3.855   1.886
  925   2HD1  ILE 209          2HD1      ILE 209 -14.946   2.845   2.323
  926   3HD1  ILE 209          1HD1      ILE 209 -15.056   4.599   2.472
  927    H    TYR 210           H        TYR 210 -10.543   3.247   7.433
  928    HA   TYR 210           HA       TYR 210 -13.001   2.176   8.744
  929   1HB   TYR 210          2HB       TYR 210 -11.108   1.659  10.564
  930   2HB   TYR 210          1HB       TYR 210 -11.424   0.562   9.222
  931    HD1  TYR 210           HD1      TYR 210  -9.264   3.385  10.341
  932    HD2  TYR 210           HD2      TYR 210  -9.783   0.162   7.549
  933    HE1  TYR 210           HE1      TYR 210  -6.943   3.714   9.529
  934    HE2  TYR 210           HE2      TYR 210  -7.463   0.492   6.737
  935    HH   TYR 210           HH       TYR 210  -5.211   1.626   8.023
  936    H    LEU 211           HN       LEU 211 -12.687   2.733  11.320
  937    HA   LEU 211           HA       LEU 211 -13.128   5.584  11.481
  938   1HB   LEU 211          2HB       LEU 211 -13.041   3.306  13.419
  939   2HB   LEU 211          1HB       LEU 211 -12.895   4.943  14.059
  940    HG   LEU 211           HG       LEU 211 -14.966   5.523  12.683
  941   1HD1  LEU 211          3HD1      LEU 211 -14.516   2.930  11.694
  942   2HD1  LEU 211          2HD1      LEU 211 -15.951   2.793  12.711
  943   3HD1  LEU 211          1HD1      LEU 211 -15.921   3.949  11.380
  944   1HD2  LEU 211          2HD2      LEU 211 -14.688   4.132  15.196
  945   2HD2  LEU 211          1HD2      LEU 211 -15.866   5.363  14.741
  946   3HD2  LEU 211          3HD2      LEU 211 -16.201   3.661  14.421
   
  No H/Q in entry =         946
  Start of MODEL    7
    1   1H    SER   1          3HT       SER   1  -8.450  -9.419 -25.626
    2   2H    SER   1          2HT       SER   1  -7.897 -11.007 -25.385
    3   3H    SER   1          1HT       SER   1  -8.871 -10.256 -24.213
    4    HA   SER   1           HA       SER   1  -6.563 -10.291 -23.505
    5   1HB   SER   1          2HB       SER   1  -5.907 -10.073 -26.079
    6   2HB   SER   1          1HB       SER   1  -5.883  -8.355 -25.682
    7    HG   SER   1           HG       SER   1  -3.862  -9.477 -25.352
    8    H    ILE   2           H        ILE   2  -5.640  -8.380 -22.375
    9    HA   ILE   2           HA       ILE   2  -7.758  -6.415 -21.814
   10    HB   ILE   2           HB       ILE   2  -5.990  -5.594 -20.124
   11   1HG1  ILE   2          2HG1      ILE   2  -4.741  -8.283 -20.707
   12   2HG1  ILE   2          1HG1      ILE   2  -4.145  -6.807 -21.467
   13   1HG2  ILE   2          2HG2      ILE   2  -7.646  -8.001 -20.169
   14   2HG2  ILE   2          1HG2      ILE   2  -6.298  -8.140 -19.041
   15   3HG2  ILE   2          3HG2      ILE   2  -7.442  -6.808 -18.887
   16   1HD1  ILE   2          1HD1      ILE   2  -4.363  -6.072 -18.811
   17   2HD1  ILE   2          3HD1      ILE   2  -3.825  -7.748 -18.703
   18   3HD1  ILE   2          2HD1      ILE   2  -2.870  -6.572 -19.607
   19    H    GLN   3           H        GLN   3  -6.924  -4.043 -21.520
   20    HA   GLN   3           HA       GLN   3  -6.162  -3.027 -24.055
   21   1HB   GLN   3          2HB       GLN   3  -5.630  -1.557 -21.478
   22   2HB   GLN   3          1HB       GLN   3  -6.146  -0.905 -23.032
   23   1HG   GLN   3          2HG       GLN   3  -8.188  -2.638 -22.507
   24   2HG   GLN   3          1HG       GLN   3  -7.763  -2.116 -20.877
   25   1HE2  GLN   3          2HE2      GLN   3  -9.676   0.800 -21.374
   26   2HE2  GLN   3          1HE2      GLN   3  -9.330  -0.540 -20.390
   27    H    ALA   4           H        ALA   4  -4.251  -3.497 -21.107
   28    HA   ALA   4           HA       ALA   4  -1.929  -3.462 -20.778
   29   1HB   ALA   4          2HB       ALA   4  -2.544  -5.445 -22.483
   30   2HB   ALA   4          1HB       ALA   4  -1.499  -4.489 -23.535
   31   3HB   ALA   4          3HB       ALA   4  -0.882  -5.100 -22.000
   32    H    GLU   5           H        GLU   5  -3.256  -1.157 -22.278
   33    HA   GLU   5           HA       GLU   5  -0.713   0.079 -23.167
   34   1HB   GLU   5          2HB       GLU   5  -3.218  -0.150 -24.850
   35   2HB   GLU   5          1HB       GLU   5  -1.964   1.049 -25.167
   36   1HG   GLU   5          2HG       GLU   5  -0.300  -0.865 -25.236
   37   2HG   GLU   5          1HG       GLU   5  -1.676  -1.967 -25.193
   38    H    GLU   6           H        GLU   6  -3.107   0.238 -21.086
   39    HA   GLU   6           HA       GLU   6  -3.044   3.194 -20.985
   40   1HB   GLU   6          2HB       GLU   6  -5.541   1.518 -21.230
   41   2HB   GLU   6          1HB       GLU   6  -5.573   3.121 -20.495
   42   1HG   GLU   6          2HG       GLU   6  -4.790   4.155 -22.516
   43   2HG   GLU   6          1HG       GLU   6  -4.408   2.594 -23.240
   44    H    TRP   7           H        TRP   7  -2.297   0.576 -19.457
   45    HA   TRP   7           HA       TRP   7  -2.150   1.538 -16.849
   46   1HB   TRP   7          2HB       TRP   7  -4.096   0.272 -15.797
   47   2HB   TRP   7          1HB       TRP   7  -4.538   1.716 -16.706
   48    HD1  TRP   7           HD1      TRP   7  -5.791   1.394 -19.001
   49    HE1  TRP   7           HE1      TRP   7  -6.974  -0.620 -20.086
   50    HE3  TRP   7           HE3      TRP   7  -4.005  -2.361 -16.048
   51    HZ2  TRP   7           HZ2      TRP   7  -7.133  -3.458 -19.749
   52    HZ3  TRP   7           HZ3      TRP   7  -4.682  -4.712 -16.455
   53    HH2  TRP   7           HH2      TRP   7  -6.242  -5.263 -18.300
   54    H    TYR   8           H        TYR   8  -1.312  -0.716 -18.964
   55    HA   TYR   8           HA       TYR   8  -0.455  -2.589 -16.879
   56   1HB   TYR   8          2HB       TYR   8  -2.500  -3.595 -17.194
   57   2HB   TYR   8          1HB       TYR   8  -2.576  -3.181 -18.902
   58    HD1  TYR   8           HD1      TYR   8  -0.414  -4.351 -20.262
   59    HD2  TYR   8           HD2      TYR   8  -2.377  -5.797 -16.723
   60    HE1  TYR   8           HE1      TYR   8   0.299  -6.659 -20.805
   61    HE2  TYR   8           HE2      TYR   8  -1.681  -8.096 -17.280
   62    HH   TYR   8           HH       TYR   8  -0.933  -9.416 -19.065
   63    H    PHE   9           H        PHE   9   1.487  -3.443 -17.351
   64    HA   PHE   9           HA       PHE   9   2.621  -2.844 -20.032
   65   1HB   PHE   9          2HB       PHE   9   3.776  -3.284 -17.292
   66   2HB   PHE   9          1HB       PHE   9   4.792  -3.524 -18.711
   67    HD1  PHE   9           HD1      PHE   9   2.083  -1.132 -19.040
   68    HD2  PHE   9           HD2      PHE   9   6.193  -1.572 -17.850
   69    HE1  PHE   9           HE1      PHE   9   2.401   1.320 -19.215
   70    HE2  PHE   9           HE2      PHE   9   6.504   0.877 -18.027
   71    HZ   PHE   9           HZ       PHE   9   4.610   2.325 -18.710
   72    H    GLY  10           H        GLY  10   2.129  -5.519 -17.755
   73   1HA   GLY  10          2HA       GLY  10   1.635  -7.624 -19.319
   74   2HA   GLY  10          1HA       GLY  10   3.340  -7.405 -19.688
   75    H    LYS  11           H        LYS  11   4.504  -8.850 -18.558
   76    HA   LYS  11           HA       LYS  11   3.637  -9.542 -15.794
   77   1HB   LYS  11          2HB       LYS  11   5.718 -10.997 -17.436
   78   2HB   LYS  11          1HB       LYS  11   4.815 -11.598 -16.046
   79   1HG   LYS  11          2HG       LYS  11   3.084 -12.245 -17.347
   80   2HG   LYS  11          1HG       LYS  11   3.040 -10.687 -18.176
   81   1HD   LYS  11          2HD       LYS  11   5.125 -11.510 -19.449
   82   2HD   LYS  11          1HD       LYS  11   4.723 -13.113 -18.832
   83   1HE   LYS  11          2HE       LYS  11   2.406 -12.800 -19.798
   84   2HE   LYS  11          1HE       LYS  11   2.998 -11.332 -20.576
   85   1HZ   LYS  11          3HZ       LYS  11   4.700 -12.659 -21.679
   86   2HZ   LYS  11          2HZ       LYS  11   4.094 -14.068 -20.950
   87   3HZ   LYS  11          1HZ       LYS  11   3.144 -13.212 -22.069
   88    H    LEU  12           H        LEU  12   4.552  -7.314 -15.380
   89    HA   LEU  12           HA       LEU  12   7.520  -7.271 -15.299
   90   1HB   LEU  12          2HB       LEU  12   6.181  -5.384 -16.330
   91   2HB   LEU  12          1HB       LEU  12   5.592  -5.018 -14.709
   92    HG   LEU  12           HG       LEU  12   7.832  -4.595 -13.920
   93   1HD1  LEU  12          3HD1      LEU  12   8.518  -6.110 -16.332
   94   2HD1  LEU  12          2HD1      LEU  12   9.482  -4.643 -16.154
   95   3HD1  LEU  12          1HD1      LEU  12   9.464  -5.847 -14.864
   96   1HD2  LEU  12          2HD2      LEU  12   6.737  -3.229 -16.279
   97   2HD2  LEU  12          1HD2      LEU  12   7.336  -2.554 -14.762
   98   3HD2  LEU  12          3HD2      LEU  12   8.468  -2.970 -16.050
   99    H    GLY  13           H        GLY  13   8.477  -6.204 -13.317
  100   1HA   GLY  13          2HA       GLY  13   7.037  -7.138 -10.868
  101   2HA   GLY  13          1HA       GLY  13   8.793  -7.180 -11.039
  102    H    ARG  14           H        ARG  14   7.129  -5.754  -9.030
  103    HA   ARG  14           HA       ARG  14   6.788  -3.044  -9.362
  104   1HB   ARG  14          2HB       ARG  14   6.475  -4.580  -7.301
  105   2HB   ARG  14          1HB       ARG  14   8.141  -4.146  -6.912
  106   1HG   ARG  14          2HG       ARG  14   6.113  -2.048  -7.594
  107   2HG   ARG  14          1HG       ARG  14   6.243  -2.677  -5.952
  108   1HD   ARG  14          2HD       ARG  14   8.885  -2.147  -6.901
  109   2HD   ARG  14          1HD       ARG  14   7.900  -0.720  -7.233
  110    HE   ARG  14           HE       ARG  14   7.217  -1.021  -4.706
  111   1HH1  ARG  14          2HH1      ARG  14  10.123  -0.222  -6.052
  112   2HH1  ARG  14          1HH1      ARG  14  11.098  -0.593  -4.669
  113   1HH2  ARG  14          1HH2      ARG  14   8.525  -2.157  -2.947
  114   2HH2  ARG  14          2HH2      ARG  14  10.192  -1.689  -2.911
  115    H    LYS  15           H        LYS  15   9.847  -4.713  -9.387
  116    HA   LYS  15           HA       LYS  15  11.440  -2.431  -8.671
  117   1HB   LYS  15          2HB       LYS  15  11.924  -5.206  -9.560
  118   2HB   LYS  15          1HB       LYS  15  13.170  -4.044 -10.016
  119   1HG   LYS  15          2HG       LYS  15  12.773  -3.300  -7.445
  120   2HG   LYS  15          1HG       LYS  15  12.377  -5.014  -7.322
  121   1HD   LYS  15          2HD       LYS  15  14.528  -5.620  -8.302
  122   2HD   LYS  15          1HD       LYS  15  14.918  -3.921  -8.568
  123   1HE   LYS  15          2HE       LYS  15  16.029  -4.324  -6.559
  124   2HE   LYS  15          1HE       LYS  15  14.476  -3.729  -5.972
  125   1HZ   LYS  15          3HZ       LYS  15  13.728  -6.050  -5.819
  126   2HZ   LYS  15          2HZ       LYS  15  15.281  -6.571  -6.269
  127   3HZ   LYS  15          1HZ       LYS  15  15.054  -5.729  -4.811
  128    H    ASP  16           H        ASP  16  10.496  -3.977 -11.710
  129    HA   ASP  16           HA       ASP  16  11.985  -2.140 -13.322
  130   1HB   ASP  16          2HB       ASP  16  11.041  -4.547 -13.820
  131   2HB   ASP  16          1HB       ASP  16   9.626  -3.642 -14.320
  132    H    ALA  17           H        ALA  17   8.735  -2.376 -12.077
  133    HA   ALA  17           HA       ALA  17   7.470  -0.413 -13.681
  134   1HB   ALA  17          1HB       ALA  17   6.265  -1.936 -12.130
  135   2HB   ALA  17          3HB       ALA  17   6.929  -1.034 -10.768
  136   3HB   ALA  17          2HB       ALA  17   5.816  -0.247 -11.889
  137    H    GLU  18           H        GLU  18   8.963  -0.017 -10.462
  138    HA   GLU  18           HA       GLU  18   8.670   2.812 -10.369
  139   1HB   GLU  18          2HB       GLU  18  10.612   2.724  -8.757
  140   2HB   GLU  18          1HB       GLU  18   9.301   1.613  -8.363
  141   1HG   GLU  18          2HG       GLU  18  11.053   0.131  -8.210
  142   2HG   GLU  18          1HG       GLU  18  10.750  -0.006  -9.941
  143    H    ARG  19           H        ARG  19  11.395   0.813 -11.537
  144    HA   ARG  19           HA       ARG  19  12.930   3.116 -12.414
  145   1HB   ARG  19          2HB       ARG  19  13.475   0.436 -12.026
  146   2HB   ARG  19          1HB       ARG  19  13.485   0.578 -13.783
  147   1HG   ARG  19          2HG       ARG  19  14.850   2.821 -12.517
  148   2HG   ARG  19          1HG       ARG  19  15.570   1.278 -12.059
  149   1HD   ARG  19          2HD       ARG  19  16.362   0.892 -14.155
  150   2HD   ARG  19          1HD       ARG  19  14.887   1.484 -14.918
  151    HE   ARG  19           HE       ARG  19  15.875   3.634 -15.059
  152   1HH1  ARG  19          2HH1      ARG  19  16.757   4.002 -12.269
  153   2HH1  ARG  19          1HH1      ARG  19  18.484   3.978 -12.400
  154   1HH2  ARG  19          1HH2      ARG  19  18.490   2.530 -15.550
  155   2HH2  ARG  19          2HH2      ARG  19  19.466   3.144 -14.257
  156    H    GLN  20           H        GLN  20  10.179   1.586 -13.651
  157    HA   GLN  20           HA       GLN  20  10.810   2.194 -16.474
  158   1HB   GLN  20          2HB       GLN  20   8.526   0.838 -15.052
  159   2HB   GLN  20          1HB       GLN  20   8.317   1.407 -16.708
  160   1HG   GLN  20          2HG       GLN  20  10.818  -0.092 -16.209
  161   2HG   GLN  20          1HG       GLN  20   9.338  -1.039 -16.060
  162   1HE2  GLN  20          2HE2      GLN  20  10.178  -1.229 -19.638
  163   2HE2  GLN  20          1HE2      GLN  20  10.749  -1.865 -18.171
  164    H    LEU  21           H        LEU  21   7.904   2.904 -14.524
  165    HA   LEU  21           HA       LEU  21   7.007   5.113 -15.945
  166   1HB   LEU  21          2HB       LEU  21   6.989   4.917 -12.920
  167   2HB   LEU  21          1HB       LEU  21   5.865   5.830 -13.927
  168    HG   LEU  21           HG       LEU  21   5.819   3.203 -14.944
  169   1HD1  LEU  21          2HD1      LEU  21   6.709   3.102 -12.278
  170   2HD1  LEU  21          1HD1      LEU  21   4.992   2.703 -12.208
  171   3HD1  LEU  21          3HD1      LEU  21   6.077   1.759 -13.232
  172   1HD2  LEU  21          3HD2      LEU  21   3.959   4.835 -13.209
  173   2HD2  LEU  21          2HD2      LEU  21   3.864   4.560 -14.948
  174   3HD2  LEU  21          1HD2      LEU  21   3.504   3.247 -13.827
  175    H    LEU  22           H        LEU  22   9.403   5.110 -13.304
  176    HA   LEU  22           HA       LEU  22   9.893   7.947 -13.442
  177   1HB   LEU  22          2HB       LEU  22  11.459   5.627 -12.300
  178   2HB   LEU  22          1HB       LEU  22  12.046   7.289 -12.217
  179    HG   LEU  22           HG       LEU  22   9.251   7.091 -11.418
  180   1HD1  LEU  22          3HD1      LEU  22  11.260   5.237 -10.206
  181   2HD1  LEU  22          2HD1      LEU  22  10.114   6.037  -9.131
  182   3HD1  LEU  22          1HD1      LEU  22   9.527   5.014 -10.442
  183   1HD2  LEU  22          3HD2      LEU  22  11.025   8.932 -11.034
  184   2HD2  LEU  22          2HD2      LEU  22   9.977   8.524  -9.675
  185   3HD2  LEU  22          1HD2      LEU  22  11.625   7.901  -9.735
  186    H    SER  23           H        SER  23  11.674   5.128 -14.778
  187    HA   SER  23           HA       SER  23  13.234   7.041 -16.448
  188   1HB   SER  23          2HB       SER  23  13.747   4.081 -16.342
  189   2HB   SER  23          1HB       SER  23  14.886   5.395 -16.638
  190    HG   SER  23           HG       SER  23  14.652   6.002 -14.464
  191    H    PHE  24           H        PHE  24  10.549   6.709 -17.190
  192    HA   PHE  24           HA       PHE  24  10.728   4.910 -19.571
  193   1HB   PHE  24          2HB       PHE  24   8.844   4.290 -18.226
  194   2HB   PHE  24          1HB       PHE  24   8.357   5.971 -18.018
  195    HD1  PHE  24           HD1      PHE  24   9.469   4.172 -21.102
  196    HD2  PHE  24           HD2      PHE  24   6.246   6.141 -19.054
  197    HE1  PHE  24           HE1      PHE  24   8.076   4.020 -23.148
  198    HE2  PHE  24           HE2      PHE  24   4.854   5.988 -21.101
  199    HZ   PHE  24           HZ       PHE  24   5.768   4.928 -23.147
  200    H    GLY  25           H        GLY  25   9.983   8.183 -18.483
  201   1HA   GLY  25          2HA       GLY  25  10.729   9.998 -20.051
  202   2HA   GLY  25          1HA       GLY  25  10.029   9.035 -21.352
  203    H    ASN  26           H        ASN  26   8.132   8.813 -18.573
  204    HA   ASN  26           HA       ASN  26   6.311  10.944 -19.619
  205   1HB   ASN  26          2HB       ASN  26   5.823   8.206 -19.330
  206   2HB   ASN  26          1HB       ASN  26   5.026   8.940 -17.938
  207   1HD2  ASN  26          2HD2      ASN  26   3.738   9.960 -21.715
  208   2HD2  ASN  26          1HD2      ASN  26   5.321   9.383 -21.508
  209    HA   PRO  27           HA       PRO  27   6.636  12.790 -15.640
  210   1HB   PRO  27          2HB       PRO  27   4.388  14.368 -15.787
  211   2HB   PRO  27          1HB       PRO  27   5.898  14.732 -16.636
  212   1HG   PRO  27          2HG       PRO  27   3.328  13.665 -17.725
  213   2HG   PRO  27          1HG       PRO  27   4.580  14.613 -18.541
  214   1HD   PRO  27          2HD       PRO  27   4.199  11.812 -18.764
  215   2HD   PRO  27          1HD       PRO  27   5.626  12.718 -19.308
  216    H    ARG  28           H        ARG  28   5.003  13.301 -13.711
  217    HA   ARG  28           HA       ARG  28   4.078  10.944 -12.575
  218   1HB   ARG  28          2HB       ARG  28   2.602  12.360 -11.156
  219   2HB   ARG  28          1HB       ARG  28   4.222  13.038 -11.308
  220   1HG   ARG  28          2HG       ARG  28   3.499  14.829 -12.537
  221   2HG   ARG  28          1HG       ARG  28   2.266  13.886 -13.373
  222   1HD   ARG  28          2HD       ARG  28   2.088  14.788 -10.482
  223   2HD   ARG  28          1HD       ARG  28   1.281  15.582 -11.833
  224    HE   ARG  28           HE       ARG  28   0.668  12.801 -10.920
  225   1HH1  ARG  28          2HH1      ARG  28   0.017  14.049 -13.747
  226   2HH1  ARG  28          1HH1      ARG  28  -1.671  14.371 -13.523
  227   1HH2  ARG  28          1HH2      ARG  28  -1.569  13.949 -10.083
  228   2HH2  ARG  28          2HH2      ARG  28  -2.569  14.314 -11.450
  229    H    GLY  29           H        GLY  29   1.663  10.430 -12.103
  230   1HA   GLY  29          2HA       GLY  29  -0.579  10.170 -12.894
  231   2HA   GLY  29          1HA       GLY  29  -0.147  11.080 -14.341
  232    H    THR  30           H        THR  30   2.196   8.748 -13.653
  233    HA   THR  30           HA       THR  30   1.238   7.102 -15.913
  234    HB   THR  30           HB       THR  30   3.721   6.369 -14.454
  235    HG1  THR  30           HG1      THR  30   3.443   8.750 -15.968
  236   1HG2  THR  30          1HG2      THR  30   2.696   5.540 -16.746
  237   2HG2  THR  30          3HG2      THR  30   3.487   6.987 -17.374
  238   3HG2  THR  30          2HG2      THR  30   4.439   5.741 -16.567
  239    H    PHE  31           H        PHE  31  -0.366   5.730 -15.202
  240    HA   PHE  31           HA       PHE  31   0.255   4.040 -12.812
  241   1HB   PHE  31          2HB       PHE  31  -2.387   4.941 -13.976
  242   2HB   PHE  31          1HB       PHE  31  -2.256   3.698 -12.735
  243    HD1  PHE  31           HD1      PHE  31  -0.704   7.073 -13.354
  244    HD2  PHE  31           HD2      PHE  31  -2.715   4.466 -10.595
  245    HE1  PHE  31           HE1      PHE  31  -0.589   8.828 -11.610
  246    HE2  PHE  31           HE2      PHE  31  -2.601   6.225  -8.852
  247    HZ   PHE  31           HZ       PHE  31  -1.539   8.408  -9.361
  248    H    LEU  32           H        LEU  32   1.188   2.227 -13.775
  249    HA   LEU  32           HA       LEU  32  -0.301   0.986 -16.044
  250   1HB   LEU  32          2HB       LEU  32   1.775  -0.177 -16.575
  251   2HB   LEU  32          1HB       LEU  32   2.108   1.549 -16.425
  252    HG   LEU  32           HG       LEU  32   2.515   0.831 -13.867
  253   1HD1  LEU  32          1HD1      LEU  32   2.826  -1.648 -15.532
  254   2HD1  LEU  32          3HD1      LEU  32   3.915  -1.384 -14.170
  255   3HD1  LEU  32          2HD1      LEU  32   2.175  -1.475 -13.901
  256   1HD2  LEU  32          3HD2      LEU  32   4.373   0.732 -16.240
  257   2HD2  LEU  32          2HD2      LEU  32   4.224   1.987 -15.010
  258   3HD2  LEU  32          1HD2      LEU  32   4.974   0.442 -14.607
  259    H    ILE  33           H        ILE  33   0.579  -1.581 -15.865
  260    HA   ILE  33           HA       ILE  33  -0.106  -2.539 -13.132
  261    HB   ILE  33           HB       ILE  33  -1.594  -3.078 -15.673
  262   1HG1  ILE  33          2HG1      ILE  33  -2.255  -2.761 -12.748
  263   2HG1  ILE  33          1HG1      ILE  33  -2.672  -1.681 -14.076
  264   1HG2  ILE  33          2HG2      ILE  33  -0.633  -5.297 -15.027
  265   2HG2  ILE  33          1HG2      ILE  33  -1.433  -5.134 -13.464
  266   3HG2  ILE  33          3HG2      ILE  33  -2.391  -5.233 -14.938
  267   1HD1  ILE  33          3HD1      ILE  33  -3.859  -3.898 -14.995
  268   2HD1  ILE  33          2HD1      ILE  33  -3.918  -4.274 -13.275
  269   3HD1  ILE  33          1HD1      ILE  33  -4.679  -2.803 -13.882
  270    H    ARG  34           H        ARG  34   0.369  -5.045 -13.105
  271    HA   ARG  34           HA       ARG  34   2.164  -6.201 -14.988
  272   1HB   ARG  34          2HB       ARG  34   4.274  -5.965 -13.531
  273   2HB   ARG  34          1HB       ARG  34   3.794  -4.556 -14.476
  274   1HG   ARG  34          2HG       ARG  34   2.966  -3.419 -12.599
  275   2HG   ARG  34          1HG       ARG  34   2.778  -4.902 -11.664
  276   1HD   ARG  34          2HD       ARG  34   5.278  -5.137 -11.650
  277   2HD   ARG  34          1HD       ARG  34   5.388  -3.560 -12.433
  278    HE   ARG  34           HE       ARG  34   5.117  -2.650 -10.287
  279   1HH1  ARG  34          2HH1      ARG  34   4.337  -5.936 -10.124
  280   2HH1  ARG  34          1HH1      ARG  34   3.338  -5.799  -8.716
  281   1HH2  ARG  34          1HH2      ARG  34   3.446  -2.333  -8.652
  282   2HH2  ARG  34          2HH2      ARG  34   2.834  -3.759  -7.882
  283    H    GLU  35           H        GLU  35   2.577  -8.322 -14.438
  284    HA   GLU  35           HA       GLU  35   1.039  -9.578 -12.426
  285   1HB   GLU  35          2HB       GLU  35   3.280 -10.376 -14.209
  286   2HB   GLU  35          1HB       GLU  35   2.932 -11.427 -12.844
  287   1HG   GLU  35          2HG       GLU  35   0.468 -11.273 -13.597
  288   2HG   GLU  35          1HG       GLU  35   1.107 -10.626 -15.109
  289    H    SER  36           H        SER  36   1.425 -10.100 -10.306
  290    HA   SER  36           HA       SER  36   3.687  -8.866  -8.945
  291   1HB   SER  36          2HB       SER  36   1.546 -10.744  -7.897
  292   2HB   SER  36          1HB       SER  36   2.620  -9.747  -6.923
  293    HG   SER  36           HG       SER  36   1.034  -8.574  -8.911
  294    H    GLU  37           H        GLU  37   5.142 -10.119  -7.572
  295    HA   GLU  37           HA       GLU  37   5.557 -12.926  -8.529
  296   1HB   GLU  37          2HB       GLU  37   7.543 -10.743  -7.912
  297   2HB   GLU  37          1HB       GLU  37   8.003 -12.443  -7.954
  298   1HG   GLU  37          2HG       GLU  37   6.914 -12.500 -10.289
  299   2HG   GLU  37          1HG       GLU  37   6.940 -10.739 -10.212
  300    H    THR  38           H        THR  38   4.255 -11.440  -6.133
  301    HA   THR  38           HA       THR  38   5.858 -12.470  -3.883
  302    HB   THR  38           HB       THR  38   4.503 -10.238  -3.977
  303    HG1  THR  38           HG1      THR  38   4.593 -10.294  -1.855
  304   1HG2  THR  38          1HG2      THR  38   2.392 -11.345  -4.727
  305   2HG2  THR  38          3HG2      THR  38   2.308 -12.158  -3.164
  306   3HG2  THR  38          2HG2      THR  38   2.191 -10.401  -3.251
  307    H    THR  39           H        THR  39   2.766 -13.019  -5.480
  308    HA   THR  39           HA       THR  39   2.432 -15.486  -3.811
  309    HB   THR  39           HB       THR  39   0.601 -13.697  -3.919
  310    HG1  THR  39           HG1      THR  39  -0.722 -15.276  -3.484
  311   1HG2  THR  39          3HG2      THR  39   0.971 -14.149  -6.693
  312   2HG2  THR  39          2HG2      THR  39  -0.631 -14.763  -6.281
  313   3HG2  THR  39          1HG2      THR  39  -0.205 -13.091  -5.917
  314    H    LYS  40           H        LYS  40   0.912 -17.089  -5.325
  315    HA   LYS  40           HA       LYS  40   2.593 -18.436  -7.051
  316   1HB   LYS  40          2HB       LYS  40  -0.334 -18.164  -7.706
  317   2HB   LYS  40          1HB       LYS  40   0.696 -19.585  -7.871
  318   1HG   LYS  40          2HG       LYS  40   0.949 -19.447  -5.300
  319   2HG   LYS  40          1HG       LYS  40  -0.442 -18.365  -5.360
  320   1HD   LYS  40          2HD       LYS  40  -0.379 -21.169  -6.517
  321   2HD   LYS  40          1HD       LYS  40  -1.113 -20.732  -4.974
  322   1HE   LYS  40          2HE       LYS  40  -2.154 -18.898  -6.836
  323   2HE   LYS  40          1HE       LYS  40  -2.193 -20.461  -7.653
  324   1HZ   LYS  40          1HZ       LYS  40  -3.100 -21.206  -5.313
  325   2HZ   LYS  40          3HZ       LYS  40  -3.593 -19.584  -5.241
  326   3HZ   LYS  40          2HZ       LYS  40  -4.132 -20.580  -6.508
  327    H    GLY  41           H        GLY  41   0.561 -15.655  -7.738
  328   1HA   GLY  41          2HA       GLY  41   2.082 -14.428  -9.650
  329   2HA   GLY  41          1HA       GLY  41   1.198 -15.638 -10.583
  330    H    ALA  42           H        ALA  42   0.650 -13.087  -8.176
  331    HA   ALA  42           HA       ALA  42  -2.146 -12.711  -9.005
  332   1HB   ALA  42          1HB       ALA  42  -0.282 -11.389  -7.025
  333   2HB   ALA  42          3HB       ALA  42  -1.881 -10.728  -7.368
  334   3HB   ALA  42          2HB       ALA  42  -1.728 -12.343  -6.685
  335    H    TYR  43           H        TYR  43  -2.219  -9.870  -8.901
  336    HA   TYR  43           HA       TYR  43  -0.437  -9.152 -11.167
  337   1HB   TYR  43          2HB       TYR  43  -3.289  -9.292 -11.247
  338   2HB   TYR  43          1HB       TYR  43  -2.795  -7.597 -11.387
  339    HD1  TYR  43           HD1      TYR  43  -0.239  -7.646 -12.661
  340    HD2  TYR  43           HD2      TYR  43  -3.644 -10.168 -13.415
  341    HE1  TYR  43           HE1      TYR  43   0.608  -8.124 -14.951
  342    HE2  TYR  43           HE2      TYR  43  -2.789 -10.648 -15.693
  343    HH   TYR  43           HH       TYR  43  -0.599 -10.646 -16.864
  344    H    SER  44           H        SER  44  -0.960  -6.499 -11.418
  345    HA   SER  44           HA       SER  44  -1.058  -5.230  -8.796
  346   1HB   SER  44          2HB       SER  44   1.536  -5.311 -10.309
  347   2HB   SER  44          1HB       SER  44   1.223  -4.469  -8.783
  348    HG   SER  44           HG       SER  44   1.726  -6.262  -7.860
  349    H    LEU  45           H        LEU  45  -0.631  -2.896  -8.928
  350    HA   LEU  45           HA       LEU  45  -0.999  -1.778 -11.675
  351   1HB   LEU  45          2HB       LEU  45  -3.212  -1.810 -10.633
  352   2HB   LEU  45          1HB       LEU  45  -2.570  -1.034  -9.189
  353    HG   LEU  45           HG       LEU  45  -2.200   0.292 -11.852
  354   1HD1  LEU  45          1HD1      LEU  45  -4.691  -0.458 -11.249
  355   2HD1  LEU  45          3HD1      LEU  45  -4.602   0.963 -10.206
  356   3HD1  LEU  45          2HD1      LEU  45  -4.357   1.127 -11.946
  357   1HD2  LEU  45          2HD2      LEU  45  -2.061   0.976  -8.979
  358   2HD2  LEU  45          1HD2      LEU  45  -1.152   1.635 -10.339
  359   3HD2  LEU  45          3HD2      LEU  45  -2.787   2.210 -10.010
  360    H    SER  46           H        SER  46   1.110  -0.965 -11.748
  361    HA   SER  46           HA       SER  46   2.267   0.443  -9.474
  362   1HB   SER  46          2HB       SER  46   3.514   0.969 -12.066
  363   2HB   SER  46          1HB       SER  46   4.198   0.217 -10.625
  364    HG   SER  46           HG       SER  46   4.069  -1.533 -11.769
  365    H    ILE  47           H        ILE  47   2.735   2.681  -9.387
  366    HA   ILE  47           HA       ILE  47   1.337   4.415 -11.351
  367    HB   ILE  47           HB       ILE  47  -0.310   4.586  -9.747
  368   1HG1  ILE  47          2HG1      ILE  47   1.831   6.462  -8.688
  369   2HG1  ILE  47          1HG1      ILE  47   0.591   6.844  -9.881
  370   1HG2  ILE  47          2HG2      ILE  47   0.874   2.904  -8.280
  371   2HG2  ILE  47          1HG2      ILE  47   1.721   4.257  -7.529
  372   3HG2  ILE  47          3HG2      ILE  47  -0.036   4.136  -7.404
  373   1HD1  ILE  47          3HD1      ILE  47  -0.984   5.949  -7.887
  374   2HD1  ILE  47          2HD1      ILE  47   0.365   6.556  -6.929
  375   3HD1  ILE  47          1HD1      ILE  47  -0.498   7.639  -8.021
  376    H    ARG  48           H        ARG  48   2.214   6.597 -11.401
  377    HA   ARG  48           HA       ARG  48   4.935   6.788 -10.166
  378   1HB   ARG  48          2HB       ARG  48   4.565   6.564 -12.804
  379   2HB   ARG  48          1HB       ARG  48   4.281   8.300 -12.662
  380   1HG   ARG  48          2HG       ARG  48   6.679   7.057 -11.336
  381   2HG   ARG  48          1HG       ARG  48   6.724   7.439 -13.057
  382   1HD   ARG  48          2HD       ARG  48   5.794   9.495 -11.062
  383   2HD   ARG  48          1HD       ARG  48   7.516   9.253 -11.358
  384    HE   ARG  48           HE       ARG  48   6.163   9.547 -13.864
  385   1HH1  ARG  48          2HH1      ARG  48   5.563  11.591 -11.367
  386   2HH1  ARG  48          1HH1      ARG  48   6.373  12.973 -12.025
  387   1HH2  ARG  48          1HH2      ARG  48   7.887  11.199 -14.591
  388   2HH2  ARG  48          2HH2      ARG  48   7.688  12.752 -13.850
  389    H    ASP  49           H        ASP  49   5.132   8.498  -8.791
  390    HA   ASP  49           HA       ASP  49   3.528  10.938  -9.320
  391   1HB   ASP  49          2HB       ASP  49   2.094   9.777  -7.792
  392   2HB   ASP  49          1HB       ASP  49   3.451   9.313  -6.767
  393    H    TRP  50           H        TRP  50   5.036  12.515  -9.380
  394    HA   TRP  50           HA       TRP  50   7.525  12.262  -7.801
  395   1HB   TRP  50          2HB       TRP  50   7.923  13.011 -10.021
  396   2HB   TRP  50          1HB       TRP  50   6.564  14.132  -9.971
  397    HD1  TRP  50           HD1      TRP  50  10.216  13.967  -9.398
  398    HE1  TRP  50           HE1      TRP  50  11.057  16.170  -8.347
  399    HE3  TRP  50           HE3      TRP  50   5.773  16.065  -8.195
  400    HZ2  TRP  50           HZ2      TRP  50   9.955  18.546  -7.191
  401    HZ3  TRP  50           HZ3      TRP  50   5.666  18.306  -7.128
  402    HH2  TRP  50           HH2      TRP  50   7.756  19.548  -6.626
  403    H    ASP  51           H        ASP  51   8.202  14.026  -6.366
  404    HA   ASP  51           HA       ASP  51   5.951  15.706  -5.362
  405   1HB   ASP  51          2HB       ASP  51   6.847  13.438  -4.056
  406   2HB   ASP  51          1HB       ASP  51   7.745  14.727  -3.258
  407    H    ASP  52           H        ASP  52   6.681  17.595  -4.137
  408    HA   ASP  52           HA       ASP  52   9.196  18.679  -5.211
  409   1HB   ASP  52          2HB       ASP  52   8.425  20.792  -4.435
  410   2HB   ASP  52          1HB       ASP  52   6.980  19.960  -5.008
  411    H    MET  53           H        MET  53   9.786  16.577  -3.458
  412    HA   MET  53           HA       MET  53  11.411  17.989  -1.535
  413   1HB   MET  53          2HB       MET  53  10.482  17.159   0.493
  414   2HB   MET  53          1HB       MET  53   9.119  17.792  -0.428
  415   1HG   MET  53          2HG       MET  53   9.512  15.076  -1.216
  416   2HG   MET  53          1HG       MET  53   9.513  15.130   0.547
  417   1HE   MET  53          1HE       MET  53   7.948  16.448  -2.614
  418   2HE   MET  53          3HE       MET  53   6.303  16.935  -2.184
  419   3HE   MET  53          2HE       MET  53   7.681  17.876  -1.618
  420    H    LYS  54           H        LYS  54  11.460  15.825  -3.743
  421    HA   LYS  54           HA       LYS  54  13.639  14.361  -2.660
  422   1HB   LYS  54          2HB       LYS  54  12.524  12.091  -2.617
  423   2HB   LYS  54          1HB       LYS  54  12.044  13.177  -1.313
  424   1HG   LYS  54          2HG       LYS  54   9.988  13.738  -2.433
  425   2HG   LYS  54          1HG       LYS  54  10.502  12.919  -3.908
  426   1HD   LYS  54          2HD       LYS  54   9.245  11.211  -3.035
  427   2HD   LYS  54          1HD       LYS  54  10.739  10.873  -2.160
  428   1HE   LYS  54          2HE       LYS  54   9.958  11.935  -0.192
  429   2HE   LYS  54          1HE       LYS  54   8.664  12.768  -1.055
  430   1HZ   LYS  54          1HZ       LYS  54   7.611  10.632  -1.463
  431   2HZ   LYS  54          3HZ       LYS  54   8.852   9.835  -0.624
  432   3HZ   LYS  54          2HZ       LYS  54   7.813  10.896   0.204
  433    H    GLY  55           H        GLY  55  11.138  14.607  -5.125
  434   1HA   GLY  55          2HA       GLY  55  12.110  14.693  -7.450
  435   2HA   GLY  55          1HA       GLY  55  12.994  13.250  -6.980
  436    H    ASP  56           H        ASP  56  11.804  12.384  -8.948
  437    HA   ASP  56           HA       ASP  56   8.958  12.034  -8.850
  438   1HB   ASP  56          2HB       ASP  56  11.188  10.676 -10.369
  439   2HB   ASP  56          1HB       ASP  56   9.519  10.135 -10.517
  440    H    HIS  57           H        HIS  57   8.076   9.628  -8.828
  441    HA   HIS  57           HA       HIS  57   9.495   7.774  -7.096
  442   1HB   HIS  57          2HB       HIS  57   7.538   9.663  -5.972
  443   2HB   HIS  57          1HB       HIS  57   7.196   7.977  -5.598
  444    HD1  HIS  57           HD1      HIS  57   8.714   6.807  -3.936
  445    HD2  HIS  57           HD2      HIS  57  10.167  10.550  -5.056
  446    HE1  HIS  57           HE1      HIS  57  10.675   7.299  -2.412
  447    H    VAL  58           H        VAL  58   7.535   6.113  -6.345
  448    HA   VAL  58           HA       VAL  58   5.509   5.803  -8.416
  449    HB   VAL  58           HB       VAL  58   8.106   4.365  -8.511
  450   1HG1  VAL  58          3HG1      VAL  58   5.447   3.003  -9.057
  451   2HG1  VAL  58          2HG1      VAL  58   6.992   2.404  -9.658
  452   3HG1  VAL  58          1HG1      VAL  58   6.691   2.479  -7.922
  453   1HG2  VAL  58          2HG2      VAL  58   5.990   5.277 -10.449
  454   2HG2  VAL  58          1HG2      VAL  58   7.648   5.854 -10.282
  455   3HG2  VAL  58          3HG2      VAL  58   7.334   4.254 -10.955
  456    H    LYS  59           H        LYS  59   3.806   4.800  -7.484
  457    HA   LYS  59           HA       LYS  59   4.286   3.248  -4.975
  458   1HB   LYS  59          2HB       LYS  59   2.601   5.372  -5.350
  459   2HB   LYS  59          1HB       LYS  59   1.519   4.020  -5.688
  460   1HG   LYS  59          2HG       LYS  59   1.394   4.469  -3.320
  461   2HG   LYS  59          1HG       LYS  59   2.302   2.972  -3.525
  462   1HD   LYS  59          2HD       LYS  59   3.472   4.376  -1.919
  463   2HD   LYS  59          1HD       LYS  59   4.421   4.305  -3.403
  464   1HE   LYS  59          2HE       LYS  59   2.593   6.460  -3.696
  465   2HE   LYS  59          1HE       LYS  59   3.317   6.615  -2.095
  466   1HZ   LYS  59          2HZ       LYS  59   5.343   5.895  -3.857
  467   2HZ   LYS  59          1HZ       LYS  59   4.474   7.149  -4.602
  468   3HZ   LYS  59          3HZ       LYS  59   5.137   7.381  -3.059
  469    H    HIS  60           H        HIS  60   2.020   1.704  -4.879
  470    HA   HIS  60           HA       HIS  60   1.531   0.475  -7.488
  471   1HB   HIS  60          2HB       HIS  60   2.828  -1.298  -5.429
  472   2HB   HIS  60          1HB       HIS  60   2.569  -1.615  -7.140
  473    HD1  HIS  60           HD1      HIS  60   4.252  -0.647  -8.816
  474    HD2  HIS  60           HD2      HIS  60   5.054   0.448  -4.874
  475    HE1  HIS  60           HE1      HIS  60   6.555   0.406  -8.821
  476    H    TYR  61           H        TYR  61  -0.138  -1.072  -7.424
  477    HA   TYR  61           HA       TYR  61  -1.535  -1.365  -4.799
  478   1HB   TYR  61          2HB       TYR  61  -2.666  -0.502  -7.461
  479   2HB   TYR  61          1HB       TYR  61  -3.694  -1.316  -6.282
  480    HD1  TYR  61           HD1      TYR  61  -3.607  -0.349  -3.834
  481    HD2  TYR  61           HD2      TYR  61  -2.356   1.803  -7.336
  482    HE1  TYR  61           HE1      TYR  61  -3.852   1.791  -2.607
  483    HE2  TYR  61           HE2      TYR  61  -2.599   3.943  -6.106
  484    HH   TYR  61           HH       TYR  61  -2.572   4.345  -3.093
  485    H    LYS  62           H        LYS  62  -0.813  -3.474  -4.545
  486    HA   LYS  62           HA       LYS  62  -0.536  -5.471  -6.472
  487   1HB   LYS  62          2HB       LYS  62   0.232  -5.840  -4.221
  488   2HB   LYS  62          1HB       LYS  62  -1.397  -5.676  -3.574
  489   1HG   LYS  62          2HG       LYS  62  -1.212  -7.719  -5.662
  490   2HG   LYS  62          1HG       LYS  62  -0.163  -8.057  -4.283
  491   1HD   LYS  62          2HD       LYS  62  -3.115  -7.378  -4.091
  492   2HD   LYS  62          1HD       LYS  62  -2.447  -9.005  -3.981
  493   1HE   LYS  62          2HE       LYS  62  -1.559  -8.648  -1.888
  494   2HE   LYS  62          1HE       LYS  62  -1.270  -6.934  -2.190
  495   1HZ   LYS  62          1HZ       LYS  62  -3.957  -8.136  -1.813
  496   2HZ   LYS  62          3HZ       LYS  62  -3.077  -7.365  -0.585
  497   3HZ   LYS  62          2HZ       LYS  62  -3.589  -6.482  -1.943
  498    H    ILE  63           H        ILE  63  -2.009  -6.177  -7.912
  499    HA   ILE  63           HA       ILE  63  -4.885  -5.953  -7.350
  500    HB   ILE  63           HB       ILE  63  -3.312  -6.944  -9.732
  501   1HG1  ILE  63          2HG1      ILE  63  -4.838  -4.435  -9.028
  502   2HG1  ILE  63          1HG1      ILE  63  -3.178  -4.582  -9.604
  503   1HG2  ILE  63          2HG2      ILE  63  -6.310  -6.706  -9.321
  504   2HG2  ILE  63          1HG2      ILE  63  -5.535  -6.990 -10.879
  505   3HG2  ILE  63          3HG2      ILE  63  -5.406  -8.195  -9.596
  506   1HD1  ILE  63          3HD1      ILE  63  -4.227  -5.607 -11.734
  507   2HD1  ILE  63          2HD1      ILE  63  -5.741  -4.916 -11.149
  508   3HD1  ILE  63          1HD1      ILE  63  -4.372  -3.862 -11.508
  509    H    ARG  64           H        ARG  64  -6.174  -7.655  -6.727
  510    HA   ARG  64           HA       ARG  64  -5.045 -10.404  -6.930
  511   1HB   ARG  64          2HB       ARG  64  -5.373  -8.931  -4.514
  512   2HB   ARG  64          1HB       ARG  64  -6.612 -10.186  -4.536
  513   1HG   ARG  64          2HG       ARG  64  -4.381 -10.886  -3.534
  514   2HG   ARG  64          1HG       ARG  64  -4.973 -11.915  -4.839
  515   1HD   ARG  64          2HD       ARG  64  -3.358 -11.198  -6.320
  516   2HD   ARG  64          1HD       ARG  64  -3.253  -9.595  -5.593
  517    HE   ARG  64           HE       ARG  64  -1.347 -10.515  -4.545
  518   1HH1  ARG  64          2HH1      ARG  64  -3.054 -13.210  -5.484
  519   2HH1  ARG  64          1HH1      ARG  64  -2.681 -14.168  -4.090
  520   1HH2  ARG  64          1HH2      ARG  64  -1.256 -11.539  -2.335
  521   2HH2  ARG  64          2HH2      ARG  64  -1.664 -13.222  -2.307
  522    H    LYS  65           H        LYS  65  -6.613 -11.995  -7.324
  523    HA   LYS  65           HA       LYS  65  -9.336 -10.925  -7.856
  524   1HB   LYS  65          2HB       LYS  65  -8.638 -11.818  -9.905
  525   2HB   LYS  65          1HB       LYS  65  -7.698 -13.096  -9.141
  526   1HG   LYS  65          2HG       LYS  65  -9.919 -14.124  -8.382
  527   2HG   LYS  65          1HG       LYS  65 -10.723 -12.963  -9.429
  528   1HD   LYS  65          2HD       LYS  65  -8.928 -13.904 -11.187
  529   2HD   LYS  65          1HD       LYS  65  -9.053 -15.323 -10.146
  530   1HE   LYS  65          2HE       LYS  65 -11.194 -13.987 -11.788
  531   2HE   LYS  65          1HE       LYS  65 -10.765 -15.697 -11.706
  532   1HZ   LYS  65          3HZ       LYS  65 -11.515 -15.561  -9.305
  533   2HZ   LYS  65          2HZ       LYS  65 -12.229 -14.074  -9.713
  534   3HZ   LYS  65          1HZ       LYS  65 -12.730 -15.502 -10.486
  535    H    LEU  66           H        LEU  66 -10.906 -11.602  -6.511
  536    HA   LEU  66           HA       LEU  66 -10.317 -13.738  -4.577
  537   1HB   LEU  66          2HB       LEU  66 -12.997 -12.428  -4.765
  538   2HB   LEU  66          1HB       LEU  66 -12.065 -12.865  -3.332
  539    HG   LEU  66           HG       LEU  66 -10.422 -11.038  -4.458
  540   1HD1  LEU  66          3HD1      LEU  66 -13.044 -10.655  -5.658
  541   2HD1  LEU  66          2HD1      LEU  66 -12.498  -9.216  -4.801
  542   3HD1  LEU  66          1HD1      LEU  66 -11.503  -9.909  -6.080
  543   1HD2  LEU  66          2HD2      LEU  66 -11.375 -11.186  -2.113
  544   2HD2  LEU  66          1HD2      LEU  66 -11.128  -9.550  -2.726
  545   3HD2  LEU  66          3HD2      LEU  66 -12.746 -10.248  -2.705
  546    H    ASP  67           H        ASP  67 -11.181 -15.780  -4.746
  547    HA   ASP  67           HA       ASP  67 -12.501 -16.546  -7.217
  548   1HB   ASP  67          2HB       ASP  67 -11.421 -17.835  -4.846
  549   2HB   ASP  67          1HB       ASP  67 -12.963 -18.544  -5.313
  550    H    ASN  68           H        ASN  68 -13.433 -15.149  -4.291
  551    HA   ASN  68           HA       ASN  68 -16.177 -16.170  -4.254
  552   1HB   ASN  68          2HB       ASN  68 -14.945 -13.843  -2.755
  553   2HB   ASN  68          1HB       ASN  68 -16.449 -14.677  -2.356
  554   1HD2  ASN  68          2HD2      ASN  68 -13.103 -16.066  -0.747
  555   2HD2  ASN  68          1HD2      ASN  68 -13.323 -14.489  -1.331
  556    H    GLY  69           H        GLY  69 -14.438 -13.805  -5.992
  557   1HA   GLY  69          2HA       GLY  69 -16.995 -12.693  -6.904
  558   2HA   GLY  69          1HA       GLY  69 -15.914 -11.540  -6.139
  559    H    GLY  70           H        GLY  70 -13.998 -10.954  -7.223
  560   1HA   GLY  70          2HA       GLY  70 -13.343 -12.176  -9.793
  561   2HA   GLY  70          1HA       GLY  70 -14.052 -10.580  -9.932
  562    H    TYR  71           H        TYR  71 -12.723  -8.846  -9.718
  563    HA   TYR  71           HA       TYR  71  -9.966  -9.405  -8.682
  564   1HB   TYR  71          2HB       TYR  71 -10.926  -7.660 -10.944
  565   2HB   TYR  71          1HB       TYR  71  -9.340  -7.430 -10.204
  566    HD1  TYR  71           HD1      TYR  71 -11.513 -10.141 -11.607
  567    HD2  TYR  71           HD2      TYR  71  -7.533  -8.657 -10.994
  568    HE1  TYR  71           HE1      TYR  71 -10.613 -12.004 -12.975
  569    HE2  TYR  71           HE2      TYR  71  -6.625 -10.524 -12.359
  570    HH   TYR  71           HH       TYR  71  -8.793 -12.851 -13.956
  571    H    TYR  72           H        TYR  72  -8.874  -7.371  -7.832
  572    HA   TYR  72           HA       TYR  72 -10.395  -5.059  -7.113
  573   1HB   TYR  72          2HB       TYR  72 -11.079  -5.480  -4.882
  574   2HB   TYR  72          1HB       TYR  72 -11.628  -6.882  -5.796
  575    HD1  TYR  72           HD1      TYR  72  -9.947  -8.891  -5.928
  576    HD2  TYR  72           HD2      TYR  72  -9.782  -5.789  -2.981
  577    HE1  TYR  72           HE1      TYR  72  -8.561 -10.348  -4.474
  578    HE2  TYR  72           HE2      TYR  72  -8.387  -7.221  -1.529
  579    HH   TYR  72           HH       TYR  72  -6.739  -9.295  -2.025
  580    H    ILE  73           H        ILE  73  -8.940  -3.532  -6.388
  581    HA   ILE  73           HA       ILE  73  -6.237  -4.476  -5.599
  582    HB   ILE  73           HB       ILE  73  -7.374  -1.884  -6.596
  583   1HG1  ILE  73          2HG1      ILE  73  -4.683  -3.204  -7.008
  584   2HG1  ILE  73          1HG1      ILE  73  -6.102  -3.541  -7.999
  585   1HG2  ILE  73          2HG2      ILE  73  -6.355  -1.303  -4.388
  586   2HG2  ILE  73          1HG2      ILE  73  -4.834  -1.996  -4.952
  587   3HG2  ILE  73          3HG2      ILE  73  -5.509  -0.577  -5.756
  588   1HD1  ILE  73          2HD1      ILE  73  -4.910  -0.781  -7.604
  589   2HD1  ILE  73          1HD1      ILE  73  -4.601  -1.808  -9.003
  590   3HD1  ILE  73          3HD1      ILE  73  -6.230  -1.210  -8.691
  591    H    THR  74           H        THR  74  -9.160  -3.080  -4.410
  592    HA   THR  74           HA       THR  74  -8.078  -3.209  -1.642
  593    HB   THR  74           HB       THR  74  -8.367  -0.972  -1.486
  594    HG1  THR  74           HG1      THR  74 -10.636  -0.343  -1.339
  595   1HG2  THR  74          3HG2      THR  74 -10.071  -1.132  -3.988
  596   2HG2  THR  74          2HG2      THR  74  -9.575   0.369  -3.204
  597   3HG2  THR  74          1HG2      THR  74  -8.363  -0.698  -3.915
  598    H    THR  75           H        THR  75  -9.527  -4.135  -0.179
  599    HA   THR  75           HA       THR  75 -11.477  -5.913  -1.296
  600    HB   THR  75           HB       THR  75 -12.101  -6.240   1.175
  601    HG1  THR  75           HG1      THR  75 -11.221  -4.092   1.688
  602   1HG2  THR  75          1HG2      THR  75  -9.863  -6.998  -0.412
  603   2HG2  THR  75          3HG2      THR  75  -9.291  -6.762   1.241
  604   3HG2  THR  75          2HG2      THR  75 -10.605  -7.893   0.917
  605    H    ARG  76           H        ARG  76 -11.812  -2.654  -0.964
  606    HA   ARG  76           HA       ARG  76 -14.644  -2.771  -0.122
  607   1HB   ARG  76          2HB       ARG  76 -13.122  -0.984   0.775
  608   2HB   ARG  76          1HB       ARG  76 -12.978  -0.350  -0.864
  609   1HG   ARG  76          2HG       ARG  76 -15.743  -0.826   0.113
  610   2HG   ARG  76          1HG       ARG  76 -14.867   0.498   0.882
  611   1HD   ARG  76          2HD       ARG  76 -14.606   0.382  -2.060
  612   2HD   ARG  76          1HD       ARG  76 -16.233   0.731  -1.476
  613    HE   ARG  76           HE       ARG  76 -14.216   2.347  -0.144
  614   1HH1  ARG  76          2HH1      ARG  76 -15.223   1.988  -3.353
  615   2HH1  ARG  76          1HH1      ARG  76 -15.656   3.650  -3.575
  616   1HH2  ARG  76          1HH2      ARG  76 -15.182   4.496  -0.246
  617   2HH2  ARG  76          2HH2      ARG  76 -15.632   5.071  -1.817
  618    H    ALA  77           H        ALA  77 -12.939  -3.176  -2.968
  619    HA   ALA  77           HA       ALA  77 -15.364  -2.705  -4.541
  620   1HB   ALA  77          3HB       ALA  77 -12.972  -0.894  -4.770
  621   2HB   ALA  77          2HB       ALA  77 -14.041  -1.163  -6.148
  622   3HB   ALA  77          1HB       ALA  77 -14.678  -0.461  -4.661
  623    H    GLN  78           H        GLN  78 -15.257  -4.768  -5.415
  624    HA   GLN  78           HA       GLN  78 -12.772  -5.547  -6.830
  625   1HB   GLN  78          2HB       GLN  78 -14.928  -7.542  -6.644
  626   2HB   GLN  78          1HB       GLN  78 -13.219  -7.711  -6.292
  627   1HG   GLN  78          2HG       GLN  78 -15.194  -6.337  -4.457
  628   2HG   GLN  78          1HG       GLN  78 -14.701  -8.014  -4.281
  629   1HE2  GLN  78          2HE2      GLN  78 -11.698  -7.181  -2.651
  630   2HE2  GLN  78          1HE2      GLN  78 -12.762  -8.400  -3.156
  631    H    PHE  79           H        PHE  79 -13.645  -7.186  -8.776
  632    HA   PHE  79           HA       PHE  79 -15.943  -6.028 -10.194
  633   1HB   PHE  79          2HB       PHE  79 -13.087  -5.788 -11.177
  634   2HB   PHE  79          1HB       PHE  79 -14.483  -5.647 -12.247
  635    HD1  PHE  79           HD1      PHE  79 -12.871  -4.226  -9.225
  636    HD2  PHE  79           HD2      PHE  79 -15.801  -3.670 -12.307
  637    HE1  PHE  79           HE1      PHE  79 -13.196  -1.896  -8.486
  638    HE2  PHE  79           HE2      PHE  79 -16.125  -1.324 -11.576
  639    HZ   PHE  79           HZ       PHE  79 -14.823  -0.429  -9.662
  640    H    GLU  80           H        GLU  80 -15.345  -7.209 -12.680
  641    HA   GLU  80           HA       GLU  80 -15.400 -10.057 -11.846
  642   1HB   GLU  80          2HB       GLU  80 -16.490 -10.399 -14.085
  643   2HB   GLU  80          1HB       GLU  80 -17.388  -9.328 -13.011
  644   1HG   GLU  80          2HG       GLU  80 -15.508  -7.754 -14.480
  645   2HG   GLU  80          1HG       GLU  80 -16.407  -8.756 -15.620
  646    H    THR  81           H        THR  81 -13.657  -7.782 -13.894
  647    HA   THR  81           HA       THR  81 -11.617  -9.884 -14.316
  648    HB   THR  81           HB       THR  81 -12.497 -10.331 -16.384
  649    HG1  THR  81           HG1      THR  81 -11.770  -7.928 -17.463
  650   1HG2  THR  81          3HG2      THR  81 -14.459  -8.783 -15.792
  651   2HG2  THR  81          2HG2      THR  81 -13.569  -7.546 -16.677
  652   3HG2  THR  81          1HG2      THR  81 -14.099  -9.011 -17.500
  653    H    LEU  82           H        LEU  82  -9.785  -8.768 -15.769
  654    HA   LEU  82           HA       LEU  82  -8.918  -6.453 -14.232
  655   1HB   LEU  82          2HB       LEU  82  -7.728  -8.232 -16.312
  656   2HB   LEU  82          1HB       LEU  82  -7.037  -6.619 -16.129
  657    HG   LEU  82           HG       LEU  82  -7.500  -8.467 -13.778
  658   1HD1  LEU  82          2HD1      LEU  82  -5.916  -9.401 -15.562
  659   2HD1  LEU  82          1HD1      LEU  82  -4.863  -8.034 -15.194
  660   3HD1  LEU  82          3HD1      LEU  82  -5.245  -9.218 -13.941
  661   1HD2  LEU  82          1HD2      LEU  82  -6.358  -5.779 -14.232
  662   2HD2  LEU  82          3HD2      LEU  82  -7.067  -6.469 -12.772
  663   3HD2  LEU  82          2HD2      LEU  82  -5.393  -6.830 -13.195
  664    H    GLN  83           H        GLN  83 -10.140  -7.101 -17.469
  665    HA   GLN  83           HA       GLN  83  -9.673  -4.410 -18.423
  666   1HB   GLN  83          2HB       GLN  83 -11.658  -6.431 -19.493
  667   2HB   GLN  83          1HB       GLN  83 -10.954  -5.068 -20.363
  668   1HG   GLN  83          2HG       GLN  83  -8.730  -6.078 -20.203
  669   2HG   GLN  83          1HG       GLN  83  -9.380  -7.408 -19.244
  670   1HE2  GLN  83          2HE2      GLN  83 -10.265  -9.240 -22.109
  671   2HE2  GLN  83          1HE2      GLN  83  -9.873  -9.238 -20.458
  672    H    GLN  84           H        GLN  84 -12.326  -6.116 -16.861
  673    HA   GLN  84           HA       GLN  84 -14.306  -4.072 -17.269
  674   1HB   GLN  84          2HB       GLN  84 -14.029  -6.409 -15.418
  675   2HB   GLN  84          1HB       GLN  84 -15.286  -5.219 -15.120
  676   1HG   GLN  84          2HG       GLN  84 -15.845  -7.276 -16.636
  677   2HG   GLN  84          1HG       GLN  84 -16.400  -5.684 -17.116
  678   1HE2  GLN  84          2HE2      GLN  84 -14.380  -7.662 -19.809
  679   2HE2  GLN  84          1HE2      GLN  84 -15.382  -8.303 -18.598
  680    H    LEU  85           H        LEU  85 -11.858  -4.618 -14.778
  681    HA   LEU  85           HA       LEU  85 -12.882  -2.361 -13.186
  682   1HB   LEU  85          2HB       LEU  85 -11.384  -2.967 -11.544
  683   2HB   LEU  85          1HB       LEU  85 -11.564  -4.513 -12.366
  684    HG   LEU  85           HG       LEU  85  -9.541  -3.239 -13.790
  685   1HD1  LEU  85          2HD1      LEU  85  -9.651  -1.692 -11.631
  686   2HD1  LEU  85          1HD1      LEU  85  -8.737  -3.022 -10.918
  687   3HD1  LEU  85          3HD1      LEU  85  -8.100  -2.167 -12.324
  688   1HD2  LEU  85          1HD2      LEU  85  -9.910  -5.637 -12.873
  689   2HD2  LEU  85          3HD2      LEU  85  -8.261  -5.050 -13.080
  690   3HD2  LEU  85          2HD2      LEU  85  -8.996  -5.064 -11.476
  691    H    VAL  86           H        VAL  86 -10.263  -2.859 -15.545
  692    HA   VAL  86           HA       VAL  86  -9.116  -0.287 -15.039
  693    HB   VAL  86           HB       VAL  86  -8.038  -0.479 -17.177
  694   1HG1  VAL  86          2HG1      VAL  86  -8.307  -2.800 -15.427
  695   2HG1  VAL  86          1HG1      VAL  86  -7.853  -3.254 -17.070
  696   3HG1  VAL  86          3HG1      VAL  86  -6.860  -2.116 -16.160
  697   1HG2  VAL  86          1HG2      VAL  86 -10.229  -1.006 -18.369
  698   2HG2  VAL  86          3HG2      VAL  86  -8.816  -1.888 -18.950
  699   3HG2  VAL  86          2HG2      VAL  86  -9.976  -2.681 -17.889
  700    H    GLN  87           H        GLN  87 -12.004  -1.425 -16.440
  701    HA   GLN  87           HA       GLN  87 -12.682   0.908 -17.996
  702   1HB   GLN  87          2HB       GLN  87 -13.610  -1.397 -18.349
  703   2HB   GLN  87          1HB       GLN  87 -14.507  -1.207 -16.851
  704   1HG   GLN  87          2HG       GLN  87 -15.789   0.591 -17.714
  705   2HG   GLN  87          1HG       GLN  87 -14.716   0.798 -19.099
  706   1HE2  GLN  87          1HE2      GLN  87 -17.360  -1.147 -17.796
  707   2HE2  GLN  87          2HE2      GLN  87 -17.654  -2.030 -19.215
  708    H    HIS  88           H        HIS  88 -13.594  -0.344 -14.819
  709    HA   HIS  88           HA       HIS  88 -15.408   1.760 -14.162
  710   1HB   HIS  88          2HB       HIS  88 -15.108  -0.566 -13.060
  711   2HB   HIS  88          1HB       HIS  88 -13.823   0.202 -12.136
  712    HD1  HIS  88           HD1      HIS  88 -14.496   1.829 -10.285
  713    HD2  HIS  88           HD2      HIS  88 -17.746   0.536 -12.552
  714    HE1  HIS  88           HE1      HIS  88 -16.574   2.629  -9.079
  715    H    TYR  89           H        TYR  89 -12.011   1.177 -13.531
  716    HA   TYR  89           HA       TYR  89 -11.668   3.607 -12.019
  717   1HB   TYR  89          2HB       TYR  89  -9.693   1.691 -13.267
  718   2HB   TYR  89          1HB       TYR  89  -9.211   3.085 -12.315
  719    HD1  TYR  89           HD1      TYR  89 -11.643   0.239 -12.062
  720    HD2  TYR  89           HD2      TYR  89  -8.752   2.686 -10.058
  721    HE1  TYR  89           HE1      TYR  89 -11.920  -1.117 -10.035
  722    HE2  TYR  89           HE2      TYR  89  -9.033   1.327  -8.008
  723    HH   TYR  89           HH       TYR  89 -11.254  -0.276  -7.156
  724    H    SER  90           H        SER  90 -11.805   2.786 -15.332
  725    HA   SER  90           HA       SER  90 -10.105   4.736 -16.481
  726   1HB   SER  90          2HB       SER  90 -12.104   2.883 -17.386
  727   2HB   SER  90          1HB       SER  90 -12.376   4.448 -18.151
  728    HG   SER  90           HG       SER  90 -10.891   3.181 -19.324
  729    H    GLU  91           H        GLU  91 -13.474   4.875 -15.435
  730    HA   GLU  91           HA       GLU  91 -13.487   7.797 -16.027
  731   1HB   GLU  91          2HB       GLU  91 -15.852   6.083 -15.230
  732   2HB   GLU  91          1HB       GLU  91 -15.879   7.681 -15.977
  733   1HG   GLU  91          2HG       GLU  91 -14.355   6.189 -17.749
  734   2HG   GLU  91          1HG       GLU  91 -15.592   5.044 -17.226
  735    H    ARG  92           H        ARG  92 -12.985   5.627 -13.493
  736    HA   ARG  92           HA       ARG  92 -13.474   7.831 -11.541
  737   1HB   ARG  92          2HB       ARG  92 -14.341   4.957 -11.110
  738   2HB   ARG  92          1HB       ARG  92 -14.497   6.272  -9.947
  739   1HG   ARG  92          2HG       ARG  92 -15.647   7.137 -12.417
  740   2HG   ARG  92          1HG       ARG  92 -16.304   5.546 -12.037
  741   1HD   ARG  92          2HD       ARG  92 -16.253   6.952  -9.593
  742   2HD   ARG  92          1HD       ARG  92 -16.874   8.093 -10.787
  743    HE   ARG  92           HE       ARG  92 -18.235   5.687  -9.850
  744   1HH1  ARG  92          2HH1      ARG  92 -18.543   8.577 -11.487
  745   2HH1  ARG  92          1HH1      ARG  92 -19.779   8.042 -12.577
  746   1HH2  ARG  92          1HH2      ARG  92 -19.521   4.709 -11.655
  747   2HH2  ARG  92          2HH2      ARG  92 -20.333   5.853 -12.672
  748    H    ALA  93           H        ALA  93 -12.362   7.303  -9.400
  749    HA   ALA  93           HA       ALA  93  -9.698   6.173 -10.003
  750   1HB   ALA  93          2HB       ALA  93  -9.877   8.352  -8.810
  751   2HB   ALA  93          1HB       ALA  93 -10.709   7.533  -7.488
  752   3HB   ALA  93          3HB       ALA  93  -9.029   7.137  -7.850
  753    H    ALA  94           H        ALA  94 -11.974   5.919  -7.291
  754    HA   ALA  94           HA       ALA  94 -12.919   3.724  -6.636
  755   1HB   ALA  94          2HB       ALA  94 -11.392   2.490  -8.223
  756   2HB   ALA  94          1HB       ALA  94 -10.100   2.687  -7.040
  757   3HB   ALA  94          3HB       ALA  94 -11.533   1.745  -6.630
  758    H    GLY  95           H        GLY  95 -10.194   5.617  -5.775
  759   1HA   GLY  95          2HA       GLY  95 -10.127   6.442  -3.443
  760   2HA   GLY  95          1HA       GLY  95 -10.624   4.836  -2.923
  761    H    LEU  96           H        LEU  96  -8.418   4.514  -5.433
  762    HA   LEU  96           HA       LEU  96  -6.360   3.604  -3.570
  763   1HB   LEU  96          2HB       LEU  96  -5.145   3.023  -5.683
  764   2HB   LEU  96          1HB       LEU  96  -6.763   2.328  -5.598
  765    HG   LEU  96           HG       LEU  96  -6.589   5.030  -6.803
  766   1HD1  LEU  96          3HD1      LEU  96  -5.190   2.621  -7.893
  767   2HD1  LEU  96          2HD1      LEU  96  -5.991   3.724  -9.013
  768   3HD1  LEU  96          1HD1      LEU  96  -4.709   4.316  -7.956
  769   1HD2  LEU  96          3HD2      LEU  96  -8.232   2.609  -6.905
  770   2HD2  LEU  96          2HD2      LEU  96  -8.669   4.279  -7.265
  771   3HD2  LEU  96          1HD2      LEU  96  -7.906   3.282  -8.502
  772    H    SER  97           H        SER  97  -4.578   4.766  -6.073
  773    HA   SER  97           HA       SER  97  -3.853   7.182  -4.509
  774   1HB   SER  97          2HB       SER  97  -2.023   5.622  -4.967
  775   2HB   SER  97          1HB       SER  97  -2.367   5.699  -6.695
  776    HG   SER  97           HG       SER  97  -0.832   7.302  -5.265
  777    H    SER  98           H        SER  98  -5.033   6.138  -7.660
  778    HA   SER  98           HA       SER  98  -6.252   8.576  -8.309
  779   1HB   SER  98          2HB       SER  98  -4.399   9.903  -8.505
  780   2HB   SER  98          1HB       SER  98  -3.333   8.543  -8.855
  781    HG   SER  98           HG       SER  98  -5.272   9.591 -10.638
  782    H    ARG  99           H        ARG  99  -7.582   6.767  -9.078
  783    HA   ARG  99           HA       ARG  99  -8.280   5.166 -10.688
  784   1HB   ARG  99          2HB       ARG  99  -7.417   7.068 -12.806
  785   2HB   ARG  99          1HB       ARG  99  -8.987   6.312 -12.545
  786   1HG   ARG  99          2HG       ARG  99  -8.972   7.846 -10.369
  787   2HG   ARG  99          1HG       ARG  99  -7.857   8.807 -11.339
  788   1HD   ARG  99          2HD       ARG  99  -9.612   8.623 -13.218
  789   2HD   ARG  99          1HD       ARG  99 -10.720   8.069 -11.963
  790    HE   ARG  99           HE       ARG  99  -9.620  10.425 -10.954
  791   1HH1  ARG  99          2HH1      ARG  99  -9.510  11.266 -13.833
  792   2HH1  ARG  99          1HH1      ARG  99 -11.070  11.983 -14.059
  793   1HH2  ARG  99          1HH2      ARG  99 -12.432  10.555 -11.208
  794   2HH2  ARG  99          2HH2      ARG  99 -12.725  11.580 -12.573
  795    H    LEU 100           H        LEU 100  -7.302   5.155 -13.464
  796    HA   LEU 100           HA       LEU 100  -4.809   3.586 -13.001
  797   1HB   LEU 100          2HB       LEU 100  -5.712   3.154 -15.643
  798   2HB   LEU 100          1HB       LEU 100  -5.840   2.039 -14.286
  799    HG   LEU 100           HG       LEU 100  -7.972   3.431 -13.668
  800   1HD1  LEU 100          3HD1      LEU 100  -7.119   4.859 -15.897
  801   2HD1  LEU 100          2HD1      LEU 100  -8.441   3.871 -16.518
  802   3HD1  LEU 100          1HD1      LEU 100  -8.717   4.958 -15.157
  803   1HD2  LEU 100          3HD2      LEU 100  -7.977   1.075 -14.440
  804   2HD2  LEU 100          2HD2      LEU 100  -9.356   1.981 -15.058
  805   3HD2  LEU 100          1HD2      LEU 100  -7.981   1.642 -16.111
  806    H    VAL 101           H        VAL 101  -3.902   3.645 -15.741
  807    HA   VAL 101           HA       VAL 101  -2.250   5.896 -15.741
  808    HB   VAL 101           HB       VAL 101  -2.468   3.766 -17.387
  809   1HG1  VAL 101          2HG1      VAL 101  -4.443   4.816 -18.554
  810   2HG1  VAL 101          1HG1      VAL 101  -3.363   6.098 -19.104
  811   3HG1  VAL 101          3HG1      VAL 101  -3.093   4.435 -19.622
  812   1HG2  VAL 101          1HG2      VAL 101  -0.714   5.835 -17.024
  813   2HG2  VAL 101          3HG2      VAL 101  -0.483   4.529 -18.187
  814   3HG2  VAL 101          2HG2      VAL 101  -1.176   6.066 -18.710
  815    H    VAL 102           H        VAL 102  -2.388   7.993 -16.554
  816    HA   VAL 102           HA       VAL 102  -4.928   9.280 -16.517
  817    HB   VAL 102           HB       VAL 102  -2.554  10.354 -18.042
  818   1HG1  VAL 102          3HG1      VAL 102  -4.802  11.508 -16.387
  819   2HG1  VAL 102          2HG1      VAL 102  -3.367  12.451 -16.788
  820   3HG1  VAL 102          1HG1      VAL 102  -4.408  11.840 -18.073
  821   1HG2  VAL 102          1HG2      VAL 102  -2.540   9.396 -15.335
  822   2HG2  VAL 102          3HG2      VAL 102  -1.242  10.193 -16.224
  823   3HG2  VAL 102          2HG2      VAL 102  -2.411  11.154 -15.318
  824    HA   PRO 103           HA       PRO 103  -6.357   8.247 -20.564
  825   1HB   PRO 103          2HB       PRO 103  -8.349  10.139 -20.724
  826   2HB   PRO 103          1HB       PRO 103  -8.489   8.640 -19.792
  827   1HG   PRO 103          2HG       PRO 103  -8.026  11.434 -18.826
  828   2HG   PRO 103          1HG       PRO 103  -8.816  10.081 -18.000
  829   1HD   PRO 103          2HD       PRO 103  -6.184  10.981 -17.533
  830   2HD   PRO 103          1HD       PRO 103  -6.845   9.419 -17.014
  831    H    SER 104           H        SER 104  -5.238  11.428 -19.686
  832    HA   SER 104           HA       SER 104  -4.650  11.956 -22.567
  833   1HB   SER 104          2HB       SER 104  -4.998  14.368 -22.122
  834   2HB   SER 104          1HB       SER 104  -6.469  13.442 -21.821
  835    HG   SER 104           HG       SER 104  -4.696  14.632 -20.006
  836    H    HIS 105           H        HIS 105  -2.816  10.646 -21.013
  837    HA   HIS 105           HA       HIS 105  -1.031  12.283 -19.510
  838   1HB   HIS 105          2HB       HIS 105   0.566  10.499 -19.760
  839   2HB   HIS 105          1HB       HIS 105  -1.024   9.750 -19.636
  840    HD1  HIS 105           HD1      HIS 105   1.685  10.550 -22.135
  841    HD2  HIS 105           HD2      HIS 105  -1.901   8.430 -21.979
  842    HE1  HIS 105           HE1      HIS 105   1.549   9.215 -24.282
  843    H    LYS 106           HN       LYS 106  -1.021  11.413 -22.975
  844    HA   LYS 106           HA       LYS 106   0.272  12.305 -24.737
  845   1HB   LYS 106          2HB       LYS 106  -1.377  14.067 -24.511
  846   2HB   LYS 106          1HB       LYS 106  -0.500  14.773 -23.155
  847   1HG   LYS 106          2HG       LYS 106   1.063  15.751 -24.507
  848   2HG   LYS 106          1HG       LYS 106   1.068  14.405 -25.646
  849   1HD   LYS 106          2HD       LYS 106  -1.469  15.411 -25.976
  850   2HD   LYS 106          1HD       LYS 106  -0.537  16.876 -25.665
  851   1HE   LYS 106          2HE       LYS 106   0.547  14.846 -27.589
  852   2HE   LYS 106          1HE       LYS 106  -0.737  15.930 -28.124
  853   1HZ   LYS 106          1HZ       LYS 106   0.857  17.671 -26.948
  854   2HZ   LYS 106          3HZ       LYS 106   2.023  16.528 -27.407
  855   3HZ   LYS 106          2HZ       LYS 106   1.026  17.241 -28.583
  856   1H    GLU 201          3HT       GLU 201  10.641  -3.099   2.549
  857   2H    GLU 201          2HT       GLU 201  11.000  -4.378   3.607
  858   3H    GLU 201          1HT       GLU 201  12.075  -3.981   2.354
  859    HA   GLU 201           HA       GLU 201  11.081  -5.446   1.050
  860   1HB   GLU 201          2HB       GLU 201   9.248  -5.630   3.436
  861   2HB   GLU 201          1HB       GLU 201   8.906  -6.542   1.967
  862   1HG   GLU 201          2HG       GLU 201  10.517  -8.049   2.432
  863   2HG   GLU 201          1HG       GLU 201  11.704  -6.778   2.723
  864    HA   PRO 202           HA       PRO 202   8.112  -3.192  -1.263
  865   1HB   PRO 202          2HB       PRO 202   7.107  -5.209  -2.837
  866   2HB   PRO 202          1HB       PRO 202   8.710  -4.492  -3.070
  867   1HG   PRO 202          2HG       PRO 202   7.990  -7.144  -1.911
  868   2HG   PRO 202          1HG       PRO 202   9.481  -6.644  -2.728
  869   1HD   PRO 202          2HD       PRO 202   9.133  -6.914   0.070
  870   2HD   PRO 202          1HD       PRO 202  10.492  -6.106  -0.741
  871    H    GLN 203           H        GLN 203   6.618  -2.733   0.530
  872    HA   GLN 203           HA       GLN 203   4.424  -4.673   0.964
  873   1HB   GLN 203          2HB       GLN 203   5.186  -2.055   2.273
  874   2HB   GLN 203          1HB       GLN 203   3.670  -2.881   2.632
  875   1HG   GLN 203          2HG       GLN 203   4.805  -4.114   4.139
  876   2HG   GLN 203          1HG       GLN 203   5.624  -4.884   2.781
  877   1HE2  GLN 203          2HE2      GLN 203   7.579  -1.656   4.432
  878   2HE2  GLN 203          1HE2      GLN 203   5.896  -1.582   4.227
  879   1HN   PTR 204          1HN       PTR 204   2.336  -4.339   0.223
  880    HA   PTR 204           HA       PTR 204   1.992  -2.140  -1.737
  881   1HB   PTR 204          1HB       PTR 204  -0.245  -3.460  -2.097
  882    HD1  PTR 204           HD1      PTR 204   0.913  -2.510  -4.164
  883    HD2  PTR 204           HD2      PTR 204   2.209  -6.107  -2.194
  884    HE1  PTR 204           HE1      PTR 204   2.181  -3.172  -6.191
  885    HE2  PTR 204           HE2      PTR 204   3.473  -6.763  -4.220
  886    H    GLU 205           H        GLU 205   0.503  -0.491  -1.444
  887    HA   GLU 205           HA       GLU 205  -0.464  -0.040   1.270
  888   1HB   GLU 205          2HB       GLU 205  -1.119   1.512  -1.252
  889   2HB   GLU 205          1HB       GLU 205  -1.287   2.076   0.411
  890   1HG   GLU 205          2HG       GLU 205   1.336   1.315   0.387
  891   2HG   GLU 205          1HG       GLU 205   1.133   1.876  -1.274
  892    H    GLU 206           H        GLU 206  -2.929   0.899   1.235
  893    HA   GLU 206           HA       GLU 206  -4.734  -0.710  -0.415
  894   1HB   GLU 206          2HB       GLU 206  -5.810  -1.584   1.836
  895   2HB   GLU 206          1HB       GLU 206  -4.468  -2.459   1.100
  896   1HG   GLU 206          2HG       GLU 206  -2.888  -1.525   2.609
  897   2HG   GLU 206          1HG       GLU 206  -4.020  -0.283   3.146
  898    H    ILE 207           H        ILE 207  -6.892   0.080  -0.298
  899    HA   ILE 207           HA       ILE 207  -7.117   2.820   0.609
  900    HB   ILE 207           HB       ILE 207  -8.996   0.863  -0.693
  901   1HG1  ILE 207          2HG1      ILE 207  -9.046   3.144  -2.142
  902   2HG1  ILE 207          1HG1      ILE 207  -7.458   3.307  -1.390
  903   1HG2  ILE 207          2HG2      ILE 207  -9.682   3.411   0.740
  904   2HG2  ILE 207          1HG2      ILE 207 -10.555   2.987  -0.732
  905   3HG2  ILE 207          3HG2      ILE 207 -10.591   1.903   0.658
  906   1HD1  ILE 207          2HD1      ILE 207  -7.699   0.604  -2.236
  907   2HD1  ILE 207          1HD1      ILE 207  -8.225   1.615  -3.580
  908   3HD1  ILE 207          3HD1      ILE 207  -6.623   1.843  -2.880
  909    HA   PRO 208           HA       PRO 208  -9.957   0.911   3.945
  910   1HB   PRO 208          2HB       PRO 208  -9.867  -1.814   4.282
  911   2HB   PRO 208          1HB       PRO 208 -11.013  -1.000   3.204
  912   1HG   PRO 208          2HG       PRO 208  -8.577  -2.569   2.510
  913   2HG   PRO 208          1HG       PRO 208 -10.034  -2.274   1.548
  914   1HD   PRO 208          2HD       PRO 208  -7.543  -0.965   1.244
  915   2HD   PRO 208          1HD       PRO 208  -9.082  -0.477   0.506
  916    H    ILE 209           H        ILE 209  -8.313   1.895   5.272
  917    HA   ILE 209           HA       ILE 209  -7.094   0.234   7.220
  918    HB   ILE 209           HB       ILE 209  -5.705  -0.144   4.980
  919   1HG1  ILE 209          2HG1      ILE 209  -5.269  -1.085   7.268
  920   2HG1  ILE 209          1HG1      ILE 209  -3.803  -0.752   6.346
  921   1HG2  ILE 209          2HG2      ILE 209  -5.329   2.458   4.965
  922   2HG2  ILE 209          1HG2      ILE 209  -4.071   2.089   6.144
  923   3HG2  ILE 209          3HG2      ILE 209  -4.002   1.379   4.531
  924   1HD1  ILE 209          3HD1      ILE 209  -3.697   1.492   7.518
  925   2HD1  ILE 209          2HD1      ILE 209  -4.998   0.924   8.565
  926   3HD1  ILE 209          1HD1      ILE 209  -3.440   0.097   8.566
  927    H    TYR 210           H        TYR 210  -8.561   2.723   6.971
  928    HA   TYR 210           HA       TYR 210  -6.607   4.796   7.780
  929   1HB   TYR 210          2HB       TYR 210  -9.462   4.765   6.910
  930   2HB   TYR 210          1HB       TYR 210  -8.955   6.064   7.987
  931    HD1  TYR 210           HD1      TYR 210  -7.636   4.245   4.975
  932    HD2  TYR 210           HD2      TYR 210  -8.167   8.007   6.980
  933    HE1  TYR 210           HE1      TYR 210  -6.571   5.413   3.065
  934    HE2  TYR 210           HE2      TYR 210  -7.102   9.176   5.069
  935    HH   TYR 210           HH       TYR 210  -6.254   8.965   3.030
  936    H    LEU 211           HN       LEU 211  -7.881   6.253   9.651
  937    HA   LEU 211           HA       LEU 211  -8.068   4.352  11.936
  938   1HB   LEU 211          2HB       LEU 211  -6.403   6.043  12.293
  939   2HB   LEU 211          1HB       LEU 211  -7.501   7.322  11.777
  940    HG   LEU 211           HG       LEU 211  -8.722   5.822  13.910
  941   1HD1  LEU 211          3HD1      LEU 211  -5.852   6.627  14.260
  942   2HD1  LEU 211          2HD1      LEU 211  -6.961   6.786  15.622
  943   3HD1  LEU 211          1HD1      LEU 211  -6.695   5.208  14.881
  944   1HD2  LEU 211          3HD2      LEU 211  -7.874   8.639  13.331
  945   2HD2  LEU 211          2HD2      LEU 211  -9.491   7.999  13.626
  946   3HD2  LEU 211          1HD2      LEU 211  -8.370   8.220  14.972
   
  No H/Q in entry =         946
  Start of MODEL    8
    1   1H    SER   1          2HT       SER   1  -5.629 -10.689 -24.226
    2   2H    SER   1          1HT       SER   1  -4.062 -11.340 -24.308
    3   3H    SER   1          3HT       SER   1  -4.934 -11.413 -22.855
    4    HA   SER   1           HA       SER   1  -3.491  -9.665 -22.474
    5   1HB   SER   1          2HB       SER   1  -2.791  -9.640 -24.930
    6   2HB   SER   1          1HB       SER   1  -4.150  -8.550 -25.209
    7    HG   SER   1           HG       SER   1  -3.179  -7.304 -23.398
    8    H    ILE   2           H        ILE   2  -4.756  -8.688 -20.955
    9    HA   ILE   2           HA       ILE   2  -7.424  -7.941 -21.111
   10    HB   ILE   2           HB       ILE   2  -6.617  -5.991 -19.492
   11   1HG1  ILE   2          2HG1      ILE   2  -4.266  -7.852 -19.245
   12   2HG1  ILE   2          1HG1      ILE   2  -4.200  -6.509 -20.387
   13   1HG2  ILE   2          2HG2      ILE   2  -6.670  -8.966 -19.091
   14   2HG2  ILE   2          1HG2      ILE   2  -6.204  -7.921 -17.750
   15   3HG2  ILE   2          3HG2      ILE   2  -7.791  -7.743 -18.496
   16   1HD1  ILE   2          3HD1      ILE   2  -5.256  -5.651 -17.819
   17   2HD1  ILE   2          2HD1      ILE   2  -3.668  -6.389 -17.636
   18   3HD1  ILE   2          1HD1      ILE   2  -3.883  -5.016 -18.726
   19    H    GLN   3           H        GLN   3  -5.365  -5.119 -20.859
   20    HA   GLN   3           HA       GLN   3  -6.930  -3.852 -23.018
   21   1HB   GLN   3          2HB       GLN   3  -5.301  -2.930 -20.732
   22   2HB   GLN   3          1HB       GLN   3  -5.155  -1.943 -22.185
   23   1HG   GLN   3          2HG       GLN   3  -7.842  -2.792 -21.096
   24   2HG   GLN   3          1HG       GLN   3  -7.041  -1.314 -20.561
   25   1HE2  GLN   3          2HE2      GLN   3  -9.231  -0.921 -23.749
   26   2HE2  GLN   3          1HE2      GLN   3  -9.515  -1.907 -22.397
   27    H    ALA   4           H        ALA   4  -3.600  -2.927 -22.460
   28    HA   ALA   4           HA       ALA   4  -2.481  -4.425 -24.662
   29   1HB   ALA   4          1HB       ALA   4  -3.688  -1.763 -25.151
   30   2HB   ALA   4          3HB       ALA   4  -2.095  -2.030 -25.858
   31   3HB   ALA   4          2HB       ALA   4  -3.434  -3.102 -26.270
   32    H    GLU   5           H        GLU   5  -2.281  -1.430 -22.759
   33    HA   GLU   5           HA       GLU   5   0.066  -1.937 -21.396
   34   1HB   GLU   5          2HB       GLU   5   1.725  -0.621 -22.913
   35   2HB   GLU   5          1HB       GLU   5   1.392  -2.308 -23.302
   36   1HG   GLU   5          2HG       GLU   5   0.310  -1.775 -25.233
   37   2HG   GLU   5          1HG       GLU   5  -0.488  -0.378 -24.509
   38    H    GLU   6           H        GLU   6  -2.348  -0.262 -21.340
   39    HA   GLU   6           HA       GLU   6  -1.258   2.495 -21.321
   40   1HB   GLU   6          2HB       GLU   6  -4.042   1.381 -20.879
   41   2HB   GLU   6          1HB       GLU   6  -3.642   3.090 -20.707
   42   1HG   GLU   6          2HG       GLU   6  -2.538   2.571 -23.138
   43   2HG   GLU   6          1HG       GLU   6  -3.893   1.444 -23.159
   44    H    TRP   7           H        TRP   7  -2.637   0.079 -19.148
   45    HA   TRP   7           HA       TRP   7  -1.298   1.442 -16.870
   46   1HB   TRP   7          2HB       TRP   7  -3.386   0.688 -15.514
   47   2HB   TRP   7          1HB       TRP   7  -3.525   2.136 -16.504
   48    HD1  TRP   7           HD1      TRP   7  -5.331   2.167 -18.312
   49    HE1  TRP   7           HE1      TRP   7  -6.982   0.431 -19.266
   50    HE3  TRP   7           HE3      TRP   7  -3.583  -2.060 -16.037
   51    HZ2  TRP   7           HZ2      TRP   7  -7.494  -2.376 -19.087
   52    HZ3  TRP   7           HZ3      TRP   7  -4.669  -4.250 -16.449
   53    HH2  TRP   7           HH2      TRP   7  -6.623  -4.411 -17.969
   54    H    TYR   8           H        TYR   8  -1.125  -1.071 -18.690
   55    HA   TYR   8           HA       TYR   8  -0.449  -2.919 -16.500
   56   1HB   TYR   8          2HB       TYR   8  -2.508  -3.866 -16.796
   57   2HB   TYR   8          1HB       TYR   8  -2.674  -3.262 -18.440
   58    HD1  TYR   8           HD1      TYR   8  -1.582  -4.432 -20.331
   59    HD2  TYR   8           HD2      TYR   8  -1.514  -6.017 -16.334
   60    HE1  TYR   8           HE1      TYR   8  -0.882  -6.639 -21.219
   61    HE2  TYR   8           HE2      TYR   8  -0.789  -8.212 -17.226
   62    HH   TYR   8           HH       TYR   8  -0.955  -9.469 -19.369
   63    H    PHE   9           H        PHE   9   1.479  -3.789 -16.900
   64    HA   PHE   9           HA       PHE   9   2.591  -3.577 -19.639
   65   1HB   PHE   9          2HB       PHE   9   3.790  -3.911 -16.894
   66   2HB   PHE   9          1HB       PHE   9   4.742  -4.245 -18.338
   67    HD1  PHE   9           HD1      PHE   9   2.125  -1.732 -18.678
   68    HD2  PHE   9           HD2      PHE   9   6.247  -2.331 -17.583
   69    HE1  PHE   9           HE1      PHE   9   2.556   0.690 -18.950
   70    HE2  PHE   9           HE2      PHE   9   6.665   0.094 -17.857
   71    HZ   PHE   9           HZ       PHE   9   4.823   1.605 -18.540
   72    H    GLY  10           H        GLY  10   1.984  -5.969 -17.082
   73   1HA   GLY  10          2HA       GLY  10   1.194  -8.167 -18.290
   74   2HA   GLY  10          1HA       GLY  10   2.825  -8.126 -18.949
   75    H    LYS  11           H        LYS  11   4.303  -9.226 -17.809
   76    HA   LYS  11           HA       LYS  11   3.710  -9.902 -14.969
   77   1HB   LYS  11          2HB       LYS  11   5.852 -11.259 -16.577
   78   2HB   LYS  11          1HB       LYS  11   4.856 -11.911 -15.275
   79   1HG   LYS  11          2HG       LYS  11   3.008 -11.189 -17.236
   80   2HG   LYS  11          1HG       LYS  11   4.350 -11.879 -18.151
   81   1HD   LYS  11          2HD       LYS  11   3.477 -13.329 -15.691
   82   2HD   LYS  11          1HD       LYS  11   2.426 -13.419 -17.104
   83   1HE   LYS  11          2HE       LYS  11   5.059 -13.777 -18.067
   84   2HE   LYS  11          1HE       LYS  11   4.928 -14.779 -16.622
   85   1HZ   LYS  11          1HZ       LYS  11   2.605 -14.907 -18.300
   86   2HZ   LYS  11          3HZ       LYS  11   4.011 -15.436 -19.088
   87   3HZ   LYS  11          2HZ       LYS  11   3.530 -16.165 -17.630
   88    H    LEU  12           H        LEU  12   4.466  -7.639 -14.618
   89    HA   LEU  12           HA       LEU  12   7.414  -7.320 -14.842
   90   1HB   LEU  12          2HB       LEU  12   5.871  -5.543 -15.726
   91   2HB   LEU  12          1HB       LEU  12   5.338  -5.257 -14.071
   92    HG   LEU  12           HG       LEU  12   7.664  -4.768 -13.413
   93   1HD1  LEU  12          1HD1      LEU  12   8.193  -6.014 -15.931
   94   2HD1  LEU  12          3HD1      LEU  12   8.809  -4.362 -16.000
   95   3HD1  LEU  12          2HD1      LEU  12   9.357  -5.453 -14.726
   96   1HD2  LEU  12          3HD2      LEU  12   6.135  -3.227 -15.403
   97   2HD2  LEU  12          2HD2      LEU  12   6.805  -2.719 -13.850
   98   3HD2  LEU  12          1HD2      LEU  12   7.837  -2.781 -15.280
   99    H    GLY  13           H        GLY  13   8.534  -6.297 -12.981
  100   1HA   GLY  13          2HA       GLY  13   7.425  -7.302 -10.394
  101   2HA   GLY  13          1HA       GLY  13   9.149  -7.160 -10.744
  102    H    ARG  14           H        ARG  14   8.038  -5.921  -8.480
  103    HA   ARG  14           HA       ARG  14   7.240  -3.207  -8.878
  104   1HB   ARG  14          2HB       ARG  14   8.261  -2.957  -6.493
  105   2HB   ARG  14          1HB       ARG  14   6.873  -4.022  -6.711
  106   1HG   ARG  14          2HG       ARG  14   8.077  -5.820  -6.072
  107   2HG   ARG  14          1HG       ARG  14   9.349  -5.441  -7.233
  108   1HD   ARG  14          2HD       ARG  14  10.218  -5.407  -4.920
  109   2HD   ARG  14          1HD       ARG  14  10.308  -3.806  -5.655
  110    HE   ARG  14           HE       ARG  14   7.857  -3.817  -4.351
  111   1HH1  ARG  14          2HH1      ARG  14   9.975  -5.690  -2.797
  112   2HH1  ARG  14          1HH1      ARG  14  10.321  -4.621  -1.479
  113   1HH2  ARG  14          1HH2      ARG  14   8.798  -1.880  -2.958
  114   2HH2  ARG  14          2HH2      ARG  14   9.655  -2.463  -1.571
  115    H    LYS  15           H        LYS  15  10.346  -4.710  -9.151
  116    HA   LYS  15           HA       LYS  15  11.928  -2.375  -8.649
  117   1HB   LYS  15          2HB       LYS  15  12.654  -4.879  -8.699
  118   2HB   LYS  15          1HB       LYS  15  12.803  -4.629 -10.437
  119   1HG   LYS  15          2HG       LYS  15  14.487  -2.995 -10.176
  120   2HG   LYS  15          1HG       LYS  15  14.084  -2.723  -8.482
  121   1HD   LYS  15          2HD       LYS  15  16.176  -4.054  -8.758
  122   2HD   LYS  15          1HD       LYS  15  14.924  -4.944  -7.892
  123   1HE   LYS  15          2HE       LYS  15  14.948  -6.559  -9.460
  124   2HE   LYS  15          1HE       LYS  15  14.601  -5.374 -10.719
  125   1HZ   LYS  15          3HZ       LYS  15  17.321  -5.416  -9.688
  126   2HZ   LYS  15          2HZ       LYS  15  16.852  -6.754 -10.625
  127   3HZ   LYS  15          1HZ       LYS  15  16.763  -5.186 -11.273
  128    H    ASP  16           H        ASP  16  10.583  -3.903 -11.539
  129    HA   ASP  16           HA       ASP  16  11.758  -2.026 -13.340
  130   1HB   ASP  16          2HB       ASP  16  10.743  -4.404 -13.763
  131   2HB   ASP  16          1HB       ASP  16   9.240  -3.509 -13.915
  132    H    ALA  17           H        ALA  17   8.686  -2.352 -11.664
  133    HA   ALA  17           HA       ALA  17   7.204  -0.334 -12.893
  134   1HB   ALA  17          1HB       ALA  17   7.346  -0.996  -9.944
  135   2HB   ALA  17          3HB       ALA  17   6.086  -0.013 -10.691
  136   3HB   ALA  17          2HB       ALA  17   6.251  -1.715 -11.127
  137    H    GLU  18           H        GLU  18   9.473   0.041 -10.171
  138    HA   GLU  18           HA       GLU  18   9.341   2.915 -10.161
  139   1HB   GLU  18          2HB       GLU  18  11.532   2.738  -8.915
  140   2HB   GLU  18          1HB       GLU  18  10.232   1.771  -8.220
  141   1HG   GLU  18          2HG       GLU  18  11.088  -0.241  -9.240
  142   2HG   GLU  18          1HG       GLU  18  12.263   0.675 -10.184
  143    H    ARG  19           H        ARG  19  11.123   0.581 -12.036
  144    HA   ARG  19           HA       ARG  19  13.036   2.491 -13.117
  145   1HB   ARG  19          2HB       ARG  19  13.582   0.109 -13.062
  146   2HB   ARG  19          1HB       ARG  19  12.194  -0.254 -14.086
  147   1HG   ARG  19          2HG       ARG  19  13.752  -0.108 -15.759
  148   2HG   ARG  19          1HG       ARG  19  13.420   1.619 -15.614
  149   1HD   ARG  19          2HD       ARG  19  15.581   1.945 -15.070
  150   2HD   ARG  19          1HD       ARG  19  15.322   0.994 -13.607
  151    HE   ARG  19           HE       ARG  19  15.930  -0.461 -16.124
  152   1HH1  ARG  19          2HH1      ARG  19  17.438   1.182 -13.581
  153   2HH1  ARG  19          1HH1      ARG  19  18.498  -0.119 -13.152
  154   1HH2  ARG  19          1HH2      ARG  19  17.025  -2.388 -15.320
  155   2HH2  ARG  19          2HH2      ARG  19  18.264  -2.139 -14.136
  156    H    GLN  20           H        GLN  20  10.862   0.551 -15.129
  157    HA   GLN  20           HA       GLN  20  10.635   2.120 -17.334
  158   1HB   GLN  20          2HB       GLN  20   9.104   0.033 -16.240
  159   2HB   GLN  20          1HB       GLN  20   7.947   1.316 -16.590
  160   1HG   GLN  20          2HG       GLN  20  10.026   0.364 -18.576
  161   2HG   GLN  20          1HG       GLN  20   8.380  -0.265 -18.518
  162   1HE2  GLN  20          2HE2      GLN  20   8.948   2.994 -20.646
  163   2HE2  GLN  20          1HE2      GLN  20  10.103   1.792 -20.326
  164    H    LEU  21           H        LEU  21   9.160   2.859 -14.212
  165    HA   LEU  21           HA       LEU  21   7.586   5.071 -15.296
  166   1HB   LEU  21          2HB       LEU  21   8.112   3.933 -12.587
  167   2HB   LEU  21          1HB       LEU  21   7.565   5.604 -12.683
  168    HG   LEU  21           HG       LEU  21   5.602   4.935 -13.964
  169   1HD1  LEU  21          2HD1      LEU  21   6.841   3.025 -15.115
  170   2HD1  LEU  21          1HD1      LEU  21   6.531   2.071 -13.664
  171   3HD1  LEU  21          3HD1      LEU  21   5.183   2.674 -14.628
  172   1HD2  LEU  21          2HD2      LEU  21   5.833   4.595 -11.356
  173   2HD2  LEU  21          1HD2      LEU  21   4.408   3.993 -12.201
  174   3HD2  LEU  21          3HD2      LEU  21   5.713   2.886 -11.775
  175    H    LEU  22           H        LEU  22  10.250   5.010 -12.922
  176    HA   LEU  22           HA       LEU  22  10.841   7.812 -13.294
  177   1HB   LEU  22          2HB       LEU  22  12.668   5.685 -12.144
  178   2HB   LEU  22          1HB       LEU  22  12.735   7.420 -11.844
  179    HG   LEU  22           HG       LEU  22  10.600   5.466 -10.960
  180   1HD1  LEU  22          1HD1      LEU  22  12.918   6.434  -9.744
  181   2HD1  LEU  22          3HD1      LEU  22  11.629   7.424  -9.058
  182   3HD1  LEU  22          2HD1      LEU  22  11.558   5.666  -8.925
  183   1HD2  LEU  22          2HD2      LEU  22   9.581   7.548 -11.899
  184   2HD2  LEU  22          1HD2      LEU  22   9.311   7.376 -10.165
  185   3HD2  LEU  22          3HD2      LEU  22  10.541   8.490 -10.760
  186    H    SER  23           H        SER  23  12.836   4.939 -14.086
  187    HA   SER  23           HA       SER  23  14.822   6.113 -15.596
  188   1HB   SER  23          2HB       SER  23  14.780   3.710 -15.236
  189   2HB   SER  23          1HB       SER  23  13.324   3.552 -16.218
  190    HG   SER  23           HG       SER  23  15.788   3.421 -17.043
  191    H    PHE  24           H        PHE  24  12.339   4.494 -17.533
  192    HA   PHE  24           HA       PHE  24  11.753   7.020 -18.960
  193   1HB   PHE  24          2HB       PHE  24  13.790   5.523 -19.925
  194   2HB   PHE  24          1HB       PHE  24  12.434   4.728 -20.725
  195    HD1  PHE  24           HD1      PHE  24  13.960   8.082 -20.098
  196    HD2  PHE  24           HD2      PHE  24  11.398   5.713 -22.603
  197    HE1  PHE  24           HE1      PHE  24  13.826   9.948 -21.727
  198    HE2  PHE  24           HE2      PHE  24  11.264   7.579 -24.232
  199    HZ   PHE  24           HZ       PHE  24  12.478   9.696 -23.793
  200    H    GLY  25           H        GLY  25   9.715   6.988 -19.922
  201   1HA   GLY  25          2HA       GLY  25   8.189   4.870 -20.827
  202   2HA   GLY  25          1HA       GLY  25   7.922   4.849 -19.084
  203    H    ASN  26           H        ASN  26   6.835   6.645 -18.117
  204    HA   ASN  26           HA       ASN  26   5.712   8.665 -19.993
  205   1HB   ASN  26          2HB       ASN  26   4.247   6.547 -18.584
  206   2HB   ASN  26          1HB       ASN  26   3.603   8.159 -18.277
  207   1HD2  ASN  26          2HD2      ASN  26   2.415   6.524 -21.601
  208   2HD2  ASN  26          1HD2      ASN  26   2.730   5.764 -20.116
  209    HA   PRO  27           HA       PRO  27   6.313  11.462 -16.670
  210   1HB   PRO  27          2HB       PRO  27   4.129  13.114 -16.923
  211   2HB   PRO  27          1HB       PRO  27   5.509  13.136 -18.032
  212   1HG   PRO  27          2HG       PRO  27   2.769  12.020 -18.449
  213   2HG   PRO  27          1HG       PRO  27   3.919  12.636 -19.644
  214   1HD   PRO  27          2HD       PRO  27   3.408   9.906 -19.077
  215   2HD   PRO  27          1HD       PRO  27   4.774  10.537 -20.020
  216    H    ARG  28           H        ARG  28   5.138  12.480 -14.680
  217    HA   ARG  28           HA       ARG  28   4.241  10.574 -12.895
  218   1HB   ARG  28          2HB       ARG  28   3.257  12.373 -11.587
  219   2HB   ARG  28          1HB       ARG  28   4.739  12.967 -12.337
  220   1HG   ARG  28          2HG       ARG  28   3.551  14.197 -13.975
  221   2HG   ARG  28          1HG       ARG  28   2.054  13.315 -13.673
  222   1HD   ARG  28          2HD       ARG  28   2.685  14.396 -11.189
  223   2HD   ARG  28          1HD       ARG  28   3.120  15.678 -12.319
  224    HE   ARG  28           HE       ARG  28   0.400  14.440 -12.183
  225   1HH1  ARG  28          1HH2      ARG  28  -0.251  15.660 -14.368
  226   2HH1  ARG  28          2HH2      ARG  28  -0.245  17.377 -14.137
  227   1HH2  ARG  28          2HH1      ARG  28   1.636  17.245 -11.227
  228   2HH2  ARG  28          1HH1      ARG  28   0.824  18.274 -12.359
  229    H    GLY  29           H        GLY  29   2.021  10.152 -12.040
  230   1HA   GLY  29          2HA       GLY  29  -0.287   9.723 -12.319
  231   2HA   GLY  29          1HA       GLY  29  -0.262  10.739 -13.761
  232    H    THR  30           H        THR  30   2.119   8.240 -13.533
  233    HA   THR  30           HA       THR  30   0.769   6.814 -15.764
  234    HB   THR  30           HB       THR  30   3.572   6.513 -14.641
  235    HG1  THR  30           HG1      THR  30   2.395   8.128 -16.561
  236   1HG2  THR  30          2HG2      THR  30   2.045   4.795 -16.289
  237   2HG2  THR  30          1HG2      THR  30   3.198   5.606 -17.349
  238   3HG2  THR  30          3HG2      THR  30   3.772   4.698 -15.950
  239    H    PHE  31           H        PHE  31  -0.765   5.497 -14.760
  240    HA   PHE  31           HA       PHE  31   0.110   3.809 -12.483
  241   1HB   PHE  31          2HB       PHE  31  -2.604   4.131 -13.780
  242   2HB   PHE  31          1HB       PHE  31  -2.277   3.173 -12.342
  243    HD1  PHE  31           HD1      PHE  31  -1.537   6.652 -13.593
  244    HD2  PHE  31           HD2      PHE  31  -2.786   4.168 -10.318
  245    HE1  PHE  31           HE1      PHE  31  -1.824   8.664 -12.178
  246    HE2  PHE  31           HE2      PHE  31  -3.071   6.183  -8.905
  247    HZ   PHE  31           HZ       PHE  31  -2.591   8.431  -9.833
  248    H    LEU  32           H        LEU  32   1.381   2.170 -13.452
  249    HA   LEU  32           HA       LEU  32   0.201   0.712 -15.747
  250   1HB   LEU  32          2HB       LEU  32   2.349  -0.340 -15.992
  251   2HB   LEU  32          1HB       LEU  32   2.660   1.367 -15.682
  252    HG   LEU  32           HG       LEU  32   2.732   0.617 -13.169
  253   1HD1  LEU  32          1HD1      LEU  32   2.753  -1.931 -14.697
  254   2HD1  LEU  32          3HD1      LEU  32   3.921  -1.800 -13.383
  255   3HD1  LEU  32          2HD1      LEU  32   2.199  -1.607 -13.055
  256   1HD2  LEU  32          3HD2      LEU  32   4.671   0.967 -15.196
  257   2HD2  LEU  32          2HD2      LEU  32   4.924   1.068 -13.454
  258   3HD2  LEU  32          1HD2      LEU  32   5.168  -0.463 -14.293
  259    H    ILE  33           H        ILE  33   0.558  -1.797 -15.515
  260    HA   ILE  33           HA       ILE  33  -0.179  -2.648 -12.750
  261    HB   ILE  33           HB       ILE  33  -1.654  -3.126 -15.318
  262   1HG1  ILE  33          2HG1      ILE  33  -2.386  -2.695 -12.419
  263   2HG1  ILE  33          1HG1      ILE  33  -2.619  -1.579 -13.763
  264   1HG2  ILE  33          3HG2      ILE  33  -0.910  -5.398 -14.583
  265   2HG2  ILE  33          2HG2      ILE  33  -1.697  -5.107 -13.031
  266   3HG2  ILE  33          1HG2      ILE  33  -2.658  -5.178 -14.505
  267   1HD1  ILE  33          1HD1      ILE  33  -3.939  -3.791 -14.683
  268   2HD1  ILE  33          3HD1      ILE  33  -4.238  -3.914 -12.949
  269   3HD1  ILE  33          2HD1      ILE  33  -4.719  -2.461 -13.826
  270    H    ARG  34           H        ARG  34   0.106  -5.166 -12.624
  271    HA   ARG  34           HA       ARG  34   1.789  -6.516 -14.478
  272   1HB   ARG  34          2HB       ARG  34   3.962  -6.371 -13.336
  273   2HB   ARG  34          1HB       ARG  34   3.427  -4.775 -13.859
  274   1HG   ARG  34          2HG       ARG  34   4.102  -4.374 -11.652
  275   2HG   ARG  34          1HG       ARG  34   2.367  -4.631 -11.472
  276   1HD   ARG  34          2HD       ARG  34   2.652  -6.604 -10.356
  277   2HD   ARG  34          1HD       ARG  34   4.005  -7.091 -11.373
  278    HE   ARG  34           HE       ARG  34   5.235  -6.469  -9.445
  279   1HH1  ARG  34          1HH2      ARG  34   5.906  -3.879 -10.286
  280   2HH1  ARG  34          2HH2      ARG  34   5.136  -2.803  -9.167
  281   1HH2  ARG  34          2HH1      ARG  34   2.915  -5.192  -7.991
  282   2HH2  ARG  34          1HH1      ARG  34   3.443  -3.547  -7.868
  283    H    GLU  35           H        GLU  35   2.447  -8.588 -13.712
  284    HA   GLU  35           HA       GLU  35   0.689  -9.728 -11.748
  285   1HB   GLU  35          2HB       GLU  35   2.902 -10.656 -13.498
  286   2HB   GLU  35          1HB       GLU  35   2.495 -11.665 -12.119
  287   1HG   GLU  35          2HG       GLU  35   0.047 -11.377 -12.884
  288   2HG   GLU  35          1HG       GLU  35   0.735 -10.803 -14.405
  289    H    SER  36           H        SER  36   0.983  -9.966  -9.593
  290    HA   SER  36           HA       SER  36   3.349  -8.908  -8.284
  291   1HB   SER  36          2HB       SER  36   1.052 -10.554  -7.173
  292   2HB   SER  36          1HB       SER  36   2.251  -9.693  -6.219
  293    HG   SER  36           HG       SER  36   1.431  -7.801  -6.818
  294    H    GLU  37           H        GLU  37   5.206 -10.043  -7.936
  295    HA   GLU  37           HA       GLU  37   5.201 -12.968  -8.380
  296   1HB   GLU  37          2HB       GLU  37   7.409 -10.983  -7.810
  297   2HB   GLU  37          1HB       GLU  37   7.674 -12.709  -8.048
  298   1HG   GLU  37          2HG       GLU  37   6.326 -12.338 -10.268
  299   2HG   GLU  37          1HG       GLU  37   6.758 -10.644 -10.036
  300    H    THR  38           H        THR  38   4.149 -11.322  -5.935
  301    HA   THR  38           HA       THR  38   5.801 -12.348  -3.744
  302    HB   THR  38           HB       THR  38   4.376 -10.154  -3.834
  303    HG1  THR  38           HG1      THR  38   4.105 -10.330  -1.566
  304   1HG2  THR  38          3HG2      THR  38   2.254 -11.264  -4.436
  305   2HG2  THR  38          2HG2      THR  38   2.300 -12.162  -2.918
  306   3HG2  THR  38          1HG2      THR  38   2.117 -10.408  -2.901
  307    H    THR  39           H        THR  39   2.654 -13.019  -5.186
  308    HA   THR  39           HA       THR  39   2.509 -15.495  -3.505
  309    HB   THR  39           HB       THR  39   0.638 -13.702  -3.452
  310    HG1  THR  39           HG1      THR  39  -0.246 -15.378  -2.592
  311   1HG2  THR  39          2HG2      THR  39   0.718 -13.967  -6.164
  312   2HG2  THR  39          1HG2      THR  39  -0.596 -15.072  -5.760
  313   3HG2  THR  39          3HG2      THR  39  -0.687 -13.380  -5.272
  314    H    LYS  40           H        LYS  40   0.835 -17.068  -4.940
  315    HA   LYS  40           HA       LYS  40   2.374 -18.388  -6.809
  316   1HB   LYS  40          2HB       LYS  40  -0.586 -18.049  -7.257
  317   2HB   LYS  40          1HB       LYS  40   0.406 -19.479  -7.542
  318   1HG   LYS  40          2HG       LYS  40   0.844 -19.422  -4.989
  319   2HG   LYS  40          1HG       LYS  40  -0.543 -18.334  -4.920
  320   1HD   LYS  40          2HD       LYS  40  -2.040 -19.987  -5.505
  321   2HD   LYS  40          1HD       LYS  40  -0.861 -20.851  -6.490
  322   1HE   LYS  40          2HE       LYS  40  -0.420 -20.705  -3.530
  323   2HE   LYS  40          1HE       LYS  40  -1.634 -21.826  -4.148
  324   1HZ   LYS  40          1HZ       LYS  40   0.350 -22.350  -5.806
  325   2HZ   LYS  40          3HZ       LYS  40   1.262 -21.861  -4.462
  326   3HZ   LYS  40          2HZ       LYS  40   0.167 -23.153  -4.320
  327    H    GLY  41           H        GLY  41   0.307 -15.588  -7.310
  328   1HA   GLY  41          2HA       GLY  41   1.728 -14.302  -9.260
  329   2HA   GLY  41          1HA       GLY  41   0.799 -15.488 -10.178
  330    H    ALA  42           H        ALA  42   0.381 -12.963  -7.709
  331    HA   ALA  42           HA       ALA  42  -2.460 -12.617  -8.384
  332   1HB   ALA  42          3HB       ALA  42  -0.641 -11.799  -6.258
  333   2HB   ALA  42          2HB       ALA  42  -1.597 -10.437  -6.844
  334   3HB   ALA  42          1HB       ALA  42  -2.404 -11.884  -6.240
  335    H    TYR  43           H        TYR  43  -2.567  -9.778  -8.277
  336    HA   TYR  43           HA       TYR  43  -1.007  -9.104 -10.728
  337   1HB   TYR  43          2HB       TYR  43  -3.841  -9.117 -10.408
  338   2HB   TYR  43          1HB       TYR  43  -3.308  -7.444 -10.588
  339    HD1  TYR  43           HD1      TYR  43  -0.934  -7.617 -12.261
  340    HD2  TYR  43           HD2      TYR  43  -4.624  -9.826 -12.496
  341    HE1  TYR  43           HE1      TYR  43  -0.553  -8.033 -14.686
  342    HE2  TYR  43           HE2      TYR  43  -4.233 -10.239 -14.904
  343    HH   TYR  43           HH       TYR  43  -2.969  -9.757 -16.659
  344    H    SER  44           H        SER  44  -1.350  -6.444 -10.933
  345    HA   SER  44           HA       SER  44  -1.064  -5.148  -8.331
  346   1HB   SER  44          2HB       SER  44   1.307  -5.368 -10.154
  347   2HB   SER  44          1HB       SER  44   1.237  -4.577  -8.568
  348    HG   SER  44           HG       SER  44   1.139  -7.309  -9.206
  349    H    LEU  45           H        LEU  45  -0.479  -2.831  -8.569
  350    HA   LEU  45           HA       LEU  45  -0.937  -1.719 -11.287
  351   1HB   LEU  45          2HB       LEU  45  -3.175  -1.728 -10.421
  352   2HB   LEU  45          1HB       LEU  45  -2.638  -1.123  -8.854
  353    HG   LEU  45           HG       LEU  45  -2.037   1.014  -9.811
  354   1HD1  LEU  45          3HD1      LEU  45  -2.031  -0.550 -12.270
  355   2HD1  LEU  45          2HD1      LEU  45  -2.938   0.949 -12.455
  356   3HD1  LEU  45          1HD1      LEU  45  -1.256   0.997 -11.930
  357   1HD2  LEU  45          3HD2      LEU  45  -4.726  -0.114 -10.480
  358   2HD2  LEU  45          2HD2      LEU  45  -4.300   1.158  -9.336
  359   3HD2  LEU  45          1HD2      LEU  45  -4.323   1.499 -11.067
  360    H    SER  46           H        SER  46   1.216  -0.948 -11.229
  361    HA   SER  46           HA       SER  46   2.229   0.610  -8.994
  362   1HB   SER  46          2HB       SER  46   3.561   1.033 -11.566
  363   2HB   SER  46          1HB       SER  46   4.217   0.420 -10.049
  364    HG   SER  46           HG       SER  46   3.671  -1.586 -10.583
  365    H    ILE  47           H        ILE  47   2.585   2.889  -8.962
  366    HA   ILE  47           HA       ILE  47   1.276   4.460 -11.117
  367    HB   ILE  47           HB       ILE  47  -0.544   4.457  -9.691
  368   1HG1  ILE  47          2HG1      ILE  47   0.558   6.815  -9.952
  369   2HG1  ILE  47          1HG1      ILE  47  -0.742   6.609  -8.784
  370   1HG2  ILE  47          3HG2      ILE  47   1.508   4.035  -7.561
  371   2HG2  ILE  47          2HG2      ILE  47  -0.055   4.707  -7.097
  372   3HG2  ILE  47          1HG2      ILE  47   0.027   3.136  -7.892
  373   1HD1  ILE  47          1HD1      ILE  47   1.724   5.971  -7.474
  374   2HD1  ILE  47          3HD1      ILE  47   1.919   7.512  -8.305
  375   3HD1  ILE  47          2HD1      ILE  47   0.616   7.298  -7.138
  376    H    ARG  48           H        ARG  48   2.672   6.022 -11.734
  377    HA   ARG  48           HA       ARG  48   5.008   6.662 -10.090
  378   1HB   ARG  48          2HB       ARG  48   5.295   6.491 -12.504
  379   2HB   ARG  48          1HB       ARG  48   4.053   7.715 -12.772
  380   1HG   ARG  48          2HG       ARG  48   5.603   9.334 -12.584
  381   2HG   ARG  48          1HG       ARG  48   5.983   8.787 -10.951
  382   1HD   ARG  48          2HD       ARG  48   7.729   7.417 -11.674
  383   2HD   ARG  48          1HD       ARG  48   7.082   7.290 -13.311
  384    HE   ARG  48           HE       ARG  48   8.991   9.209 -12.516
  385   1HH1  ARG  48          1HH2      ARG  48   6.947  11.233 -12.449
  386   2HH1  ARG  48          2HH2      ARG  48   6.735  11.685 -14.107
  387   1HH2  ARG  48          2HH1      ARG  48   8.277   8.841 -15.356
  388   2HH2  ARG  48          1HH1      ARG  48   7.488  10.331 -15.753
  389    H    ASP  49           H        ASP  49   5.439   8.725  -9.163
  390    HA   ASP  49           HA       ASP  49   3.408  10.835  -9.403
  391   1HB   ASP  49          2HB       ASP  49   2.409   9.418  -7.676
  392   2HB   ASP  49          1HB       ASP  49   3.916   9.436  -6.760
  393    H    TRP  50           H        TRP  50   5.210  12.080 -10.160
  394    HA   TRP  50           HA       TRP  50   7.585  12.441  -8.484
  395   1HB   TRP  50          2HB       TRP  50   7.939  12.728 -10.834
  396   2HB   TRP  50          1HB       TRP  50   6.544  13.795 -10.986
  397    HD1  TRP  50           HD1      TRP  50  10.200  13.863 -10.415
  398    HE1  TRP  50           HE1      TRP  50  10.969  16.237  -9.760
  399    HE3  TRP  50           HE3      TRP  50   5.689  16.001  -9.590
  400    HZ2  TRP  50           HZ2      TRP  50   9.788  18.748  -9.038
  401    HZ3  TRP  50           HZ3      TRP  50   5.506  18.391  -8.933
  402    HH2  TRP  50           HH2      TRP  50   7.555  19.765  -8.655
  403    H    ASP  51           H        ASP  51   8.124  14.493  -7.441
  404    HA   ASP  51           HA       ASP  51   5.808  16.290  -6.920
  405   1HB   ASP  51          2HB       ASP  51   6.841  14.378  -5.065
  406   2HB   ASP  51          1HB       ASP  51   7.270  15.986  -4.483
  407    H    ASP  52           H        ASP  52   6.496  18.383  -6.001
  408    HA   ASP  52           HA       ASP  52   9.081  19.227  -7.127
  409   1HB   ASP  52          2HB       ASP  52   6.674  20.476  -6.958
  410   2HB   ASP  52          1HB       ASP  52   7.475  21.143  -5.535
  411    H    MET  53           H        MET  53   9.619  17.486  -5.107
  412    HA   MET  53           HA       MET  53  11.078  19.166  -3.266
  413   1HB   MET  53          2HB       MET  53  10.068  18.348  -1.210
  414   2HB   MET  53          1HB       MET  53   8.816  19.075  -2.218
  415   1HG   MET  53          2HG       MET  53   8.866  16.441  -3.083
  416   2HG   MET  53          1HG       MET  53   9.123  16.294  -1.345
  417   1HE   MET  53          1HE       MET  53   7.444  17.894  -4.105
  418   2HE   MET  53          3HE       MET  53   5.705  17.792  -3.796
  419   3HE   MET  53          2HE       MET  53   6.625  19.181  -3.226
  420    H    LYS  54           H        LYS  54  10.231  15.962  -4.433
  421    HA   LYS  54           HA       LYS  54  12.812  15.024  -3.354
  422   1HB   LYS  54          2HB       LYS  54  11.539  12.713  -3.364
  423   2HB   LYS  54          1HB       LYS  54  11.360  13.824  -2.006
  424   1HG   LYS  54          2HG       LYS  54   9.239  14.546  -2.715
  425   2HG   LYS  54          1HG       LYS  54   9.507  14.011  -4.374
  426   1HD   LYS  54          2HD       LYS  54   8.427  12.102  -3.851
  427   2HD   LYS  54          1HD       LYS  54   9.777  11.698  -2.791
  428   1HE   LYS  54          2HE       LYS  54   8.703  12.604  -0.889
  429   2HE   LYS  54          1HE       LYS  54   7.558  13.522  -1.866
  430   1HZ   LYS  54          3HZ       LYS  54   6.713  11.316  -2.667
  431   2HZ   LYS  54          2HZ       LYS  54   7.645  10.591  -1.445
  432   3HZ   LYS  54          1HZ       LYS  54   6.395  11.668  -1.038
  433    H    GLY  55           H        GLY  55  10.963  15.476  -6.179
  434   1HA   GLY  55          2HA       GLY  55  11.945  15.072  -8.344
  435   2HA   GLY  55          1HA       GLY  55  12.858  13.755  -7.622
  436    H    ASP  56           H        ASP  56  11.894  12.585  -9.555
  437    HA   ASP  56           HA       ASP  56   9.043  12.051  -9.529
  438   1HB   ASP  56          2HB       ASP  56   9.794  10.162 -11.129
  439   2HB   ASP  56          1HB       ASP  56  10.078  11.821 -11.646
  440    H    HIS  57           H        HIS  57   8.186   9.797  -9.213
  441    HA   HIS  57           HA       HIS  57   9.774   7.941  -7.611
  442   1HB   HIS  57          2HB       HIS  57   7.833   9.824  -6.369
  443   2HB   HIS  57          1HB       HIS  57   7.754   8.147  -5.831
  444    HD1  HIS  57           HD1      HIS  57   8.729  10.120  -3.778
  445    HD2  HIS  57           HD2      HIS  57  11.320   8.267  -6.468
  446    HE1  HIS  57           HE1      HIS  57  11.037  10.228  -2.741
  447    H    VAL  58           H        VAL  58   7.860   6.322  -6.603
  448    HA   VAL  58           HA       VAL  58   5.643   5.988  -8.475
  449    HB   VAL  58           HB       VAL  58   7.420   5.038  -9.839
  450   1HG1  VAL  58          2HG1      VAL  58   8.237   3.939  -7.226
  451   2HG1  VAL  58          1HG1      VAL  58   8.380   2.814  -8.580
  452   3HG1  VAL  58          3HG1      VAL  58   9.220   4.366  -8.628
  453   1HG2  VAL  58          2HG2      VAL  58   5.223   3.847  -9.757
  454   2HG2  VAL  58          1HG2      VAL  58   6.574   2.769 -10.117
  455   3HG2  VAL  58          3HG2      VAL  58   5.876   2.799  -8.497
  456    H    LYS  59           H        LYS  59   4.382   3.992  -7.898
  457    HA   LYS  59           HA       LYS  59   4.910   2.935  -5.183
  458   1HB   LYS  59          2HB       LYS  59   2.622   4.701  -5.970
  459   2HB   LYS  59          1HB       LYS  59   2.300   3.374  -4.854
  460   1HG   LYS  59          2HG       LYS  59   3.088   4.690  -3.201
  461   2HG   LYS  59          1HG       LYS  59   4.685   4.541  -3.933
  462   1HD   LYS  59          2HD       LYS  59   4.568   6.610  -4.934
  463   2HD   LYS  59          1HD       LYS  59   2.818   6.525  -5.145
  464   1HE   LYS  59          2HE       LYS  59   2.450   6.997  -2.799
  465   2HE   LYS  59          1HE       LYS  59   4.177   6.882  -2.459
  466   1HZ   LYS  59          2HZ       LYS  59   3.298   8.785  -4.500
  467   2HZ   LYS  59          1HZ       LYS  59   3.019   9.183  -2.872
  468   3HZ   LYS  59          3HZ       LYS  59   4.599   8.887  -3.411
  469    H    HIS  60           H        HIS  60   2.676   1.425  -4.810
  470    HA   HIS  60           HA       HIS  60   1.930   0.133  -7.331
  471   1HB   HIS  60          2HB       HIS  60   3.169  -1.723  -5.364
  472   2HB   HIS  60          1HB       HIS  60   3.045  -1.869  -7.114
  473    HD1  HIS  60           HD1      HIS  60   4.853  -0.722  -8.553
  474    HD2  HIS  60           HD2      HIS  60   5.400  -0.165  -4.458
  475    HE1  HIS  60           HE1      HIS  60   7.175   0.245  -8.266
  476    H    TYR  61           H        TYR  61   0.126  -1.120  -7.168
  477    HA   TYR  61           HA       TYR  61  -1.093  -1.369  -4.452
  478   1HB   TYR  61          2HB       TYR  61  -2.323  -0.566  -7.096
  479   2HB   TYR  61          1HB       TYR  61  -3.311  -1.273  -5.820
  480    HD1  TYR  61           HD1      TYR  61  -3.463  -0.171  -3.592
  481    HD2  TYR  61           HD2      TYR  61  -1.519   1.682  -6.942
  482    HE1  TYR  61           HE1      TYR  61  -3.580   2.029  -2.444
  483    HE2  TYR  61           HE2      TYR  61  -1.643   3.878  -5.804
  484    HH   TYR  61           HH       TYR  61  -2.197   4.955  -3.942
  485    H    LYS  62           H        LYS  62  -0.357  -3.515  -4.228
  486    HA   LYS  62           HA       LYS  62  -0.377  -5.517  -6.193
  487   1HB   LYS  62          2HB       LYS  62   0.655  -5.743  -3.937
  488   2HB   LYS  62          1HB       LYS  62  -0.954  -5.893  -3.237
  489   1HG   LYS  62          2HG       LYS  62  -0.428  -7.699  -5.511
  490   2HG   LYS  62          1HG       LYS  62   0.566  -8.005  -4.086
  491   1HD   LYS  62          2HD       LYS  62  -2.437  -7.661  -3.941
  492   2HD   LYS  62          1HD       LYS  62  -1.666  -9.232  -4.151
  493   1HE   LYS  62          2HE       LYS  62  -1.308  -9.340  -1.930
  494   2HE   LYS  62          1HE       LYS  62  -0.316  -7.886  -2.030
  495   1HZ   LYS  62          2HZ       LYS  62  -2.968  -7.082  -2.219
  496   2HZ   LYS  62          1HZ       LYS  62  -2.890  -8.185  -0.930
  497   3HZ   LYS  62          3HZ       LYS  62  -1.891  -6.815  -0.932
  498    H    ILE  63           H        ILE  63  -2.095  -5.975  -7.436
  499    HA   ILE  63           HA       ILE  63  -4.831  -5.698  -6.444
  500    HB   ILE  63           HB       ILE  63  -3.568  -6.477  -9.058
  501   1HG1  ILE  63          2HG1      ILE  63  -5.732  -4.625  -9.239
  502   2HG1  ILE  63          1HG1      ILE  63  -4.719  -4.138  -7.880
  503   1HG2  ILE  63          3HG2      ILE  63  -6.439  -6.914  -8.215
  504   2HG2  ILE  63          2HG2      ILE  63  -5.983  -6.705  -9.906
  505   3HG2  ILE  63          1HG2      ILE  63  -5.344  -8.064  -8.982
  506   1HD1  ILE  63          3HD1      ILE  63  -3.133  -4.965 -10.183
  507   2HD1  ILE  63          2HD1      ILE  63  -4.212  -3.626 -10.573
  508   3HD1  ILE  63          1HD1      ILE  63  -3.055  -3.470  -9.251
  509    H    ARG  64           H        ARG  64  -6.357  -7.443  -6.340
  510    HA   ARG  64           HA       ARG  64  -5.187 -10.177  -6.178
  511   1HB   ARG  64          2HB       ARG  64  -6.034  -8.634  -3.953
  512   2HB   ARG  64          1HB       ARG  64  -7.287  -9.841  -4.233
  513   1HG   ARG  64          2HG       ARG  64  -5.422 -10.610  -2.712
  514   2HG   ARG  64          1HG       ARG  64  -5.689 -11.639  -4.120
  515   1HD   ARG  64          2HD       ARG  64  -3.646 -11.175  -4.971
  516   2HD   ARG  64          1HD       ARG  64  -3.822  -9.449  -4.657
  517    HE   ARG  64           HE       ARG  64  -3.048  -9.890  -2.337
  518   1HH1  ARG  64          2HH1      ARG  64  -3.613 -12.927  -2.664
  519   2HH1  ARG  64          1HH1      ARG  64  -1.992 -13.536  -2.694
  520   1HH2  ARG  64          1HH2      ARG  64  -0.552 -10.431  -3.247
  521   2HH2  ARG  64          2HH2      ARG  64  -0.261 -12.122  -3.023
  522    H    LYS  65           H        LYS  65  -6.371 -11.478  -7.500
  523    HA   LYS  65           HA       LYS  65  -9.110 -10.565  -8.215
  524   1HB   LYS  65          2HB       LYS  65  -7.732 -10.869 -10.161
  525   2HB   LYS  65          1HB       LYS  65  -7.158 -12.433  -9.585
  526   1HG   LYS  65          2HG       LYS  65  -9.559 -13.240  -9.685
  527   2HG   LYS  65          1HG       LYS  65  -9.958 -11.728 -10.500
  528   1HD   LYS  65          2HD       LYS  65  -9.458 -12.883 -12.398
  529   2HD   LYS  65          1HD       LYS  65  -7.785 -12.558 -11.945
  530   1HE   LYS  65          2HE       LYS  65  -8.659 -14.827 -10.451
  531   2HE   LYS  65          1HE       LYS  65  -9.107 -15.091 -12.137
  532   1HZ   LYS  65          1HZ       LYS  65  -6.632 -14.076 -12.366
  533   2HZ   LYS  65          3HZ       LYS  65  -6.490 -14.955 -10.923
  534   3HZ   LYS  65          2HZ       LYS  65  -6.991 -15.738 -12.346
  535    H    LEU  66           H        LEU  66 -10.861 -11.828  -7.770
  536    HA   LEU  66           HA       LEU  66 -10.457 -14.045  -5.904
  537   1HB   LEU  66          2HB       LEU  66 -12.924 -12.756  -7.095
  538   2HB   LEU  66          1HB       LEU  66 -13.009 -14.164  -6.041
  539    HG   LEU  66           HG       LEU  66 -13.306 -12.380  -4.551
  540   1HD1  LEU  66          3HD1      LEU  66 -11.167 -13.928  -4.188
  541   2HD1  LEU  66          2HD1      LEU  66 -10.328 -12.383  -4.364
  542   3HD1  LEU  66          1HD1      LEU  66 -11.532 -12.594  -3.093
  543   1HD2  LEU  66          2HD2      LEU  66 -11.094 -10.931  -6.031
  544   2HD2  LEU  66          1HD2      LEU  66 -12.819 -10.587  -6.158
  545   3HD2  LEU  66          3HD2      LEU  66 -11.973 -10.301  -4.637
  546    H    ASP  67           H        ASP  67 -10.849 -16.213  -6.331
  547    HA   ASP  67           HA       ASP  67 -10.638 -17.057  -9.101
  548   1HB   ASP  67          2HB       ASP  67 -10.573 -18.286  -6.457
  549   2HB   ASP  67          1HB       ASP  67 -11.500 -19.253  -7.600
  550    H    ASN  68           H        ASN  68 -13.155 -16.191  -6.967
  551    HA   ASN  68           HA       ASN  68 -15.272 -17.711  -8.297
  552   1HB   ASN  68          2HB       ASN  68 -15.862 -15.268  -6.692
  553   2HB   ASN  68          1HB       ASN  68 -16.665 -16.837  -6.669
  554   1HD2  ASN  68          2HD2      ASN  68 -13.571 -18.017  -4.725
  555   2HD2  ASN  68          1HD2      ASN  68 -14.020 -18.284  -6.336
  556    H    GLY  69           H        GLY  69 -13.473 -14.905  -8.904
  557   1HA   GLY  69          2HA       GLY  69 -13.704 -13.770 -11.051
  558   2HA   GLY  69          1HA       GLY  69 -15.434 -14.064 -10.945
  559    H    GLY  70           H        GLY  70 -12.792 -12.159  -9.581
  560   1HA   GLY  70          2HA       GLY  70 -14.505  -9.894  -9.202
  561   2HA   GLY  70          1HA       GLY  70 -14.092 -10.647  -7.671
  562    H    TYR  71           H        TYR  71 -12.791  -8.911 -10.451
  563    HA   TYR  71           HA       TYR  71 -10.043  -8.939  -9.444
  564   1HB   TYR  71          2HB       TYR  71 -11.504  -7.665 -11.711
  565   2HB   TYR  71          1HB       TYR  71 -10.053  -6.840 -11.141
  566    HD1  TYR  71           HD1      TYR  71  -7.875  -8.122 -11.013
  567    HD2  TYR  71           HD2      TYR  71 -11.367  -9.685 -12.960
  568    HE1  TYR  71           HE1      TYR  71  -6.466  -9.767 -12.217
  569    HE2  TYR  71           HE2      TYR  71  -9.960 -11.332 -14.166
  570    HH   TYR  71           HH       TYR  71  -6.455 -11.206 -14.022
  571    H    TYR  72           H        TYR  72  -9.365  -7.661  -7.761
  572    HA   TYR  72           HA       TYR  72 -10.632  -5.010  -7.385
  573   1HB   TYR  72          2HB       TYR  72 -11.520  -5.471  -5.228
  574   2HB   TYR  72          1HB       TYR  72 -12.043  -6.800  -6.259
  575    HD1  TYR  72           HD1      TYR  72 -10.820  -9.011  -6.165
  576    HD2  TYR  72           HD2      TYR  72 -10.041  -5.846  -3.382
  577    HE1  TYR  72           HE1      TYR  72  -9.679 -10.611  -4.676
  578    HE2  TYR  72           HE2      TYR  72  -8.898  -7.433  -1.884
  579    HH   TYR  72           HH       TYR  72  -7.711  -9.666  -2.129
  580    H    ILE  73           H        ILE  73  -8.989  -3.619  -6.790
  581    HA   ILE  73           HA       ILE  73  -6.487  -4.725  -5.683
  582    HB   ILE  73           HB       ILE  73  -6.977  -1.772  -5.691
  583   1HG1  ILE  73          2HG1      ILE  73  -6.721  -3.452  -8.205
  584   2HG1  ILE  73          1HG1      ILE  73  -8.043  -2.362  -7.791
  585   1HG2  ILE  73          2HG2      ILE  73  -4.749  -3.706  -6.064
  586   2HG2  ILE  73          1HG2      ILE  73  -4.621  -2.166  -6.912
  587   3HG2  ILE  73          3HG2      ILE  73  -4.791  -2.193  -5.158
  588   1HD1  ILE  73          3HD1      ILE  73  -5.182  -1.410  -8.067
  589   2HD1  ILE  73          2HD1      ILE  73  -6.308  -1.438  -9.427
  590   3HD1  ILE  73          1HD1      ILE  73  -6.650  -0.432  -8.019
  591    H    THR  74           H        THR  74  -9.430  -3.224  -4.715
  592    HA   THR  74           HA       THR  74  -8.640  -3.511  -1.866
  593    HB   THR  74           HB       THR  74  -8.763  -1.261  -1.659
  594    HG1  THR  74           HG1      THR  74 -10.634  -0.999  -0.814
  595   1HG2  THR  74          3HG2      THR  74  -8.658  -1.107  -4.193
  596   2HG2  THR  74          2HG2      THR  74 -10.420  -1.025  -4.178
  597   3HG2  THR  74          1HG2      THR  74  -9.471   0.239  -3.394
  598    H    THR  75           H        THR  75 -10.275  -4.410  -0.620
  599    HA   THR  75           HA       THR  75 -12.222  -5.998  -1.983
  600    HB   THR  75           HB       THR  75 -13.081  -6.502   0.291
  601    HG1  THR  75           HG1      THR  75 -12.867  -4.876   1.607
  602   1HG2  THR  75          2HG2      THR  75 -10.459  -6.880  -0.766
  603   2HG2  THR  75          1HG2      THR  75 -10.316  -6.664   0.982
  604   3HG2  THR  75          3HG2      THR  75 -11.354  -7.935   0.333
  605    H    ARG  76           H        ARG  76 -12.336  -2.708  -1.420
  606    HA   ARG  76           HA       ARG  76 -15.204  -2.534  -0.894
  607   1HB   ARG  76          2HB       ARG  76 -13.870  -0.754  -0.004
  608   2HB   ARG  76          1HB       ARG  76 -13.086  -0.479  -1.559
  609   1HG   ARG  76          2HG       ARG  76 -14.889   0.658  -2.423
  610   2HG   ARG  76          1HG       ARG  76 -16.058  -0.285  -1.499
  611   1HD   ARG  76          2HD       ARG  76 -15.492   0.926   0.538
  612   2HD   ARG  76          1HD       ARG  76 -14.205   1.795  -0.299
  613    HE   ARG  76           HE       ARG  76 -15.965   3.326  -0.709
  614   1HH1  ARG  76          1HH2      ARG  76 -16.591   2.236  -3.276
  615   2HH1  ARG  76          2HH2      ARG  76 -18.235   1.706  -3.142
  616   1HH2  ARG  76          2HH1      ARG  76 -18.233   1.707   0.325
  617   2HH2  ARG  76          1HH1      ARG  76 -19.164   1.406  -1.104
  618    H    ALA  77           H        ALA  77 -13.345  -3.176  -3.669
  619    HA   ALA  77           HA       ALA  77 -15.719  -2.758  -5.344
  620   1HB   ALA  77          3HB       ALA  77 -13.278  -1.022  -5.579
  621   2HB   ALA  77          2HB       ALA  77 -14.271  -1.365  -6.997
  622   3HB   ALA  77          1HB       ALA  77 -14.979  -0.555  -5.599
  623    H    GLN  78           H        GLN  78 -15.652  -4.878  -6.066
  624    HA   GLN  78           HA       GLN  78 -13.184  -5.837  -7.397
  625   1HB   GLN  78          2HB       GLN  78 -15.645  -7.399  -6.564
  626   2HB   GLN  78          1HB       GLN  78 -14.134  -8.059  -7.178
  627   1HG   GLN  78          2HG       GLN  78 -13.417  -8.178  -5.037
  628   2HG   GLN  78          1HG       GLN  78 -13.388  -6.415  -5.027
  629   1HE2  GLN  78          2HE2      GLN  78 -15.621  -6.924  -2.263
  630   2HE2  GLN  78          1HE2      GLN  78 -13.985  -6.708  -2.657
  631    H    PHE  79           H        PHE  79 -13.677  -7.135  -9.463
  632    HA   PHE  79           HA       PHE  79 -16.173  -6.314 -10.833
  633   1HB   PHE  79          2HB       PHE  79 -13.388  -5.542 -11.707
  634   2HB   PHE  79          1HB       PHE  79 -14.734  -5.619 -12.847
  635    HD1  PHE  79           HD1      PHE  79 -13.713  -4.149  -9.579
  636    HD2  PHE  79           HD2      PHE  79 -16.267  -3.829 -13.013
  637    HE1  PHE  79           HE1      PHE  79 -14.520  -1.966  -8.768
  638    HE2  PHE  79           HE2      PHE  79 -17.072  -1.625 -12.206
  639    HZ   PHE  79           HZ       PHE  79 -16.201  -0.691 -10.077
  640    H    GLU  80           H        GLU  80 -15.445  -7.199 -13.396
  641    HA   GLU  80           HA       GLU  80 -15.216 -10.094 -12.822
  642   1HB   GLU  80          2HB       GLU  80 -16.122 -10.317 -15.165
  643   2HB   GLU  80          1HB       GLU  80 -17.190  -9.467 -14.051
  644   1HG   GLU  80          2HG       GLU  80 -15.354  -7.613 -15.298
  645   2HG   GLU  80          1HG       GLU  80 -16.244  -8.519 -16.521
  646    H    THR  81           H        THR  81 -13.590  -7.501 -14.579
  647    HA   THR  81           HA       THR  81 -11.358  -9.394 -15.081
  648    HB   THR  81           HB       THR  81 -12.104  -9.631 -17.237
  649    HG1  THR  81           HG1      THR  81 -11.486  -7.068 -17.960
  650   1HG2  THR  81          3HG2      THR  81 -14.203  -8.323 -16.594
  651   2HG2  THR  81          2HG2      THR  81 -13.356  -6.901 -17.200
  652   3HG2  THR  81          1HG2      THR  81 -13.719  -8.240 -18.288
  653    H    LEU  82           H        LEU  82  -9.534  -7.955 -16.272
  654    HA   LEU  82           HA       LEU  82  -8.986  -5.781 -14.395
  655   1HB   LEU  82          2HB       LEU  82  -7.465  -7.225 -16.520
  656   2HB   LEU  82          1HB       LEU  82  -6.939  -5.590 -16.117
  657    HG   LEU  82           HG       LEU  82  -7.526  -7.470 -13.866
  658   1HD1  LEU  82          1HD1      LEU  82  -5.964  -8.459 -15.819
  659   2HD1  LEU  82          3HD1      LEU  82  -4.755  -7.496 -14.962
  660   3HD1  LEU  82          2HD1      LEU  82  -5.653  -8.761 -14.110
  661   1HD2  LEU  82          1HD2      LEU  82  -6.637  -4.908 -13.989
  662   2HD2  LEU  82          3HD2      LEU  82  -6.246  -6.008 -12.666
  663   3HD2  LEU  82          2HD2      LEU  82  -5.099  -5.771 -13.985
  664    H    GLN  83           H        GLN  83  -9.936  -6.161 -17.748
  665    HA   GLN  83           HA       GLN  83  -9.591  -3.375 -18.446
  666   1HB   GLN  83          2HB       GLN  83  -9.925  -5.586 -19.937
  667   2HB   GLN  83          1HB       GLN  83 -11.603  -5.043 -19.878
  668   1HG   GLN  83          2HG       GLN  83  -9.882  -2.782 -20.358
  669   2HG   GLN  83          1HG       GLN  83  -9.527  -4.049 -21.534
  670   1HE2  GLN  83          2HE2      GLN  83 -13.005  -4.051 -22.736
  671   2HE2  GLN  83          1HE2      GLN  83 -11.842  -5.181 -22.235
  672    H    GLN  84           H        GLN  84 -12.201  -5.361 -17.162
  673    HA   GLN  84           HA       GLN  84 -14.248  -3.335 -17.415
  674   1HB   GLN  84          2HB       GLN  84 -14.020  -5.905 -15.867
  675   2HB   GLN  84          1HB       GLN  84 -15.395  -4.834 -15.651
  676   1HG   GLN  84          2HG       GLN  84 -15.449  -6.772 -17.480
  677   2HG   GLN  84          1HG       GLN  84 -16.221  -5.221 -17.774
  678   1HE2  GLN  84          2HE2      GLN  84 -13.812  -4.183 -20.216
  679   2HE2  GLN  84          1HE2      GLN  84 -14.959  -3.615 -19.102
  680    H    LEU  85           H        LEU  85 -11.894  -4.177 -14.934
  681    HA   LEU  85           HA       LEU  85 -13.103  -2.344 -12.985
  682   1HB   LEU  85          2HB       LEU  85 -11.650  -3.236 -11.475
  683   2HB   LEU  85          1HB       LEU  85 -11.446  -4.487 -12.696
  684    HG   LEU  85           HG       LEU  85  -9.652  -2.578 -13.530
  685   1HD1  LEU  85          1HD1      LEU  85 -10.304  -1.969 -10.824
  686   2HD1  LEU  85          3HD1      LEU  85  -8.672  -2.642 -10.850
  687   3HD1  LEU  85          2HD1      LEU  85  -9.061  -1.231 -11.836
  688   1HD2  LEU  85          1HD2      LEU  85  -9.669  -5.208 -12.628
  689   2HD2  LEU  85          3HD2      LEU  85  -8.324  -4.361 -13.390
  690   3HD2  LEU  85          2HD2      LEU  85  -8.458  -4.399 -11.631
  691    H    VAL  86           H        VAL  86 -10.440  -2.218 -15.318
  692    HA   VAL  86           HA       VAL  86  -9.539   0.358 -14.466
  693    HB   VAL  86           HB       VAL  86  -8.599   0.549 -16.769
  694   1HG1  VAL  86          1HG1      VAL  86  -8.050  -1.470 -14.827
  695   2HG1  VAL  86          3HG1      VAL  86  -7.854  -2.196 -16.422
  696   3HG1  VAL  86          2HG1      VAL  86  -6.934  -0.755 -15.990
  697   1HG2  VAL  86          2HG2      VAL  86 -10.604  -0.550 -17.825
  698   2HG2  VAL  86          1HG2      VAL  86  -9.057  -1.178 -18.402
  699   3HG2  VAL  86          3HG2      VAL  86  -9.995  -2.090 -17.221
  700    H    GLN  87           H        GLN  87 -12.237  -0.858 -16.183
  701    HA   GLN  87           HA       GLN  87 -13.077   1.528 -17.520
  702   1HB   GLN  87          2HB       GLN  87 -13.857  -0.819 -17.999
  703   2HB   GLN  87          1HB       GLN  87 -14.812  -0.731 -16.527
  704   1HG   GLN  87          2HG       GLN  87 -16.164   1.012 -17.360
  705   2HG   GLN  87          1HG       GLN  87 -15.042   1.374 -18.672
  706   1HE2  GLN  87          2HE2      GLN  87 -17.958  -1.312 -19.297
  707   2HE2  GLN  87          1HE2      GLN  87 -17.913  -0.290 -17.944
  708    H    HIS  88           H        HIS  88 -13.992   0.043 -14.429
  709    HA   HIS  88           HA       HIS  88 -15.849   2.151 -13.767
  710   1HB   HIS  88          2HB       HIS  88 -15.766  -0.311 -12.922
  711   2HB   HIS  88          1HB       HIS  88 -14.598   0.304 -11.757
  712    HD1  HIS  88           HD1      HIS  88 -15.463   2.255 -10.146
  713    HD2  HIS  88           HD2      HIS  88 -18.432   0.332 -12.353
  714    HE1  HIS  88           HE1      HIS  88 -17.672   2.874  -9.070
  715    H    TYR  89           H        TYR  89 -12.589   1.273 -12.793
  716    HA   TYR  89           HA       TYR  89 -12.277   3.485 -10.988
  717   1HB   TYR  89          2HB       TYR  89 -10.325   1.615 -12.302
  718   2HB   TYR  89          1HB       TYR  89  -9.822   2.873 -11.182
  719    HD1  TYR  89           HD1      TYR  89 -12.273   0.063 -11.460
  720    HD2  TYR  89           HD2      TYR  89  -9.728   2.369  -8.894
  721    HE1  TYR  89           HE1      TYR  89 -12.804  -1.446  -9.602
  722    HE2  TYR  89           HE2      TYR  89 -10.268   0.851  -7.006
  723    HH   TYR  89           HH       TYR  89 -11.546  -2.119  -7.350
  724    H    SER  90           H        SER  90 -12.290   3.228 -14.354
  725    HA   SER  90           HA       SER  90 -10.346   5.181 -15.072
  726   1HB   SER  90          2HB       SER  90 -12.319   3.596 -16.392
  727   2HB   SER  90          1HB       SER  90 -12.552   5.273 -16.882
  728    HG   SER  90           HG       SER  90 -10.810   5.132 -18.016
  729    H    GLU  91           H        GLU  91 -13.528   5.319 -13.777
  730    HA   GLU  91           HA       GLU  91 -13.581   8.284 -14.143
  731   1HB   GLU  91          2HB       GLU  91 -15.922   6.559 -13.313
  732   2HB   GLU  91          1HB       GLU  91 -15.954   8.195 -13.971
  733   1HG   GLU  91          2HG       GLU  91 -14.720   7.006 -16.014
  734   2HG   GLU  91          1HG       GLU  91 -15.557   5.589 -15.381
  735    H    ARG  92           H        ARG  92 -13.207   5.708 -11.913
  736    HA   ARG  92           HA       ARG  92 -13.283   7.706  -9.685
  737   1HB   ARG  92          2HB       ARG  92 -14.183   4.882  -9.202
  738   2HB   ARG  92          1HB       ARG  92 -14.559   6.341  -8.287
  739   1HG   ARG  92          2HG       ARG  92 -15.640   7.019 -10.669
  740   2HG   ARG  92          1HG       ARG  92 -15.834   5.268 -10.749
  741   1HD   ARG  92          2HD       ARG  92 -17.387   5.241  -9.078
  742   2HD   ARG  92          1HD       ARG  92 -16.550   6.485  -8.150
  743    HE   ARG  92           HE       ARG  92 -17.539   8.112  -9.894
  744   1HH1  ARG  92          1HH2      ARG  92 -19.146   6.964 -11.728
  745   2HH1  ARG  92          2HH2      ARG  92 -20.662   6.603 -10.970
  746   1HH2  ARG  92          2HH1      ARG  92 -19.407   6.836  -7.746
  747   2HH2  ARG  92          1HH1      ARG  92 -20.809   6.531  -8.716
  748    H    ALA  93           H        ALA  93 -11.838   7.176  -7.920
  749    HA   ALA  93           HA       ALA  93  -9.551   5.534  -8.822
  750   1HB   ALA  93          3HB       ALA  93  -9.276   7.859  -7.807
  751   2HB   ALA  93          2HB       ALA  93  -9.757   7.144  -6.268
  752   3HB   ALA  93          1HB       ALA  93  -8.290   6.591  -7.077
  753    H    ALA  94           H        ALA  94 -11.781   5.767  -6.082
  754    HA   ALA  94           HA       ALA  94 -12.744   3.920  -4.914
  755   1HB   ALA  94          1HB       ALA  94 -11.691   2.437  -6.788
  756   2HB   ALA  94          3HB       ALA  94 -10.381   2.198  -5.632
  757   3HB   ALA  94          2HB       ALA  94 -12.025   1.709  -5.218
  758    H    GLY  95           H        GLY  95  -9.529   5.156  -4.802
  759   1HA   GLY  95          2HA       GLY  95  -9.219   5.938  -2.310
  760   2HA   GLY  95          1HA       GLY  95  -9.215   4.205  -2.004
  761    H    LEU  96           H        LEU  96  -7.766   4.036  -4.810
  762    HA   LEU  96           HA       LEU  96  -5.111   4.043  -3.611
  763   1HB   LEU  96          2HB       LEU  96  -4.354   3.017  -5.597
  764   2HB   LEU  96          1HB       LEU  96  -5.970   2.369  -5.345
  765    HG   LEU  96           HG       LEU  96  -5.225   4.641  -7.193
  766   1HD1  LEU  96          3HD1      LEU  96  -5.954   1.745  -7.630
  767   2HD1  LEU  96          2HD1      LEU  96  -5.926   2.942  -8.928
  768   3HD1  LEU  96          1HD1      LEU  96  -4.439   2.542  -8.062
  769   1HD2  LEU  96          3HD2      LEU  96  -7.846   3.309  -6.530
  770   2HD2  LEU  96          2HD2      LEU  96  -7.461   5.029  -6.466
  771   3HD2  LEU  96          1HD2      LEU  96  -7.605   4.214  -8.024
  772    H    SER  97           H        SER  97  -3.430   4.845  -5.585
  773    HA   SER  97           HA       SER  97  -3.061   7.559  -5.175
  774   1HB   SER  97          2HB       SER  97  -2.206   5.677  -7.330
  775   2HB   SER  97          1HB       SER  97  -1.922   7.402  -7.567
  776    HG   SER  97           HG       SER  97  -0.899   7.392  -5.491
  777    H    SER  98           H        SER  98  -4.696   6.107  -8.007
  778    HA   SER  98           HA       SER  98  -6.786   7.968  -8.151
  779   1HB   SER  98          2HB       SER  98  -4.250   9.153  -8.857
  780   2HB   SER  98          1HB       SER  98  -5.346   9.194 -10.237
  781    HG   SER  98           HG       SER  98  -5.467  10.970  -8.630
  782    H    ARG  99           H        ARG  99  -8.004   6.467  -9.179
  783    HA   ARG  99           HA       ARG  99  -8.661   4.880 -10.807
  784   1HB   ARG  99          2HB       ARG  99  -7.715   7.161 -12.560
  785   2HB   ARG  99          1HB       ARG  99  -8.922   5.947 -12.980
  786   1HG   ARG  99          2HG       ARG  99 -10.335   6.732 -11.092
  787   2HG   ARG  99          1HG       ARG  99  -9.141   7.980 -10.738
  788   1HD   ARG  99          2HD       ARG  99 -10.064   7.858 -13.552
  789   2HD   ARG  99          1HD       ARG  99 -11.276   8.370 -12.377
  790    HE   ARG  99           HE       ARG  99  -8.899   9.881 -13.162
  791   1HH1  ARG  99          2HH1      ARG  99 -11.894  10.008 -11.706
  792   2HH1  ARG  99          1HH1      ARG  99 -11.489  11.233 -10.550
  793   1HH2  ARG  99          1HH2      ARG  99  -8.096  11.154 -11.258
  794   2HH2  ARG  99          2HH2      ARG  99  -9.340  11.882 -10.296
  795    H    LEU 100           H        LEU 100  -7.849   4.424 -13.391
  796    HA   LEU 100           HA       LEU 100  -5.477   2.798 -12.966
  797   1HB   LEU 100          2HB       LEU 100  -6.494   3.328 -15.732
  798   2HB   LEU 100          1HB       LEU 100  -5.900   1.828 -15.030
  799    HG   LEU 100           HG       LEU 100  -8.141   1.350 -15.145
  800   1HD1  LEU 100          1HD1      LEU 100  -7.246   1.904 -12.596
  801   2HD1  LEU 100          3HD1      LEU 100  -8.763   2.798 -12.687
  802   3HD1  LEU 100          2HD1      LEU 100  -8.744   1.058 -12.991
  803   1HD2  LEU 100          3HD2      LEU 100  -8.382   4.274 -15.168
  804   2HD2  LEU 100          2HD2      LEU 100  -9.306   3.060 -16.050
  805   3HD2  LEU 100          1HD2      LEU 100  -9.720   3.444 -14.380
  806    H    VAL 101           H        VAL 101  -4.645   3.400 -15.893
  807    HA   VAL 101           HA       VAL 101  -2.577   5.346 -15.182
  808    HB   VAL 101           HB       VAL 101  -2.127   3.301 -16.560
  809   1HG1  VAL 101          2HG1      VAL 101  -4.361   4.376 -18.029
  810   2HG1  VAL 101          1HG1      VAL 101  -2.965   4.242 -19.098
  811   3HG1  VAL 101          3HG1      VAL 101  -3.555   2.821 -18.236
  812   1HG2  VAL 101          1HG2      VAL 101  -1.015   5.769 -16.791
  813   2HG2  VAL 101          3HG2      VAL 101  -0.447   4.349 -17.673
  814   3HG2  VAL 101          2HG2      VAL 101  -1.543   5.494 -18.452
  815    H    VAL 102           H        VAL 102  -5.076   6.610 -15.101
  816    HA   VAL 102           HA       VAL 102  -6.139   8.534 -15.920
  817    HB   VAL 102           HB       VAL 102  -3.551   8.688 -17.494
  818   1HG1  VAL 102          1HG1      VAL 102  -5.563   9.958 -18.450
  819   2HG1  VAL 102          3HG1      VAL 102  -5.497  10.942 -16.988
  820   3HG1  VAL 102          2HG1      VAL 102  -4.125  10.915 -18.096
  821   1HG2  VAL 102          1HG2      VAL 102  -4.195   9.131 -14.756
  822   2HG2  VAL 102          3HG2      VAL 102  -2.663   9.443 -15.573
  823   3HG2  VAL 102          2HG2      VAL 102  -3.891  10.705 -15.489
  824    HA   PRO 103           HA       PRO 103  -8.123   6.978 -19.540
  825   1HB   PRO 103          2HB       PRO 103  -9.807   9.114 -19.959
  826   2HB   PRO 103          1HB       PRO 103 -10.072   7.881 -18.716
  827   1HG   PRO 103          2HG       PRO 103  -9.097  10.691 -18.413
  828   2HG   PRO 103          1HG       PRO 103  -9.977   9.682 -17.257
  829   1HD   PRO 103          2HD       PRO 103  -7.200  10.206 -17.213
  830   2HD   PRO 103          1HD       PRO 103  -8.026   8.928 -16.301
  831    H    SER 104           H        SER 104  -6.982  10.363 -19.573
  832    HA   SER 104           HA       SER 104  -6.071   9.912 -22.378
  833   1HB   SER 104          2HB       SER 104  -8.134  11.700 -21.535
  834   2HB   SER 104          1HB       SER 104  -6.748  12.670 -22.036
  835    HG   SER 104           HG       SER 104  -7.453  10.497 -23.624
  836    H    HIS 105           H        HIS 105  -4.025   9.520 -21.094
  837    HA   HIS 105           HA       HIS 105  -2.652  11.185 -19.425
  838   1HB   HIS 105          2HB       HIS 105  -1.882   9.327 -21.545
  839   2HB   HIS 105          1HB       HIS 105  -0.691  10.609 -21.307
  840    HD1  HIS 105           HD1      HIS 105   0.608   8.288 -20.347
  841    HD2  HIS 105           HD2      HIS 105  -2.347  10.032 -17.986
  842    HE1  HIS 105           HE1      HIS 105   0.981   7.431 -17.992
  843    H    LYS 106           HN       LYS 106  -1.709  13.185 -19.486
  844    HA   LYS 106           HA       LYS 106  -0.843  14.580 -21.772
  845   1HB   LYS 106          2HB       LYS 106  -3.450  14.446 -22.096
  846   2HB   LYS 106          1HB       LYS 106  -3.473  15.732 -20.890
  847   1HG   LYS 106          2HG       LYS 106  -1.459  16.522 -22.637
  848   2HG   LYS 106          1HG       LYS 106  -2.685  15.839 -23.706
  849   1HD   LYS 106          2HD       LYS 106  -4.390  17.246 -22.429
  850   2HD   LYS 106          1HD       LYS 106  -3.017  18.073 -21.692
  851   1HE   LYS 106          2HE       LYS 106  -2.575  19.246 -23.580
  852   2HE   LYS 106          1HE       LYS 106  -2.789  17.829 -24.608
  853   1HZ   LYS 106          2HZ       LYS 106  -5.214  18.099 -24.307
  854   2HZ   LYS 106          1HZ       LYS 106  -4.923  19.559 -23.488
  855   3HZ   LYS 106          3HZ       LYS 106  -4.487  19.402 -25.119
  856   1H    GLU 201          2HT       GLU 201   7.658  -0.819   7.015
  857   2H    GLU 201          1HT       GLU 201   8.847  -0.022   6.100
  858   3H    GLU 201          3HT       GLU 201   7.915   0.848   7.218
  859    HA   GLU 201           HA       GLU 201   6.103   0.957   5.882
  860   1HB   GLU 201          2HB       GLU 201   8.626   0.883   4.312
  861   2HB   GLU 201          1HB       GLU 201   7.129   0.793   3.382
  862   1HG   GLU 201          2HG       GLU 201   6.303   2.820   4.576
  863   2HG   GLU 201          1HG       GLU 201   7.857   2.933   5.404
  864    HA   PRO 202           HA       PRO 202   4.510  -2.920   4.573
  865   1HB   PRO 202          2HB       PRO 202   2.459  -2.009   2.987
  866   2HB   PRO 202          1HB       PRO 202   2.419  -1.967   4.757
  867   1HG   PRO 202          2HG       PRO 202   2.832   0.277   2.836
  868   2HG   PRO 202          1HG       PRO 202   2.172   0.314   4.480
  869   1HD   PRO 202          2HD       PRO 202   4.798   1.064   3.729
  870   2HD   PRO 202          1HD       PRO 202   4.227   0.779   5.388
  871    H    GLN 203           H        GLN 203   4.082  -4.204   2.547
  872    HA   GLN 203           HA       GLN 203   6.074  -3.552   0.494
  873   1HB   GLN 203          2HB       GLN 203   5.622  -5.892   1.397
  874   2HB   GLN 203          1HB       GLN 203   4.112  -5.857   0.484
  875   1HG   GLN 203          2HG       GLN 203   5.543  -6.840  -1.067
  876   2HG   GLN 203          1HG       GLN 203   5.686  -5.138  -1.509
  877   1HE2  GLN 203          2HE2      GLN 203   9.076  -6.864  -0.837
  878   2HE2  GLN 203          1HE2      GLN 203   7.704  -7.473  -1.629
  879   1HN   PTR 204          1HN       PTR 204   2.678  -3.148   0.952
  880    HA   PTR 204           HA       PTR 204   2.483  -1.936  -1.735
  881   1HB   PTR 204          1HB       PTR 204   0.189  -3.233  -1.919
  882    HD1  PTR 204           HD1      PTR 204   1.412  -2.514  -4.067
  883    HD2  PTR 204           HD2      PTR 204   2.540  -5.942  -1.731
  884    HE1  PTR 204           HE1      PTR 204   2.659  -3.433  -6.007
  885    HE2  PTR 204           HE2      PTR 204   3.784  -6.856  -3.670
  886    H    GLU 205           H        GLU 205  -0.066  -1.210  -1.879
  887    HA   GLU 205           HA       GLU 205  -0.688   0.032   0.772
  888   1HB   GLU 205          2HB       GLU 205  -0.781   1.220  -2.007
  889   2HB   GLU 205          1HB       GLU 205  -1.655   1.936  -0.652
  890   1HG   GLU 205          2HG       GLU 205   0.688   1.725   0.560
  891   2HG   GLU 205          1HG       GLU 205   1.301   1.715  -1.094
  892    H    GLU 206           H        GLU 206  -2.541  -0.893   1.502
  893    HA   GLU 206           HA       GLU 206  -4.642  -1.588  -0.510
  894   1HB   GLU 206          2HB       GLU 206  -5.502  -3.073   1.406
  895   2HB   GLU 206          1HB       GLU 206  -4.010  -3.585   0.617
  896   1HG   GLU 206          2HG       GLU 206  -2.667  -2.861   2.409
  897   2HG   GLU 206          1HG       GLU 206  -3.927  -1.803   3.044
  898    H    ILE 207           H        ILE 207  -6.334  -0.197  -0.496
  899    HA   ILE 207           HA       ILE 207  -6.689   1.857   1.445
  900    HB   ILE 207           HB       ILE 207  -8.679   0.646  -0.496
  901   1HG1  ILE 207          2HG1      ILE 207  -7.814   3.281  -1.173
  902   2HG1  ILE 207          1HG1      ILE 207  -6.376   2.319  -0.829
  903   1HG2  ILE 207          1HG2      ILE 207  -9.633   1.951   1.489
  904   2HG2  ILE 207          3HG2      ILE 207  -8.812   3.364   0.825
  905   3HG2  ILE 207          2HG2      ILE 207 -10.066   2.551  -0.112
  906   1HD1  ILE 207          2HD1      ILE 207  -7.840   0.544  -2.298
  907   2HD1  ILE 207          1HD1      ILE 207  -8.323   2.070  -3.039
  908   3HD1  ILE 207          3HD1      ILE 207  -6.619   1.618  -2.982
  909    HA   PRO 208           HA       PRO 208  -8.682  -0.434   4.653
  910   1HB   PRO 208          2HB       PRO 208  -9.567   1.729   6.100
  911   2HB   PRO 208          1HB       PRO 208  -7.883   1.178   6.097
  912   1HG   PRO 208          2HG       PRO 208  -9.081   3.555   4.755
  913   2HG   PRO 208          1HG       PRO 208  -7.417   3.296   5.302
  914   1HD   PRO 208          2HD       PRO 208  -8.339   3.095   2.630
  915   2HD   PRO 208          1HD       PRO 208  -6.767   2.536   3.240
  916    H    ILE 209           H        ILE 209 -10.968   0.016   5.946
  917    HA   ILE 209           HA       ILE 209 -13.061   0.909   4.053
  918    HB   ILE 209           HB       ILE 209 -12.648  -1.525   3.587
  919   1HG1  ILE 209          2HG1      ILE 209 -15.253  -1.909   4.640
  920   2HG1  ILE 209          1HG1      ILE 209 -15.128  -0.200   4.223
  921   1HG2  ILE 209          3HG2      ILE 209 -12.018  -2.056   5.973
  922   2HG2  ILE 209          2HG2      ILE 209 -13.726  -1.919   6.391
  923   3HG2  ILE 209          1HG2      ILE 209 -13.190  -3.172   5.271
  924   1HD1  ILE 209          3HD1      ILE 209 -13.900  -1.802   2.160
  925   2HD1  ILE 209          2HD1      ILE 209 -15.547  -2.360   2.452
  926   3HD1  ILE 209          1HD1      ILE 209 -15.249  -0.674   2.027
  927    H    TYR 210           H        TYR 210 -11.848   1.340   6.915
  928    HA   TYR 210           HA       TYR 210 -14.096   0.817   8.684
  929   1HB   TYR 210          2HB       TYR 210 -12.032   2.870   9.355
  930   2HB   TYR 210          1HB       TYR 210 -12.734   1.613  10.366
  931    HD1  TYR 210           HD1      TYR 210 -12.171  -0.863   9.698
  932    HD2  TYR 210           HD2      TYR 210  -9.886   2.560   8.468
  933    HE1  TYR 210           HE1      TYR 210 -10.222  -2.327   9.243
  934    HE2  TYR 210           HE2      TYR 210  -7.937   1.096   8.013
  935    HH   TYR 210           HH       TYR 210  -8.120  -2.428   8.558
  936    H    LEU 211           HN       LEU 211 -14.550   3.096  10.074
  937    HA   LEU 211           HA       LEU 211 -15.259   5.198   8.093
  938   1HB   LEU 211          2HB       LEU 211 -17.128   3.355   9.010
  939   2HB   LEU 211          1HB       LEU 211 -17.378   4.751  10.059
  940    HG   LEU 211           HG       LEU 211 -18.769   4.949   8.045
  941   1HD1  LEU 211          3HD1      LEU 211 -16.568   6.826   8.674
  942   2HD1  LEU 211          2HD1      LEU 211 -17.337   7.073   7.106
  943   3HD1  LEU 211          1HD1      LEU 211 -18.305   7.119   8.579
  944   1HD2  LEU 211          1HD2      LEU 211 -16.498   3.827   6.794
  945   2HD2  LEU 211          3HD2      LEU 211 -18.010   4.306   6.024
  946   3HD2  LEU 211          2HD2      LEU 211 -16.670   5.448   6.123
   
  No H/Q in entry =         946
  Start of MODEL    9
    1   1H    SER   1          3HT       SER   1  -3.625 -10.144 -23.068
    2   2H    SER   1          2HT       SER   1  -3.132  -9.610 -24.604
    3   3H    SER   1          1HT       SER   1  -1.987 -10.211 -23.503
    4    HA   SER   1           HA       SER   1  -2.128  -8.350 -22.125
    5   1HB   SER   1          2HB       SER   1  -1.367  -8.120 -24.757
    6   2HB   SER   1          1HB       SER   1  -2.535  -6.809 -24.603
    7    HG   SER   1           HG       SER   1  -0.434  -6.148 -24.013
    8    H    ILE   2           H        ILE   2  -3.656  -7.380 -20.889
    9    HA   ILE   2           HA       ILE   2  -6.415  -7.245 -21.641
   10    HB   ILE   2           HB       ILE   2  -5.145  -5.504 -19.529
   11   1HG1  ILE   2          2HG1      ILE   2  -6.028  -7.979 -18.428
   12   2HG1  ILE   2          1HG1      ILE   2  -4.947  -8.355 -19.771
   13   1HG2  ILE   2          1HG2      ILE   2  -7.841  -6.629 -20.138
   14   2HG2  ILE   2          3HG2      ILE   2  -7.384  -6.479 -18.440
   15   3HG2  ILE   2          2HG2      ILE   2  -7.405  -5.052 -19.478
   16   1HD1  ILE   2          1HD1      ILE   2  -3.328  -6.667 -18.802
   17   2HD1  ILE   2          3HD1      ILE   2  -4.365  -6.593 -17.379
   18   3HD1  ILE   2          2HD1      ILE   2  -3.571  -8.107 -17.814
   19    H    GLN   3           H        GLN   3  -4.435  -4.388 -20.828
   20    HA   GLN   3           HA       GLN   3  -6.014  -2.836 -22.787
   21   1HB   GLN   3          2HB       GLN   3  -5.686  -1.762 -20.655
   22   2HB   GLN   3          1HB       GLN   3  -3.944  -2.017 -20.730
   23   1HG   GLN   3          2HG       GLN   3  -4.778   0.325 -21.351
   24   2HG   GLN   3          1HG       GLN   3  -3.703  -0.444 -22.516
   25   1HE2  GLN   3          2HE2      GLN   3  -6.191   0.378 -24.917
   26   2HE2  GLN   3          1HE2      GLN   3  -4.627   0.713 -24.349
   27    H    ALA   4           H        ALA   4  -2.673  -1.985 -22.183
   28    HA   ALA   4           HA       ALA   4  -1.497  -3.259 -24.455
   29   1HB   ALA   4          1HB       ALA   4  -3.019  -0.773 -24.887
   30   2HB   ALA   4          3HB       ALA   4  -1.420  -0.823 -25.628
   31   3HB   ALA   4          2HB       ALA   4  -2.616  -2.057 -26.028
   32    H    GLU   5           H        GLU   5  -0.724  -2.585 -21.792
   33    HA   GLU   5           HA       GLU   5   1.362  -2.013 -20.828
   34   1HB   GLU   5          2HB       GLU   5   2.027  -0.370 -23.260
   35   2HB   GLU   5          1HB       GLU   5   3.124  -1.172 -22.136
   36   1HG   GLU   5          2HG       GLU   5   1.671  -3.298 -23.048
   37   2HG   GLU   5          1HG       GLU   5   1.687  -2.267 -24.478
   38    H    GLU   6           H        GLU   6  -1.227  -0.205 -21.315
   39    HA   GLU   6           HA       GLU   6  -0.123   2.454 -20.725
   40   1HB   GLU   6          2HB       GLU   6  -2.741   1.319 -21.391
   41   2HB   GLU   6          1HB       GLU   6  -2.833   2.524 -20.107
   42   1HG   GLU   6          2HG       GLU   6  -1.367   4.004 -21.606
   43   2HG   GLU   6          1HG       GLU   6  -1.723   2.857 -22.899
   44    H    TRP   7           H        TRP   7  -2.624   0.672 -18.960
   45    HA   TRP   7           HA       TRP   7  -1.341   1.495 -16.410
   46   1HB   TRP   7          2HB       TRP   7  -3.581   0.743 -15.447
   47   2HB   TRP   7          1HB       TRP   7  -3.664   2.141 -16.518
   48    HD1  TRP   7           HD1      TRP   7  -4.986   1.904 -18.737
   49    HE1  TRP   7           HE1      TRP   7  -6.396   0.021 -19.791
   50    HE3  TRP   7           HE3      TRP   7  -3.745  -1.967 -15.644
   51    HZ2  TRP   7           HZ2      TRP   7  -6.923  -2.759 -19.381
   52    HZ3  TRP   7           HZ3      TRP   7  -4.716  -4.220 -16.003
   53    HH2  TRP   7           HH2      TRP   7  -6.299  -4.620 -17.865
   54    H    TYR   8           H        TYR   8  -1.230  -1.001 -18.504
   55    HA   TYR   8           HA       TYR   8  -0.526  -2.928 -16.401
   56   1HB   TYR   8          2HB       TYR   8  -2.636  -3.792 -16.630
   57   2HB   TYR   8          1HB       TYR   8  -2.854  -3.120 -18.239
   58    HD1  TYR   8           HD1      TYR   8  -1.959  -4.269 -20.231
   59    HD2  TYR   8           HD2      TYR   8  -1.638  -5.979 -16.294
   60    HE1  TYR   8           HE1      TYR   8  -1.388  -6.467 -21.228
   61    HE2  TYR   8           HE2      TYR   8  -1.056  -8.164 -17.297
   62    HH   TYR   8           HH       TYR   8  -0.998  -9.355 -19.211
   63    H    PHE   9           H        PHE   9   1.383  -3.780 -16.936
   64    HA   PHE   9           HA       PHE   9   2.311  -3.542 -19.740
   65   1HB   PHE   9          2HB       PHE   9   3.668  -3.956 -17.086
   66   2HB   PHE   9          1HB       PHE   9   4.520  -4.302 -18.588
   67    HD1  PHE   9           HD1      PHE   9   1.933  -1.665 -18.458
   68    HD2  PHE   9           HD2      PHE   9   6.152  -2.493 -18.200
   69    HE1  PHE   9           HE1      PHE   9   2.431   0.745 -18.727
   70    HE2  PHE   9           HE2      PHE   9   6.637  -0.080 -18.472
   71    HZ   PHE   9           HZ       PHE   9   4.779   1.538 -18.736
   72    H    GLY  10           H        GLY  10   1.756  -5.970 -17.218
   73   1HA   GLY  10          2HA       GLY  10   0.870  -8.117 -18.477
   74   2HA   GLY  10          1HA       GLY  10   2.507  -8.117 -19.128
   75    H    LYS  11           H        LYS  11   3.930  -9.317 -17.998
   76    HA   LYS  11           HA       LYS  11   3.305  -9.959 -15.154
   77   1HB   LYS  11          2HB       LYS  11   5.361 -11.440 -16.763
   78   2HB   LYS  11          1HB       LYS  11   4.332 -12.031 -15.458
   79   1HG   LYS  11          2HG       LYS  11   2.524 -11.212 -17.418
   80   2HG   LYS  11          1HG       LYS  11   3.826 -11.974 -18.335
   81   1HD   LYS  11          2HD       LYS  11   3.638 -14.006 -17.036
   82   2HD   LYS  11          1HD       LYS  11   2.498 -13.247 -15.925
   83   1HE   LYS  11          2HE       LYS  11   0.999 -14.328 -17.309
   84   2HE   LYS  11          1HE       LYS  11   1.157 -12.811 -18.195
   85   1HZ   LYS  11          2HZ       LYS  11   2.965 -15.085 -18.726
   86   2HZ   LYS  11          1HZ       LYS  11   1.445 -14.982 -19.477
   87   3HZ   LYS  11          3HZ       LYS  11   2.596 -13.762 -19.727
   88    H    LEU  12           H        LEU  12   4.210  -7.698 -14.874
   89    HA   LEU  12           HA       LEU  12   7.185  -7.647 -14.997
   90   1HB   LEU  12          2HB       LEU  12   5.814  -5.807 -16.068
   91   2HB   LEU  12          1HB       LEU  12   5.294  -5.349 -14.447
   92    HG   LEU  12           HG       LEU  12   7.577  -4.917 -13.774
   93   1HD1  LEU  12          1HD1      LEU  12   8.130  -6.537 -16.146
   94   2HD1  LEU  12          3HD1      LEU  12   9.099  -5.064 -16.101
   95   3HD1  LEU  12          2HD1      LEU  12   9.163  -6.199 -14.753
   96   1HD2  LEU  12          2HD2      LEU  12   6.513  -3.676 -16.265
   97   2HD2  LEU  12          1HD2      LEU  12   6.855  -2.941 -14.697
   98   3HD2  LEU  12          3HD2      LEU  12   8.174  -3.292 -15.816
   99    H    GLY  13           H        GLY  13   8.246  -6.473 -13.108
  100   1HA   GLY  13          2HA       GLY  13   6.946  -7.364 -10.569
  101   2HA   GLY  13          1HA       GLY  13   8.691  -7.243 -10.803
  102    H    ARG  14           H        ARG  14   8.524  -5.860  -8.810
  103    HA   ARG  14           HA       ARG  14   7.311  -3.197  -9.188
  104   1HB   ARG  14          2HB       ARG  14   8.194  -2.807  -6.872
  105   2HB   ARG  14          1HB       ARG  14   7.118  -4.197  -6.989
  106   1HG   ARG  14          2HG       ARG  14   8.759  -5.475  -6.123
  107   2HG   ARG  14          1HG       ARG  14   9.720  -5.152  -7.567
  108   1HD   ARG  14          2HD       ARG  14  10.340  -2.921  -6.398
  109   2HD   ARG  14          1HD       ARG  14   9.743  -3.692  -4.928
  110    HE   ARG  14           HE       ARG  14  11.537  -5.515  -6.111
  111   1HH1  ARG  14          2HH1      ARG  14  11.886  -2.169  -5.654
  112   2HH1  ARG  14          1HH1      ARG  14  13.363  -2.286  -4.756
  113   1HH2  ARG  14          1HH2      ARG  14  13.298  -5.749  -4.588
  114   2HH2  ARG  14          2HH2      ARG  14  14.162  -4.312  -4.153
  115    H    LYS  15           H        LYS  15  10.396  -4.707  -9.532
  116    HA   LYS  15           HA       LYS  15  11.998  -2.355  -9.196
  117   1HB   LYS  15          2HB       LYS  15  12.641  -4.939  -9.232
  118   2HB   LYS  15          1HB       LYS  15  12.906  -4.599 -10.942
  119   1HG   LYS  15          2HG       LYS  15  14.457  -2.802 -10.388
  120   2HG   LYS  15          1HG       LYS  15  14.121  -3.001  -8.668
  121   1HD   LYS  15          2HD       LYS  15  15.220  -5.083  -8.571
  122   2HD   LYS  15          1HD       LYS  15  15.135  -5.313 -10.317
  123   1HE   LYS  15          2HE       LYS  15  16.666  -3.314 -10.561
  124   2HE   LYS  15          1HE       LYS  15  16.872  -3.339  -8.809
  125   1HZ   LYS  15          2HZ       LYS  15  17.297  -5.916  -9.521
  126   2HZ   LYS  15          1HZ       LYS  15  18.001  -5.062 -10.810
  127   3HZ   LYS  15          3HZ       LYS  15  18.514  -4.768  -9.221
  128    H    ASP  16           H        ASP  16  10.530  -4.007 -11.961
  129    HA   ASP  16           HA       ASP  16  11.652  -2.124 -13.828
  130   1HB   ASP  16          2HB       ASP  16  10.924  -4.579 -14.254
  131   2HB   ASP  16          1HB       ASP  16   9.311  -3.895 -14.385
  132    H    ALA  17           H        ALA  17   8.467  -2.775 -12.435
  133    HA   ALA  17           HA       ALA  17   6.930  -0.845 -13.695
  134   1HB   ALA  17          2HB       ALA  17   6.934  -1.945 -10.917
  135   2HB   ALA  17          1HB       ALA  17   5.906  -0.553 -11.261
  136   3HB   ALA  17          3HB       ALA  17   5.689  -2.054 -12.161
  137    H    GLU  18           H        GLU  18   9.185  -0.366 -11.000
  138    HA   GLU  18           HA       GLU  18   8.683   2.481 -10.805
  139   1HB   GLU  18          2HB       GLU  18  10.789   2.502  -9.464
  140   2HB   GLU  18          1HB       GLU  18   9.657   1.265  -8.915
  141   1HG   GLU  18          2HG       GLU  18  10.881  -0.461 -10.095
  142   2HG   GLU  18          1HG       GLU  18  11.925   0.739 -10.857
  143    H    ARG  19           H        ARG  19  11.005   0.456 -12.558
  144    HA   ARG  19           HA       ARG  19  12.605   2.634 -13.552
  145   1HB   ARG  19          2HB       ARG  19  12.421  -0.247 -13.937
  146   2HB   ARG  19          1HB       ARG  19  12.751   0.595 -15.452
  147   1HG   ARG  19          2HG       ARG  19  14.285   1.507 -13.073
  148   2HG   ARG  19          1HG       ARG  19  14.699  -0.085 -13.709
  149   1HD   ARG  19          2HD       ARG  19  14.975   0.910 -15.967
  150   2HD   ARG  19          1HD       ARG  19  14.614   2.501 -15.296
  151    HE   ARG  19           HE       ARG  19  16.772   1.327 -13.824
  152   1HH1  ARG  19          2HH1      ARG  19  17.169   0.925 -16.926
  153   2HH1  ARG  19          1HH1      ARG  19  18.231   2.256 -17.246
  154   1HH2  ARG  19          1HH2      ARG  19  17.626   3.812 -14.207
  155   2HH2  ARG  19          2HH2      ARG  19  18.490   3.890 -15.706
  156    H    GLN  20           H        GLN  20  10.572   0.537 -15.585
  157    HA   GLN  20           HA       GLN  20  10.288   2.122 -17.802
  158   1HB   GLN  20          2HB       GLN  20   8.776  -0.019 -16.617
  159   2HB   GLN  20          1HB       GLN  20   7.661   1.169 -17.293
  160   1HG   GLN  20          2HG       GLN  20  10.050   0.349 -18.909
  161   2HG   GLN  20          1HG       GLN  20   8.668  -0.743 -18.824
  162   1HE2  GLN  20          2HE2      GLN  20   8.171   2.926 -20.630
  163   2HE2  GLN  20          1HE2      GLN  20   9.403   2.730 -19.479
  164    H    LEU  21           H        LEU  21   8.321   2.447 -14.831
  165    HA   LEU  21           HA       LEU  21   6.672   4.567 -15.745
  166   1HB   LEU  21          2HB       LEU  21   7.535   3.545 -13.087
  167   2HB   LEU  21          1HB       LEU  21   6.865   5.175 -13.133
  168    HG   LEU  21           HG       LEU  21   4.815   4.400 -14.107
  169   1HD1  LEU  21          1HD1      LEU  21   6.394   1.874 -14.566
  170   2HD1  LEU  21          3HD1      LEU  21   4.631   1.836 -14.529
  171   3HD1  LEU  21          2HD1      LEU  21   5.467   2.822 -15.729
  172   1HD2  LEU  21          3HD2      LEU  21   5.872   2.744 -11.830
  173   2HD2  LEU  21          2HD2      LEU  21   4.638   4.003 -11.808
  174   3HD2  LEU  21          1HD2      LEU  21   4.265   2.415 -12.479
  175    H    LEU  22           H        LEU  22   9.693   4.770 -13.857
  176    HA   LEU  22           HA       LEU  22   9.861   7.659 -14.409
  177   1HB   LEU  22          2HB       LEU  22  11.948   5.949 -13.044
  178   2HB   LEU  22          1HB       LEU  22  11.693   7.686 -12.880
  179    HG   LEU  22           HG       LEU  22   9.932   5.448 -11.858
  180   1HD1  LEU  22          3HD1      LEU  22  11.935   6.338 -10.534
  181   2HD1  LEU  22          2HD1      LEU  22  11.050   7.859 -10.415
  182   3HD1  LEU  22          1HD1      LEU  22  10.377   6.390  -9.710
  183   1HD2  LEU  22          2HD2      LEU  22   9.333   8.372 -12.300
  184   2HD2  LEU  22          1HD2      LEU  22   8.354   6.972 -12.740
  185   3HD2  LEU  22          3HD2      LEU  22   8.504   7.447 -11.048
  186    H    SER  23           H        SER  23  10.237   5.354 -16.468
  187    HA   SER  23           HA       SER  23  13.012   5.862 -17.344
  188   1HB   SER  23          2HB       SER  23  12.794   3.982 -18.640
  189   2HB   SER  23          1HB       SER  23  11.486   3.636 -17.509
  190    HG   SER  23           HG       SER  23  11.390   4.516 -20.150
  191    H    PHE  24           H        PHE  24  10.928   8.016 -17.341
  192    HA   PHE  24           HA       PHE  24  10.346   9.806 -18.742
  193   1HB   PHE  24          2HB       PHE  24  12.644   8.511 -20.120
  194   2HB   PHE  24          1HB       PHE  24  11.650   9.595 -21.095
  195    HD1  PHE  24           HD1      PHE  24  12.921   9.542 -17.556
  196    HD2  PHE  24           HD2      PHE  24  12.458  11.771 -21.199
  197    HE1  PHE  24           HE1      PHE  24  14.018  11.498 -16.499
  198    HE2  PHE  24           HE2      PHE  24  13.555  13.727 -20.142
  199    HZ   PHE  24           HZ       PHE  24  14.336  13.591 -17.791
  200    H    GLY  25           H        GLY  25   8.437   7.955 -18.697
  201   1HA   GLY  25          2HA       GLY  25   7.677   7.626 -21.570
  202   2HA   GLY  25          1HA       GLY  25   7.350   6.361 -20.385
  203    H    ASN  26           H        ASN  26   6.634   8.215 -18.252
  204    HA   ASN  26           HA       ASN  26   4.357   9.773 -19.264
  205   1HB   ASN  26          2HB       ASN  26   3.704   7.633 -17.258
  206   2HB   ASN  26          1HB       ASN  26   2.624   8.494 -18.354
  207   1HD2  ASN  26          2HD2      ASN  26   2.930   6.062 -20.877
  208   2HD2  ASN  26          1HD2      ASN  26   2.082   7.393 -20.253
  209    HA   PRO  27           HA       PRO  27   5.361  11.997 -15.606
  210   1HB   PRO  27          2HB       PRO  27   3.102  13.562 -15.497
  211   2HB   PRO  27          1HB       PRO  27   4.430  13.834 -16.637
  212   1HG   PRO  27          2HG       PRO  27   1.720  12.676 -17.133
  213   2HG   PRO  27          1HG       PRO  27   2.791  13.536 -18.250
  214   1HD   PRO  27          2HD       PRO  27   2.414  10.728 -18.129
  215   2HD   PRO  27          1HD       PRO  27   3.709  11.570 -19.005
  216    H    ARG  28           H        ARG  28   3.768  12.867 -13.596
  217    HA   ARG  28           HA       ARG  28   3.131  10.484 -12.128
  218   1HB   ARG  28          2HB       ARG  28   2.400  11.960 -10.376
  219   2HB   ARG  28          1HB       ARG  28   3.783  12.735 -11.148
  220   1HG   ARG  28          2HG       ARG  28   2.167  14.024 -12.584
  221   2HG   ARG  28          1HG       ARG  28   0.853  13.351 -11.618
  222   1HD   ARG  28          2HD       ARG  28   1.232  15.338 -10.477
  223   2HD   ARG  28          1HD       ARG  28   2.316  14.259  -9.600
  224    HE   ARG  28           HE       ARG  28   4.088  15.153 -11.309
  225   1HH1  ARG  28          1HH2      ARG  28   3.280  17.231 -12.779
  226   2HH1  ARG  28          2HH2      ARG  28   3.177  18.628 -11.760
  227   1HH2  ARG  28          2HH1      ARG  28   3.137  16.805  -8.812
  228   2HH2  ARG  28          1HH1      ARG  28   3.097  18.387  -9.515
  229    H    GLY  29           H        GLY  29   0.977   9.865 -11.331
  230   1HA   GLY  29          2HA       GLY  29  -1.447   9.960 -11.470
  231   2HA   GLY  29          1HA       GLY  29  -1.292  10.862 -12.979
  232    H    THR  30           H        THR  30   0.968   8.644 -13.438
  233    HA   THR  30           HA       THR  30  -0.771   6.960 -15.077
  234    HB   THR  30           HB       THR  30   2.112   6.307 -14.568
  235    HG1  THR  30           HG1      THR  30   1.085   8.547 -15.954
  236   1HG2  THR  30          2HG2      THR  30   0.244   6.285 -16.949
  237   2HG2  THR  30          1HG2      THR  30   1.973   5.958 -17.074
  238   3HG2  THR  30          3HG2      THR  30   0.943   4.894 -16.118
  239    H    PHE  31           H        PHE  31  -1.095   4.699 -14.772
  240    HA   PHE  31           HA       PHE  31  -0.223   3.597 -12.144
  241   1HB   PHE  31          2HB       PHE  31  -3.035   3.689 -13.253
  242   2HB   PHE  31          1HB       PHE  31  -2.552   2.553 -11.994
  243    HD1  PHE  31           HD1      PHE  31  -2.294   6.212 -12.800
  244    HD2  PHE  31           HD2      PHE  31  -2.770   3.203  -9.771
  245    HE1  PHE  31           HE1      PHE  31  -2.564   7.982 -11.083
  246    HE2  PHE  31           HE2      PHE  31  -3.042   4.973  -8.056
  247    HZ   PHE  31           HZ       PHE  31  -2.938   7.362  -8.711
  248    H    LEU  32           H        LEU  32   1.277   2.307 -13.319
  249    HA   LEU  32           HA       LEU  32   0.445   0.594 -15.511
  250   1HB   LEU  32          2HB       LEU  32   2.719   1.116 -15.604
  251   2HB   LEU  32          1HB       LEU  32   2.925   0.988 -13.862
  252    HG   LEU  32           HG       LEU  32   2.287  -1.449 -15.519
  253   1HD1  LEU  32          2HD1      LEU  32   4.412  -0.038 -16.231
  254   2HD1  LEU  32          1HD1      LEU  32   5.106  -0.748 -14.774
  255   3HD1  LEU  32          3HD1      LEU  32   4.521  -1.790 -16.072
  256   1HD2  LEU  32          3HD2      LEU  32   2.557  -0.958 -12.785
  257   2HD2  LEU  32          2HD2      LEU  32   2.609  -2.541 -13.562
  258   3HD2  LEU  32          1HD2      LEU  32   4.106  -1.665 -13.245
  259    H    ILE  33           H        ILE  33   0.489  -1.798 -15.363
  260    HA   ILE  33           HA       ILE  33  -0.151  -2.810 -12.625
  261    HB   ILE  33           HB       ILE  33  -1.691  -3.139 -15.183
  262   1HG1  ILE  33          2HG1      ILE  33  -2.278  -2.665 -12.270
  263   2HG1  ILE  33          1HG1      ILE  33  -2.679  -1.653 -13.654
  264   1HG2  ILE  33          1HG2      ILE  33  -0.981  -5.447 -14.554
  265   2HG2  ILE  33          3HG2      ILE  33  -1.696  -5.198 -12.960
  266   3HG2  ILE  33          2HG2      ILE  33  -2.720  -5.204 -14.394
  267   1HD1  ILE  33          3HD1      ILE  33  -3.862  -4.396 -13.136
  268   2HD1  ILE  33          2HD1      ILE  33  -4.662  -2.872 -12.753
  269   3HD1  ILE  33          1HD1      ILE  33  -4.313  -3.289 -14.430
  270    H    ARG  34           H        ARG  34   0.124  -5.315 -12.625
  271    HA   ARG  34           HA       ARG  34   1.636  -6.679 -14.574
  272   1HB   ARG  34          2HB       ARG  34   3.925  -6.518 -13.446
  273   2HB   ARG  34          1HB       ARG  34   3.409  -5.096 -14.354
  274   1HG   ARG  34          2HG       ARG  34   2.753  -3.952 -12.342
  275   2HG   ARG  34          1HG       ARG  34   2.950  -5.414 -11.377
  276   1HD   ARG  34          2HD       ARG  34   5.404  -5.388 -12.093
  277   2HD   ARG  34          1HD       ARG  34   5.109  -3.759 -12.698
  278    HE   ARG  34           HE       ARG  34   5.485  -3.149 -10.453
  279   1HH1  ARG  34          1HH1      ARG  34   3.784  -6.325  -8.854
  280   2HH1  ARG  34          2HH1      ARG  34   4.492  -6.383 -10.434
  281   1HH2  ARG  34          1HH2      ARG  34   4.185  -2.897  -8.512
  282   2HH2  ARG  34          2HH2      ARG  34   3.608  -4.349  -7.767
  283    H    GLU  35           H        GLU  35   2.426  -8.727 -13.808
  284    HA   GLU  35           HA       GLU  35   0.907  -9.847 -11.664
  285   1HB   GLU  35          2HB       GLU  35   3.073 -10.747 -13.490
  286   2HB   GLU  35          1HB       GLU  35   2.822 -11.688 -12.024
  287   1HG   GLU  35          2HG       GLU  35   0.320 -11.620 -12.636
  288   2HG   GLU  35          1HG       GLU  35   0.861 -11.093 -14.233
  289    H    SER  36           H        SER  36   1.325  -9.889  -9.517
  290    HA   SER  36           HA       SER  36   3.776  -8.687  -8.476
  291   1HB   SER  36          2HB       SER  36   1.436 -10.021  -7.080
  292   2HB   SER  36          1HB       SER  36   2.740  -9.168  -6.270
  293    HG   SER  36           HG       SER  36   1.837  -7.351  -6.755
  294    H    GLU  37           H        GLU  37   5.583  -9.835  -7.967
  295    HA   GLU  37           HA       GLU  37   5.469 -12.789  -8.050
  296   1HB   GLU  37          2HB       GLU  37   7.747 -10.826  -7.722
  297   2HB   GLU  37          1HB       GLU  37   7.953 -12.576  -7.728
  298   1HG   GLU  37          2HG       GLU  37   6.352 -11.599  -9.985
  299   2HG   GLU  37          1HG       GLU  37   7.994 -10.956  -9.974
  300    H    THR  38           H        THR  38   4.492 -10.788  -5.834
  301    HA   THR  38           HA       THR  38   6.080 -11.539  -3.511
  302    HB   THR  38           HB       THR  38   4.618  -9.409  -3.882
  303    HG1  THR  38           HG1      THR  38   3.980  -9.709  -1.494
  304   1HG2  THR  38          2HG2      THR  38   2.541 -10.608  -4.440
  305   2HG2  THR  38          1HG2      THR  38   2.541 -11.352  -2.841
  306   3HG2  THR  38          3HG2      THR  38   2.328  -9.609  -3.003
  307    H    THR  39           H        THR  39   2.951 -12.433  -4.888
  308    HA   THR  39           HA       THR  39   2.864 -14.709  -2.937
  309    HB   THR  39           HB       THR  39   0.925 -12.971  -3.159
  310    HG1  THR  39           HG1      THR  39   0.450 -14.657  -1.941
  311   1HG2  THR  39          2HG2      THR  39   1.006 -13.590  -5.778
  312   2HG2  THR  39          1HG2      THR  39  -0.168 -14.790  -5.237
  313   3HG2  THR  39          3HG2      THR  39  -0.474 -13.075  -4.967
  314    H    LYS  40           H        LYS  40   1.289 -16.516  -4.195
  315    HA   LYS  40           HA       LYS  40   2.916 -17.983  -5.864
  316   1HB   LYS  40          2HB       LYS  40  -0.042 -17.818  -6.415
  317   2HB   LYS  40          1HB       LYS  40   1.009 -19.231  -6.503
  318   1HG   LYS  40          2HG       LYS  40   1.375 -18.850  -3.966
  319   2HG   LYS  40          1HG       LYS  40  -0.051 -17.817  -4.062
  320   1HD   LYS  40          2HD       LYS  40  -1.009 -19.955  -5.376
  321   2HD   LYS  40          1HD       LYS  40   0.176 -20.777  -4.359
  322   1HE   LYS  40          2HE       LYS  40  -0.882 -20.123  -2.376
  323   2HE   LYS  40          1HE       LYS  40  -1.693 -18.758  -3.142
  324   1HZ   LYS  40          2HZ       LYS  40  -2.526 -21.055  -4.463
  325   2HZ   LYS  40          1HZ       LYS  40  -2.626 -21.393  -2.801
  326   3HZ   LYS  40          3HZ       LYS  40  -3.444 -20.053  -3.443
  327    H    GLY  41           H        GLY  41   0.776 -15.342  -6.741
  328   1HA   GLY  41          2HA       GLY  41   2.189 -14.236  -8.800
  329   2HA   GLY  41          1HA       GLY  41   1.337 -15.565  -9.593
  330    H    ALA  42           H        ALA  42   0.751 -12.800  -7.445
  331    HA   ALA  42           HA       ALA  42  -2.080 -12.648  -8.264
  332   1HB   ALA  42          2HB       ALA  42  -0.402 -11.614  -6.102
  333   2HB   ALA  42          1HB       ALA  42  -1.448 -10.373  -6.784
  334   3HB   ALA  42          3HB       ALA  42  -2.149 -11.856  -6.138
  335    H    TYR  43           H        TYR  43  -2.310  -9.820  -8.287
  336    HA   TYR  43           HA       TYR  43  -0.679  -9.181 -10.701
  337   1HB   TYR  43          2HB       TYR  43  -3.529  -9.191 -10.394
  338   2HB   TYR  43          1HB       TYR  43  -2.985  -7.535 -10.665
  339    HD1  TYR  43           HD1      TYR  43  -0.660  -7.733 -12.317
  340    HD2  TYR  43           HD2      TYR  43  -4.261 -10.083 -12.431
  341    HE1  TYR  43           HE1      TYR  43  -0.248  -8.267 -14.712
  342    HE2  TYR  43           HE2      TYR  43  -3.847 -10.614 -14.816
  343    HH   TYR  43           HH       TYR  43  -2.444 -10.429 -16.516
  344    H    SER  44           H        SER  44  -1.089  -6.505 -10.936
  345    HA   SER  44           HA       SER  44  -0.807  -5.212  -8.320
  346   1HB   SER  44          2HB       SER  44   1.402  -6.109  -8.496
  347   2HB   SER  44          1HB       SER  44   1.521  -5.592 -10.180
  348    HG   SER  44           HG       SER  44   1.906  -3.604  -9.567
  349    H    LEU  45           H        LEU  45  -0.318  -2.894  -8.560
  350    HA   LEU  45           HA       LEU  45  -0.895  -1.774 -11.255
  351   1HB   LEU  45          2HB       LEU  45  -3.094  -1.876 -10.186
  352   2HB   LEU  45          1HB       LEU  45  -2.460  -1.044  -8.765
  353    HG   LEU  45           HG       LEU  45  -1.765   0.839 -10.349
  354   1HD1  LEU  45          3HD1      LEU  45  -3.498  -0.830 -12.180
  355   2HD1  LEU  45          2HD1      LEU  45  -3.178   0.878 -12.469
  356   3HD1  LEU  45          1HD1      LEU  45  -1.847  -0.280 -12.460
  357   1HD2  LEU  45          1HD2      LEU  45  -4.682   0.141  -9.965
  358   2HD2  LEU  45          3HD2      LEU  45  -3.678   1.148  -8.923
  359   3HD2  LEU  45          2HD2      LEU  45  -4.124   1.714 -10.534
  360    H    SER  46           H        SER  46   1.397  -1.247 -11.018
  361    HA   SER  46           HA       SER  46   2.410   0.460  -8.958
  362   1HB   SER  46          2HB       SER  46   3.518   0.669 -11.718
  363   2HB   SER  46          1HB       SER  46   4.362   0.480 -10.181
  364    HG   SER  46           HG       SER  46   4.273  -1.599 -10.391
  365    H    ILE  47           H        ILE  47   2.873   2.770  -9.140
  366    HA   ILE  47           HA       ILE  47   1.288   4.217 -11.195
  367    HB   ILE  47           HB       ILE  47   0.109   5.532  -9.622
  368   1HG1  ILE  47          2HG1      ILE  47   1.895   4.347  -7.469
  369   2HG1  ILE  47          1HG1      ILE  47   2.046   5.976  -8.130
  370   1HG2  ILE  47          1HG2      ILE  47  -0.660   3.144  -9.803
  371   2HG2  ILE  47          3HG2      ILE  47   0.266   2.788  -8.345
  372   3HG2  ILE  47          2HG2      ILE  47  -1.090   3.913  -8.275
  373   1HD1  ILE  47          3HD1      ILE  47  -0.636   5.163  -7.109
  374   2HD1  ILE  47          2HD1      ILE  47   0.622   5.473  -5.912
  375   3HD1  ILE  47          1HD1      ILE  47   0.158   6.737  -7.052
  376    H    ARG  48           H        ARG  48   2.445   5.899 -12.019
  377    HA   ARG  48           HA       ARG  48   5.063   6.530 -10.831
  378   1HB   ARG  48          2HB       ARG  48   4.181   6.435 -13.413
  379   2HB   ARG  48          1HB       ARG  48   4.071   8.165 -13.090
  380   1HG   ARG  48          2HG       ARG  48   6.547   6.781 -12.179
  381   2HG   ARG  48          1HG       ARG  48   6.352   6.999 -13.918
  382   1HD   ARG  48          2HD       ARG  48   5.587   9.436 -12.636
  383   2HD   ARG  48          1HD       ARG  48   7.144   8.941 -11.972
  384    HE   ARG  48           HE       ARG  48   7.199   8.676 -14.826
  385   1HH1  ARG  48          2HH1      ARG  48   5.910  11.412 -13.849
  386   2HH1  ARG  48          1HH1      ARG  48   7.286  12.443 -14.055
  387   1HH2  ARG  48          1HH2      ARG  48   9.526   9.821 -14.421
  388   2HH2  ARG  48          2HH2      ARG  48   9.334  11.542 -14.378
  389    H    ASP  49           H        ASP  49   5.407   8.245  -9.482
  390    HA   ASP  49           HA       ASP  49   3.607  10.587  -9.646
  391   1HB   ASP  49          2HB       ASP  49   2.538   9.049  -8.018
  392   2HB   ASP  49          1HB       ASP  49   4.023   9.046  -7.068
  393    H    TRP  50           H        TRP  50   4.911  12.326  -9.649
  394    HA   TRP  50           HA       TRP  50   7.574  12.156  -8.300
  395   1HB   TRP  50          2HB       TRP  50   7.857  12.794 -10.582
  396   2HB   TRP  50          1HB       TRP  50   6.473  13.884 -10.529
  397    HD1  TRP  50           HD1      TRP  50  10.147  13.853 -10.137
  398    HE1  TRP  50           HE1      TRP  50  10.976  16.110  -9.201
  399    HE3  TRP  50           HE3      TRP  50   5.717  15.848  -8.757
  400    HZ2  TRP  50           HZ2      TRP  50   9.860  18.491  -8.049
  401    HZ3  TRP  50           HZ3      TRP  50   5.588  18.120  -7.749
  402    HH2  TRP  50           HH2      TRP  50   7.661  19.440  -7.393
  403    H    ASP  51           H        ASP  51   8.210  13.935  -6.921
  404    HA   ASP  51           HA       ASP  51   5.968  15.681  -6.014
  405   1HB   ASP  51          2HB       ASP  51   7.252  13.550  -4.525
  406   2HB   ASP  51          1HB       ASP  51   7.499  15.102  -3.726
  407    H    ASP  52           H        ASP  52   6.764  17.589  -4.784
  408    HA   ASP  52           HA       ASP  52   9.228  18.630  -6.005
  409   1HB   ASP  52          2HB       ASP  52   8.552  20.760  -5.142
  410   2HB   ASP  52          1HB       ASP  52   7.079  19.971  -5.705
  411    H    MET  53           H        MET  53   9.929  16.545  -4.362
  412    HA   MET  53           HA       MET  53  11.617  17.887  -2.441
  413   1HB   MET  53          2HB       MET  53  10.794  16.841  -0.441
  414   2HB   MET  53          1HB       MET  53   9.412  17.593  -1.236
  415   1HG   MET  53          2HG       MET  53   9.357  15.157  -2.419
  416   2HG   MET  53          1HG       MET  53  10.045  14.717  -0.856
  417   1HE   MET  53          3HE       MET  53   7.776  16.806  -2.684
  418   2HE   MET  53          2HE       MET  53   6.212  16.074  -2.338
  419   3HE   MET  53          1HE       MET  53   6.709  17.524  -1.470
  420    H    LYS  54           H        LYS  54  10.518  14.895  -3.935
  421    HA   LYS  54           HA       LYS  54  13.195  13.781  -3.382
  422   1HB   LYS  54          2HB       LYS  54  11.846  11.514  -3.588
  423   2HB   LYS  54          1HB       LYS  54  11.911  12.387  -2.057
  424   1HG   LYS  54          2HG       LYS  54   9.723  13.087  -2.207
  425   2HG   LYS  54          1HG       LYS  54   9.760  13.168  -3.969
  426   1HD   LYS  54          2HD       LYS  54   9.064  11.018  -4.196
  427   2HD   LYS  54          1HD       LYS  54  10.109  10.449  -2.894
  428   1HE   LYS  54          2HE       LYS  54   7.730  12.132  -2.194
  429   2HE   LYS  54          1HE       LYS  54   7.472  10.437  -2.608
  430   1HZ   LYS  54          2HZ       LYS  54   9.488  11.302  -0.619
  431   2HZ   LYS  54          1HZ       LYS  54   7.884  10.940  -0.192
  432   3HZ   LYS  54          3HZ       LYS  54   8.871   9.741  -0.873
  433    H    GLY  55           H        GLY  55  11.143  14.814  -5.820
  434   1HA   GLY  55          2HA       GLY  55  11.643  14.718  -8.132
  435   2HA   GLY  55          1HA       GLY  55  12.752  13.397  -7.796
  436    H    ASP  56           H        ASP  56  11.599  12.366  -9.683
  437    HA   ASP  56           HA       ASP  56   8.821  11.688  -9.481
  438   1HB   ASP  56          2HB       ASP  56   9.555   9.849 -11.165
  439   2HB   ASP  56          1HB       ASP  56   9.735  11.533 -11.652
  440    H    HIS  57           H        HIS  57   8.017   9.426  -9.165
  441    HA   HIS  57           HA       HIS  57   9.731   7.560  -7.706
  442   1HB   HIS  57          2HB       HIS  57   7.903   9.391  -6.314
  443   2HB   HIS  57          1HB       HIS  57   7.613   7.696  -5.937
  444    HD1  HIS  57           HD1      HIS  57  10.347  10.312  -5.831
  445    HD2  HIS  57           HD2      HIS  57   9.601   6.479  -4.373
  446    HE1  HIS  57           HE1      HIS  57  12.214   9.790  -4.202
  447    H    VAL  58           H        VAL  58   7.860   5.857  -6.724
  448    HA   VAL  58           HA       VAL  58   5.658   5.537  -8.597
  449    HB   VAL  58           HB       VAL  58   8.249   4.187  -8.991
  450   1HG1  VAL  58          3HG1      VAL  58   5.633   2.653  -9.039
  451   2HG1  VAL  58          2HG1      VAL  58   7.049   2.145  -9.961
  452   3HG1  VAL  58          1HG1      VAL  58   7.122   2.213  -8.199
  453   1HG2  VAL  58          3HG2      VAL  58   5.814   4.857 -10.629
  454   2HG2  VAL  58          2HG2      VAL  58   7.407   5.609 -10.691
  455   3HG2  VAL  58          1HG2      VAL  58   7.183   3.966 -11.295
  456    H    LYS  59           H        LYS  59   4.091   4.876  -7.273
  457    HA   LYS  59           HA       LYS  59   4.741   3.170  -4.926
  458   1HB   LYS  59          2HB       LYS  59   2.665   5.138  -5.591
  459   2HB   LYS  59          1HB       LYS  59   2.014   3.664  -4.874
  460   1HG   LYS  59          2HG       LYS  59   4.422   4.986  -3.649
  461   2HG   LYS  59          1HG       LYS  59   2.809   5.610  -3.303
  462   1HD   LYS  59          2HD       LYS  59   2.193   3.738  -2.115
  463   2HD   LYS  59          1HD       LYS  59   3.190   2.661  -3.093
  464   1HE   LYS  59          2HE       LYS  59   4.908   2.816  -1.638
  465   2HE   LYS  59          1HE       LYS  59   4.829   4.577  -1.647
  466   1HZ   LYS  59          3HZ       LYS  59   2.703   4.100  -0.207
  467   2HZ   LYS  59          2HZ       LYS  59   3.539   2.664   0.150
  468   3HZ   LYS  59          1HZ       LYS  59   4.245   4.170   0.495
  469    H    HIS  60           H        HIS  60   2.367   1.738  -4.687
  470    HA   HIS  60           HA       HIS  60   1.758   0.498  -7.265
  471   1HB   HIS  60          2HB       HIS  60   3.011  -1.289  -5.192
  472   2HB   HIS  60          1HB       HIS  60   2.672  -1.650  -6.881
  473    HD1  HIS  60           HD1      HIS  60   4.349  -0.850  -8.644
  474    HD2  HIS  60           HD2      HIS  60   5.332   0.385  -4.786
  475    HE1  HIS  60           HE1      HIS  60   6.696   0.090  -8.772
  476    H    TYR  61           H        TYR  61   0.027  -0.947  -7.175
  477    HA   TYR  61           HA       TYR  61  -1.394  -1.092  -4.552
  478   1HB   TYR  61          2HB       TYR  61  -2.347  -0.070  -7.174
  479   2HB   TYR  61          1HB       TYR  61  -3.471  -1.137  -6.325
  480    HD1  TYR  61           HD1      TYR  61  -4.034  -0.614  -3.890
  481    HD2  TYR  61           HD2      TYR  61  -2.002   2.164  -6.459
  482    HE1  TYR  61           HE1      TYR  61  -4.612   1.237  -2.345
  483    HE2  TYR  61           HE2      TYR  61  -2.581   4.015  -4.914
  484    HH   TYR  61           HH       TYR  61  -4.497   3.414  -1.964
  485    H    LYS  62           H        LYS  62  -0.826  -3.203  -4.142
  486    HA   LYS  62           HA       LYS  62  -0.543  -5.316  -5.938
  487   1HB   LYS  62          2HB       LYS  62   0.083  -5.568  -3.622
  488   2HB   LYS  62          1HB       LYS  62  -1.575  -5.331  -3.087
  489   1HG   LYS  62          2HG       LYS  62  -1.415  -7.470  -5.039
  490   2HG   LYS  62          1HG       LYS  62  -0.318  -7.770  -3.688
  491   1HD   LYS  62          2HD       LYS  62  -3.157  -6.879  -3.199
  492   2HD   LYS  62          1HD       LYS  62  -2.780  -8.581  -3.467
  493   1HE   LYS  62          2HE       LYS  62  -2.502  -8.531  -1.183
  494   2HE   LYS  62          1HE       LYS  62  -0.880  -8.023  -1.653
  495   1HZ   LYS  62          2HZ       LYS  62  -3.073  -6.086  -1.206
  496   2HZ   LYS  62          1HZ       LYS  62  -2.057  -6.608   0.052
  497   3HZ   LYS  62          3HZ       LYS  62  -1.402  -5.785  -1.279
  498    H    ILE  63           H        ILE  63  -1.949  -6.134  -7.360
  499    HA   ILE  63           HA       ILE  63  -4.840  -5.697  -7.008
  500    HB   ILE  63           HB       ILE  63  -3.027  -6.499  -9.231
  501   1HG1  ILE  63          2HG1      ILE  63  -5.360  -4.609  -8.887
  502   2HG1  ILE  63          1HG1      ILE  63  -3.653  -4.174  -8.983
  503   1HG2  ILE  63          2HG2      ILE  63  -6.011  -7.070  -9.184
  504   2HG2  ILE  63          1HG2      ILE  63  -4.981  -7.171 -10.612
  505   3HG2  ILE  63          3HG2      ILE  63  -4.732  -8.283  -9.266
  506   1HD1  ILE  63          2HD1      ILE  63  -4.372  -5.802 -11.243
  507   2HD1  ILE  63          1HD1      ILE  63  -5.487  -4.442 -11.117
  508   3HD1  ILE  63          3HD1      ILE  63  -3.750  -4.152 -11.227
  509    H    ARG  64           H        ARG  64  -6.255  -7.294  -6.457
  510    HA   ARG  64           HA       ARG  64  -5.299 -10.112  -6.438
  511   1HB   ARG  64          2HB       ARG  64  -5.774  -8.497  -4.121
  512   2HB   ARG  64          1HB       ARG  64  -7.045  -9.716  -4.211
  513   1HG   ARG  64          2HG       ARG  64  -4.932 -10.424  -2.972
  514   2HG   ARG  64          1HG       ARG  64  -5.454 -11.504  -4.264
  515   1HD   ARG  64          2HD       ARG  64  -3.694 -10.931  -5.640
  516   2HD   ARG  64          1HD       ARG  64  -3.582  -9.295  -4.992
  517    HE   ARG  64           HE       ARG  64  -1.844 -10.191  -3.683
  518   1HH1  ARG  64          2HH1      ARG  64  -3.358 -12.901  -4.844
  519   2HH1  ARG  64          1HH1      ARG  64  -3.156 -13.866  -3.420
  520   1HH2  ARG  64          1HH2      ARG  64  -2.042 -11.225  -1.468
  521   2HH2  ARG  64          2HH2      ARG  64  -2.411 -12.917  -1.509
  522    H    LYS  65           H        LYS  65  -6.740 -11.285  -7.601
  523    HA   LYS  65           HA       LYS  65  -9.527 -10.246  -7.783
  524   1HB   LYS  65          2HB       LYS  65  -9.647 -10.995  -9.986
  525   2HB   LYS  65          1HB       LYS  65  -7.954 -10.524  -9.882
  526   1HG   LYS  65          2HG       LYS  65  -8.937 -13.352  -9.399
  527   2HG   LYS  65          1HG       LYS  65  -8.339 -12.777 -10.952
  528   1HD   LYS  65          2HD       LYS  65  -6.812 -12.971  -8.346
  529   2HD   LYS  65          1HD       LYS  65  -6.481 -13.821  -9.853
  530   1HE   LYS  65          2HE       LYS  65  -6.100 -11.568 -10.937
  531   2HE   LYS  65          1HE       LYS  65  -6.197 -10.851  -9.329
  532   1HZ   LYS  65          2HZ       LYS  65  -4.402 -12.411  -8.657
  533   2HZ   LYS  65          1HZ       LYS  65  -4.233 -12.853 -10.288
  534   3HZ   LYS  65          3HZ       LYS  65  -3.923 -11.257  -9.807
  535    H    LEU  66           H        LEU  66 -11.240 -11.742  -7.543
  536    HA   LEU  66           HA       LEU  66 -10.675 -13.918  -5.723
  537   1HB   LEU  66          2HB       LEU  66 -13.190 -13.138  -7.204
  538   2HB   LEU  66          1HB       LEU  66 -13.116 -14.483  -6.067
  539    HG   LEU  66           HG       LEU  66 -13.889 -12.666  -4.768
  540   1HD1  LEU  66          2HD1      LEU  66 -11.576 -13.867  -4.088
  541   2HD1  LEU  66          1HD1      LEU  66 -11.002 -12.203  -4.205
  542   3HD1  LEU  66          3HD1      LEU  66 -12.312 -12.609  -3.096
  543   1HD2  LEU  66          3HD2      LEU  66 -12.770 -11.133  -6.747
  544   2HD2  LEU  66          2HD2      LEU  66 -13.489 -10.496  -5.270
  545   3HD2  LEU  66          1HD2      LEU  66 -11.745 -10.751  -5.367
  546    H    ASP  67           H        ASP  67 -11.397 -16.189  -6.186
  547    HA   ASP  67           HA       ASP  67 -10.164 -17.096  -8.647
  548   1HB   ASP  67          2HB       ASP  67 -11.195 -18.277  -6.209
  549   2HB   ASP  67          1HB       ASP  67 -11.779 -19.165  -7.614
  550    H    ASN  68           H        ASN  68 -13.199 -15.930  -7.710
  551    HA   ASN  68           HA       ASN  68 -14.606 -17.223  -9.991
  552   1HB   ASN  68          2HB       ASN  68 -15.697 -15.187  -8.024
  553   2HB   ASN  68          1HB       ASN  68 -16.620 -16.260  -9.078
  554   1HD2  ASN  68          2HD2      ASN  68 -15.202 -17.644  -5.522
  555   2HD2  ASN  68          1HD2      ASN  68 -14.849 -16.069  -6.047
  556    H    GLY  69           H        GLY  69 -12.720 -14.538  -9.301
  557   1HA   GLY  69          2HA       GLY  69 -12.201 -13.250 -11.448
  558   2HA   GLY  69          1HA       GLY  69 -13.932 -12.944 -11.468
  559    H    GLY  70           H        GLY  70 -14.843 -11.668  -9.779
  560   1HA   GLY  70          2HA       GLY  70 -14.681  -9.431  -8.864
  561   2HA   GLY  70          1HA       GLY  70 -14.190 -10.485  -7.556
  562    H    TYR  71           H        TYR  71 -12.729  -8.877 -10.420
  563    HA   TYR  71           HA       TYR  71 -10.070  -8.918  -9.270
  564   1HB   TYR  71          2HB       TYR  71 -11.383  -7.576 -11.593
  565   2HB   TYR  71          1HB       TYR  71  -9.875  -6.878 -11.002
  566    HD1  TYR  71           HD1      TYR  71  -7.797  -8.242 -10.940
  567    HD2  TYR  71           HD2      TYR  71 -11.435  -9.720 -12.676
  568    HE1  TYR  71           HE1      TYR  71  -6.520 -10.028 -12.097
  569    HE2  TYR  71           HE2      TYR  71 -10.162 -11.504 -13.835
  570    HH   TYR  71           HH       TYR  71  -6.957 -12.279 -13.043
  571    H    TYR  72           H        TYR  72  -9.288  -7.609  -7.656
  572    HA   TYR  72           HA       TYR  72 -10.443  -4.892  -7.327
  573   1HB   TYR  72          2HB       TYR  72 -11.074  -5.217  -5.023
  574   2HB   TYR  72          1HB       TYR  72 -11.867  -6.457  -5.984
  575    HD1  TYR  72           HD1      TYR  72  -9.179  -5.772  -3.548
  576    HD2  TYR  72           HD2      TYR  72 -11.218  -8.814  -5.788
  577    HE1  TYR  72           HE1      TYR  72  -8.110  -7.503  -2.162
  578    HE2  TYR  72           HE2      TYR  72 -10.142 -10.553  -4.407
  579    HH   TYR  72           HH       TYR  72  -8.862 -10.090  -1.544
  580    H    ILE  73           H        ILE  73  -8.811  -3.476  -6.736
  581    HA   ILE  73           HA       ILE  73  -6.189  -4.571  -5.948
  582    HB   ILE  73           HB       ILE  73  -7.244  -1.775  -6.453
  583   1HG1  ILE  73          2HG1      ILE  73  -4.844  -3.282  -7.514
  584   2HG1  ILE  73          1HG1      ILE  73  -6.406  -3.184  -8.328
  585   1HG2  ILE  73          1HG2      ILE  73  -5.861  -1.755  -4.358
  586   2HG2  ILE  73          3HG2      ILE  73  -4.520  -2.395  -5.308
  587   3HG2  ILE  73          2HG2      ILE  73  -5.186  -0.803  -5.680
  588   1HD1  ILE  73          2HD1      ILE  73  -5.765  -0.531  -7.690
  589   2HD1  ILE  73          1HD1      ILE  73  -4.252  -1.237  -8.259
  590   3HD1  ILE  73          3HD1      ILE  73  -5.685  -1.277  -9.285
  591    H    THR  74           H        THR  74  -9.028  -3.121  -4.612
  592    HA   THR  74           HA       THR  74  -7.983  -3.610  -1.869
  593    HB   THR  74           HB       THR  74  -8.193  -1.384  -1.509
  594    HG1  THR  74           HG1      THR  74  -9.970  -1.653  -0.412
  595   1HG2  THR  74          3HG2      THR  74  -9.922  -1.271  -3.994
  596   2HG2  THR  74          2HG2      THR  74  -9.410   0.142  -3.070
  597   3HG2  THR  74          1HG2      THR  74  -8.210  -0.859  -3.889
  598    H    THR  75           H        THR  75  -9.461  -4.649  -0.537
  599    HA   THR  75           HA       THR  75 -11.459  -6.228  -1.854
  600    HB   THR  75           HB       THR  75 -11.959  -7.093   0.371
  601    HG1  THR  75           HG1      THR  75 -10.457  -4.829   1.170
  602   1HG2  THR  75          2HG2      THR  75  -9.391  -6.924  -0.869
  603   2HG2  THR  75          1HG2      THR  75  -9.158  -6.904   0.883
  604   3HG2  THR  75          3HG2      THR  75 -10.039  -8.233   0.127
  605    H    ARG  76           H        ARG  76 -11.670  -3.021  -1.085
  606    HA   ARG  76           HA       ARG  76 -14.444  -3.030  -0.148
  607   1HB   ARG  76          2HB       ARG  76 -12.742  -1.255   0.476
  608   2HB   ARG  76          1HB       ARG  76 -12.835  -0.683  -1.189
  609   1HG   ARG  76          2HG       ARG  76 -14.616   0.554  -0.568
  610   2HG   ARG  76          1HG       ARG  76 -15.506  -0.955  -0.369
  611   1HD   ARG  76          2HD       ARG  76 -13.699  -0.198   1.865
  612   2HD   ARG  76          1HD       ARG  76 -15.130   0.810   1.650
  613    HE   ARG  76           HE       ARG  76 -15.216  -2.141   2.122
  614   1HH1  ARG  76          2HH1      ARG  76 -17.518  -0.434   0.836
  615   2HH1  ARG  76          1HH1      ARG  76 -18.555  -0.268   2.214
  616   1HH2  ARG  76          1HH2      ARG  76 -16.147  -1.308   4.482
  617   2HH2  ARG  76          2HH2      ARG  76 -17.778  -0.763   4.277
  618    H    ALA  77           H        ALA  77 -12.846  -3.311  -3.151
  619    HA   ALA  77           HA       ALA  77 -15.423  -3.099  -4.553
  620   1HB   ALA  77          1HB       ALA  77 -13.139  -1.191  -5.093
  621   2HB   ALA  77          3HB       ALA  77 -14.421  -1.500  -6.266
  622   3HB   ALA  77          2HB       ALA  77 -14.811  -0.792  -4.698
  623    H    GLN  78           H        GLN  78 -15.458  -4.738  -5.991
  624    HA   GLN  78           HA       GLN  78 -12.920  -5.607  -7.248
  625   1HB   GLN  78          2HB       GLN  78 -14.249  -7.899  -7.356
  626   2HB   GLN  78          1HB       GLN  78 -13.296  -7.492  -5.940
  627   1HG   GLN  78          2HG       GLN  78 -15.703  -6.346  -5.306
  628   2HG   GLN  78          1HG       GLN  78 -16.214  -7.747  -6.237
  629   1HE2  GLN  78          2HE2      GLN  78 -13.970  -8.464  -2.855
  630   2HE2  GLN  78          1HE2      GLN  78 -13.645  -7.077  -3.779
  631    H    PHE  79           H        PHE  79 -13.542  -7.004  -9.299
  632    HA   PHE  79           HA       PHE  79 -16.015  -6.012 -10.591
  633   1HB   PHE  79          2HB       PHE  79 -13.210  -5.496 -11.598
  634   2HB   PHE  79          1HB       PHE  79 -14.634  -5.388 -12.634
  635    HD1  PHE  79           HD1      PHE  79 -13.220  -4.133  -9.416
  636    HD2  PHE  79           HD2      PHE  79 -15.950  -3.431 -12.653
  637    HE1  PHE  79           HE1      PHE  79 -13.695  -1.877  -8.520
  638    HE2  PHE  79           HE2      PHE  79 -16.429  -1.165 -11.756
  639    HZ   PHE  79           HZ       PHE  79 -15.300  -0.388  -9.685
  640    H    GLU  80           H        GLU  80 -15.476  -6.955 -13.160
  641    HA   GLU  80           HA       GLU  80 -15.459  -9.855 -12.580
  642   1HB   GLU  80          2HB       GLU  80 -16.377 -10.037 -14.910
  643   2HB   GLU  80          1HB       GLU  80 -17.361  -9.043 -13.836
  644   1HG   GLU  80          2HG       GLU  80 -15.398  -7.350 -15.025
  645   2HG   GLU  80          1HG       GLU  80 -16.150  -8.291 -16.313
  646    H    THR  81           H        THR  81 -13.618  -7.455 -14.421
  647    HA   THR  81           HA       THR  81 -11.538  -9.535 -14.800
  648    HB   THR  81           HB       THR  81 -12.243  -9.822 -16.958
  649    HG1  THR  81           HG1      THR  81 -11.446  -7.329 -17.771
  650   1HG2  THR  81          1HG2      THR  81 -14.260  -8.323 -16.402
  651   2HG2  THR  81          3HG2      THR  81 -13.314  -7.026 -17.130
  652   3HG2  THR  81          2HG2      THR  81 -13.770  -8.432 -18.089
  653    H    LEU  82           H        LEU  82  -9.598  -8.328 -16.013
  654    HA   LEU  82           HA       LEU  82  -8.869  -6.137 -14.245
  655   1HB   LEU  82          2HB       LEU  82  -7.508  -7.800 -16.294
  656   2HB   LEU  82          1HB       LEU  82  -6.873  -6.169 -16.074
  657    HG   LEU  82           HG       LEU  82  -7.426  -7.970 -13.716
  658   1HD1  LEU  82          2HD1      LEU  82  -5.734  -8.795 -15.625
  659   2HD1  LEU  82          1HD1      LEU  82  -4.652  -7.688 -14.775
  660   3HD1  LEU  82          3HD1      LEU  82  -5.402  -9.032 -13.906
  661   1HD2  LEU  82          3HD2      LEU  82  -6.117  -5.359 -14.236
  662   2HD2  LEU  82          2HD2      LEU  82  -6.963  -5.928 -12.797
  663   3HD2  LEU  82          1HD2      LEU  82  -5.294  -6.417 -13.090
  664    H    GLN  83           H        GLN  83  -9.775  -6.554 -17.625
  665    HA   GLN  83           HA       GLN  83  -9.276  -3.812 -18.357
  666   1HB   GLN  83          2HB       GLN  83  -9.510  -5.811 -19.942
  667   2HB   GLN  83          1HB       GLN  83 -11.250  -5.665 -19.697
  668   1HG   GLN  83          2HG       GLN  83 -11.376  -3.646 -20.820
  669   2HG   GLN  83          1HG       GLN  83  -9.721  -3.195 -20.410
  670   1HE2  GLN  83          1HE2      GLN  83 -11.499  -3.911 -23.054
  671   2HE2  GLN  83          2HE2      GLN  83 -10.338  -4.703 -24.007
  672    H    GLN  84           H        GLN  84 -12.090  -5.608 -17.198
  673    HA   GLN  84           HA       GLN  84 -14.002  -3.506 -17.540
  674   1HB   GLN  84          2HB       GLN  84 -13.857  -5.961 -15.826
  675   2HB   GLN  84          1HB       GLN  84 -15.128  -4.781 -15.542
  676   1HG   GLN  84          2HG       GLN  84 -15.585  -6.745 -17.212
  677   2HG   GLN  84          1HG       GLN  84 -16.111  -5.125 -17.625
  678   1HE2  GLN  84          2HE2      GLN  84 -13.921  -6.931 -20.306
  679   2HE2  GLN  84          1HE2      GLN  84 -14.997  -7.646 -19.203
  680    H    LEU  85           H        LEU  85 -11.720  -4.270 -14.960
  681    HA   LEU  85           HA       LEU  85 -12.792  -2.168 -13.212
  682   1HB   LEU  85          2HB       LEU  85 -11.367  -2.974 -11.610
  683   2HB   LEU  85          1HB       LEU  85 -11.342  -4.383 -12.664
  684    HG   LEU  85           HG       LEU  85  -9.382  -2.790 -13.771
  685   1HD1  LEU  85          3HD1      LEU  85  -9.864  -1.726 -11.216
  686   2HD1  LEU  85          2HD1      LEU  85  -8.404  -2.703 -11.051
  687   3HD1  LEU  85          1HD1      LEU  85  -8.470  -1.410 -12.249
  688   1HD2  LEU  85          3HD2      LEU  85  -9.636  -5.293 -12.703
  689   2HD2  LEU  85          2HD2      LEU  85  -8.161  -4.625 -13.401
  690   3HD2  LEU  85          1HD2      LEU  85  -8.422  -4.558 -11.657
  691    H    VAL  86           H        VAL  86 -10.154  -2.416 -15.574
  692    HA   VAL  86           HA       VAL  86  -9.016   0.085 -14.829
  693    HB   VAL  86           HB       VAL  86  -7.840   0.052 -16.897
  694   1HG1  VAL  86          2HG1      VAL  86  -8.152  -2.324 -15.356
  695   2HG1  VAL  86          1HG1      VAL  86  -8.000  -2.800 -17.047
  696   3HG1  VAL  86          3HG1      VAL  86  -6.747  -1.813 -16.292
  697   1HG2  VAL  86          3HG2      VAL  86 -10.360  -0.950 -17.889
  698   2HG2  VAL  86          2HG2      VAL  86  -9.015  -0.256 -18.790
  699   3HG2  VAL  86          1HG2      VAL  86  -9.042  -1.982 -18.438
  700    H    GLN  87           H        GLN  87 -11.863  -0.893 -16.393
  701    HA   GLN  87           HA       GLN  87 -12.483   1.564 -17.774
  702   1HB   GLN  87          2HB       GLN  87 -13.403  -0.701 -18.342
  703   2HB   GLN  87          1HB       GLN  87 -14.352  -0.627 -16.866
  704   1HG   GLN  87          2HG       GLN  87 -15.609   1.227 -17.626
  705   2HG   GLN  87          1HG       GLN  87 -14.476   1.567 -18.934
  706   1HE2  GLN  87          2HE2      GLN  87 -17.394  -0.239 -20.416
  707   2HE2  GLN  87          1HE2      GLN  87 -17.178   1.238 -19.608
  708    H    HIS  88           H        HIS  88 -13.502   0.069 -14.737
  709    HA   HIS  88           HA       HIS  88 -15.322   2.149 -14.002
  710   1HB   HIS  88          2HB       HIS  88 -15.104  -0.288 -13.107
  711   2HB   HIS  88          1HB       HIS  88 -13.899   0.395 -12.023
  712    HD1  HIS  88           HD1      HIS  88 -14.718   2.008 -10.177
  713    HD2  HIS  88           HD2      HIS  88 -17.784   0.615 -12.634
  714    HE1  HIS  88           HE1      HIS  88 -16.891   2.665  -9.053
  715    H    TYR  89           H        TYR  89 -11.977   1.421 -13.248
  716    HA   TYR  89           HA       TYR  89 -11.666   3.713 -11.517
  717   1HB   TYR  89          2HB       TYR  89  -9.682   1.816 -12.783
  718   2HB   TYR  89          1HB       TYR  89  -9.209   3.126 -11.709
  719    HD1  TYR  89           HD1      TYR  89 -11.721   0.345 -11.829
  720    HD2  TYR  89           HD2      TYR  89  -8.974   2.611  -9.436
  721    HE1  TYR  89           HE1      TYR  89 -12.226  -1.098  -9.905
  722    HE2  TYR  89           HE2      TYR  89  -9.481   1.158  -7.493
  723    HH   TYR  89           HH       TYR  89 -11.653  -0.352  -6.844
  724    H    SER  90           H        SER  90 -11.629   3.193 -14.891
  725    HA   SER  90           HA       SER  90  -9.774   5.142 -15.759
  726   1HB   SER  90          2HB       SER  90 -11.886   3.547 -16.932
  727   2HB   SER  90          1HB       SER  90 -11.898   5.182 -17.595
  728    HG   SER  90           HG       SER  90  -9.678   4.937 -18.043
  729    H    GLU  91           H        GLU  91 -13.191   5.386 -14.893
  730    HA   GLU  91           HA       GLU  91 -13.010   8.345 -15.195
  731   1HB   GLU  91          2HB       GLU  91 -15.486   6.669 -14.698
  732   2HB   GLU  91          1HB       GLU  91 -15.423   8.355 -15.211
  733   1HG   GLU  91          2HG       GLU  91 -13.870   7.018 -17.104
  734   2HG   GLU  91          1HG       GLU  91 -15.224   5.925 -16.816
  735    H    ARG  92           H        ARG  92 -12.863   5.882 -12.859
  736    HA   ARG  92           HA       ARG  92 -13.350   7.925 -10.725
  737   1HB   ARG  92          2HB       ARG  92 -14.103   5.011 -10.432
  738   2HB   ARG  92          1HB       ARG  92 -14.527   6.350  -9.368
  739   1HG   ARG  92          2HG       ARG  92 -15.359   6.621 -12.208
  740   2HG   ARG  92          1HG       ARG  92 -16.204   5.396 -11.264
  741   1HD   ARG  92          2HD       ARG  92 -15.964   7.724  -9.634
  742   2HD   ARG  92          1HD       ARG  92 -16.568   8.236 -11.211
  743    HE   ARG  92           HE       ARG  92 -18.223   6.184 -10.775
  744   1HH1  ARG  92          1HH2      ARG  92 -18.488   5.481  -8.262
  745   2HH1  ARG  92          2HH2      ARG  92 -19.213   6.771  -7.362
  746   1HH2  ARG  92          2HH1      ARG  92 -18.521   9.182  -9.756
  747   2HH2  ARG  92          1HH1      ARG  92 -19.232   8.867  -8.208
  748    H    ALA  93           H        ALA  93 -12.203   7.397  -8.684
  749    HA   ALA  93           HA       ALA  93  -9.581   6.171  -9.276
  750   1HB   ALA  93          2HB       ALA  93  -9.767   8.382  -8.079
  751   2HB   ALA  93          1HB       ALA  93 -10.502   7.523  -6.725
  752   3HB   ALA  93          3HB       ALA  93  -8.839   7.168  -7.197
  753    H    ALA  94           H        ALA  94 -12.074   5.928  -6.759
  754    HA   ALA  94           HA       ALA  94 -13.018   3.819  -6.016
  755   1HB   ALA  94          3HB       ALA  94 -11.437   2.641  -7.707
  756   2HB   ALA  94          2HB       ALA  94 -10.317   2.528  -6.349
  757   3HB   ALA  94          1HB       ALA  94 -11.902   1.763  -6.249
  758    H    GLY  95           H        GLY  95 -10.466   5.763  -5.077
  759   1HA   GLY  95          2HA       GLY  95 -10.442   6.357  -2.657
  760   2HA   GLY  95          1HA       GLY  95 -10.607   4.637  -2.308
  761    H    LEU  96           H        LEU  96  -8.575   4.678  -4.853
  762    HA   LEU  96           HA       LEU  96  -6.257   4.216  -3.161
  763   1HB   LEU  96          2HB       LEU  96  -5.127   3.525  -5.144
  764   2HB   LEU  96          1HB       LEU  96  -6.777   2.933  -5.288
  765    HG   LEU  96           HG       LEU  96  -5.700   5.461  -6.561
  766   1HD1  LEU  96          1HD1      LEU  96  -5.623   2.676  -7.314
  767   2HD1  LEU  96          3HD1      LEU  96  -6.595   3.592  -8.464
  768   3HD1  LEU  96          2HD1      LEU  96  -4.924   4.065  -8.151
  769   1HD2  LEU  96          1HD2      LEU  96  -8.384   4.103  -6.582
  770   2HD2  LEU  96          3HD2      LEU  96  -8.021   5.794  -6.241
  771   3HD2  LEU  96          2HD2      LEU  96  -7.888   5.179  -7.887
  772    H    SER  97           H        SER  97  -4.287   5.272  -5.046
  773    HA   SER  97           HA       SER  97  -4.074   7.937  -3.909
  774   1HB   SER  97          2HB       SER  97  -2.054   7.926  -5.645
  775   2HB   SER  97          1HB       SER  97  -1.970   7.020  -4.133
  776    HG   SER  97           HG       SER  97  -1.552   5.459  -5.502
  777    H    SER  98           H        SER  98  -4.582   6.669  -7.203
  778    HA   SER  98           HA       SER  98  -6.120   9.029  -7.912
  779   1HB   SER  98          2HB       SER  98  -3.678   8.833  -9.605
  780   2HB   SER  98          1HB       SER  98  -4.633  10.249  -9.164
  781    HG   SER  98           HG       SER  98  -2.787   8.830  -7.554
  782    H    ARG  99           H        ARG  99  -7.350   6.923  -8.300
  783    HA   ARG  99           HA       ARG  99  -8.068   5.175  -9.729
  784   1HB   ARG  99          2HB       ARG  99  -8.750   6.070 -11.890
  785   2HB   ARG  99          1HB       ARG  99  -9.021   7.286 -10.645
  786   1HG   ARG  99          2HG       ARG  99  -6.870   8.362 -11.239
  787   2HG   ARG  99          1HG       ARG  99  -6.633   7.164 -12.511
  788   1HD   ARG  99          2HD       ARG  99  -7.870   8.426 -13.905
  789   2HD   ARG  99          1HD       ARG  99  -9.254   8.232 -12.828
  790    HE   ARG  99           HE       ARG  99  -7.259  10.446 -12.534
  791   1HH1  ARG  99          2HH1      ARG  99  -9.148   9.953 -10.258
  792   2HH1  ARG  99          1HH1      ARG  99 -10.451  11.031 -10.630
  793   1HH2  ARG  99          1HH2      ARG  99  -9.493  11.477 -13.932
  794   2HH2  ARG  99          2HH2      ARG  99 -10.648  11.894 -12.709
  795    H    LEU 100           H        LEU 100  -7.245   5.319 -12.681
  796    HA   LEU 100           HA       LEU 100  -4.629   3.920 -12.337
  797   1HB   LEU 100          2HB       LEU 100  -5.533   2.999 -14.725
  798   2HB   LEU 100          1HB       LEU 100  -5.911   2.217 -13.193
  799    HG   LEU 100           HG       LEU 100  -7.971   3.678 -13.059
  800   1HD1  LEU 100          1HD1      LEU 100  -6.679   4.921 -15.260
  801   2HD1  LEU 100          3HD1      LEU 100  -8.165   4.201 -15.875
  802   3HD1  LEU 100          2HD1      LEU 100  -8.229   5.351 -14.538
  803   1HD2  LEU 100          3HD2      LEU 100  -7.946   1.311 -13.933
  804   2HD2  LEU 100          2HD2      LEU 100  -9.267   2.308 -14.540
  805   3HD2  LEU 100          1HD2      LEU 100  -7.864   1.985 -15.560
  806    H    VAL 101           H        VAL 101  -3.977   3.841 -15.156
  807    HA   VAL 101           HA       VAL 101  -2.584   6.211 -15.534
  808    HB   VAL 101           HB       VAL 101  -2.798   5.692 -18.021
  809   1HG1  VAL 101          3HG1      VAL 101  -2.016   3.456 -16.134
  810   2HG1  VAL 101          2HG1      VAL 101  -1.506   3.591 -17.817
  811   3HG1  VAL 101          1HG1      VAL 101  -0.979   4.791 -16.636
  812   1HG2  VAL 101          3HG2      VAL 101  -4.818   3.865 -16.860
  813   2HG2  VAL 101          2HG2      VAL 101  -4.741   4.579 -18.470
  814   3HG2  VAL 101          1HG2      VAL 101  -3.765   3.161 -18.088
  815    H    VAL 102           H        VAL 102  -3.599   8.154 -15.156
  816    HA   VAL 102           HA       VAL 102  -6.289   8.735 -16.019
  817    HB   VAL 102           HB       VAL 102  -4.315  10.931 -15.526
  818   1HG1  VAL 102          2HG1      VAL 102  -7.214  10.385 -15.228
  819   2HG1  VAL 102          1HG1      VAL 102  -6.484  11.376 -13.964
  820   3HG1  VAL 102          3HG1      VAL 102  -6.389  11.885 -15.650
  821   1HG2  VAL 102          2HG2      VAL 102  -5.018   8.726 -13.647
  822   2HG2  VAL 102          1HG2      VAL 102  -3.555   9.707 -13.729
  823   3HG2  VAL 102          3HG2      VAL 102  -5.018  10.365 -12.998
  824    HA   PRO 103           HA       PRO 103  -4.131  11.071 -19.581
  825   1HB   PRO 103          2HB       PRO 103  -1.449  10.605 -19.965
  826   2HB   PRO 103          1HB       PRO 103  -2.081  11.912 -18.951
  827   1HG   PRO 103          2HG       PRO 103  -0.812   9.338 -18.136
  828   2HG   PRO 103          1HG       PRO 103  -0.896  10.872 -17.256
  829   1HD   PRO 103          2HD       PRO 103  -2.506   8.575 -16.803
  830   2HD   PRO 103          1HD       PRO 103  -2.762  10.189 -16.113
  831    H    SER 104           H        SER 104  -2.691  10.240 -21.698
  832    HA   SER 104           HA       SER 104  -3.097   7.302 -21.969
  833   1HB   SER 104          2HB       SER 104  -5.081   8.694 -22.860
  834   2HB   SER 104          1HB       SER 104  -3.977   9.218 -24.131
  835    HG   SER 104           HG       SER 104  -5.273   7.290 -24.574
  836    H    HIS 105           H        HIS 105  -1.033   6.648 -22.402
  837    HA   HIS 105           HA       HIS 105   1.113   8.097 -23.377
  838   1HB   HIS 105          2HB       HIS 105   2.112   6.012 -24.061
  839   2HB   HIS 105          1HB       HIS 105   1.129   5.673 -22.637
  840    HD1  HIS 105           HD1      HIS 105   1.779   4.308 -25.837
  841    HD2  HIS 105           HD2      HIS 105  -1.718   4.927 -23.652
  842    HE1  HIS 105           HE1      HIS 105   0.030   2.769 -26.832
  843    H    LYS 106           HN       LYS 106  -1.652   6.942 -25.177
  844    HA   LYS 106           HA       LYS 106  -0.828   6.891 -27.801
  845   1HB   LYS 106          2HB       LYS 106  -3.160   6.573 -27.265
  846   2HB   LYS 106          1HB       LYS 106  -3.294   8.223 -26.654
  847   1HG   LYS 106          2HG       LYS 106  -3.444   9.122 -28.748
  848   2HG   LYS 106          1HG       LYS 106  -2.288   7.977 -29.430
  849   1HD   LYS 106          2HD       LYS 106  -3.935   6.297 -29.690
  850   2HD   LYS 106          1HD       LYS 106  -5.052   7.101 -28.588
  851   1HE   LYS 106          2HE       LYS 106  -6.015   7.984 -30.436
  852   2HE   LYS 106          1HE       LYS 106  -4.590   9.017 -30.549
  853   1HZ   LYS 106          2HZ       LYS 106  -4.443   6.302 -31.642
  854   2HZ   LYS 106          1HZ       LYS 106  -5.293   7.480 -32.522
  855   3HZ   LYS 106          3HZ       LYS 106  -3.655   7.718 -32.152
  856   1H    GLU 201          2HT       GLU 201   7.134  -6.732   5.137
  857   2H    GLU 201          1HT       GLU 201   8.458  -6.525   6.182
  858   3H    GLU 201          3HT       GLU 201   6.918  -5.995   6.653
  859    HA   GLU 201           HA       GLU 201   7.480  -3.998   5.898
  860   1HB   GLU 201          2HB       GLU 201   9.878  -5.122   5.814
  861   2HB   GLU 201          1HB       GLU 201   9.622  -5.028   4.070
  862   1HG   GLU 201          2HG       GLU 201   9.164  -2.609   4.267
  863   2HG   GLU 201          1HG       GLU 201   9.434  -2.703   6.008
  864    HA   PRO 202           HA       PRO 202   5.295  -5.217   1.990
  865   1HB   PRO 202          2HB       PRO 202   2.819  -4.317   2.779
  866   2HB   PRO 202          1HB       PRO 202   3.393  -5.970   3.056
  867   1HG   PRO 202          2HG       PRO 202   3.114  -3.730   5.005
  868   2HG   PRO 202          1HG       PRO 202   3.061  -5.477   5.290
  869   1HD   PRO 202          2HD       PRO 202   5.264  -3.779   5.812
  870   2HD   PRO 202          1HD       PRO 202   5.301  -5.555   5.773
  871    H    GLN 203           H        GLN 203   4.566  -3.699   0.366
  872    HA   GLN 203           HA       GLN 203   4.670  -0.823   1.159
  873   1HB   GLN 203          2HB       GLN 203   6.730  -2.048  -0.172
  874   2HB   GLN 203          1HB       GLN 203   5.750  -1.456  -1.514
  875   1HG   GLN 203          2HG       GLN 203   6.659   0.579  -1.178
  876   2HG   GLN 203          1HG       GLN 203   5.785   0.646   0.352
  877   1HE2  GLN 203          2HE2      GLN 203   9.037   0.995   1.771
  878   2HE2  GLN 203          1HE2      GLN 203   7.615   1.818   1.346
  879   1HN   PTR 204          1HN       PTR 204   2.448  -2.726   0.511
  880    HA   PTR 204           HA       PTR 204   1.444  -1.494  -2.014
  881   1HB   PTR 204          1HB       PTR 204  -0.387  -3.337  -1.633
  882    HD1  PTR 204           HD1      PTR 204   0.984  -2.300  -3.867
  883    HD2  PTR 204           HD2      PTR 204   1.990  -5.772  -1.542
  884    HE1  PTR 204           HE1      PTR 204   2.220  -3.242  -5.801
  885    HE2  PTR 204           HE2      PTR 204   3.227  -6.710  -3.474
  886    H    GLU 205           H        GLU 205   0.636   0.482  -1.270
  887    HA   GLU 205           HA       GLU 205  -0.631   1.119   1.103
  888   1HB   GLU 205          2HB       GLU 205  -1.711   2.041  -1.570
  889   2HB   GLU 205          1HB       GLU 205  -1.708   2.923  -0.041
  890   1HG   GLU 205          2HG       GLU 205   0.983   2.239  -0.523
  891   2HG   GLU 205          1HG       GLU 205   0.351   2.802  -2.071
  892    H    GLU 206           H        GLU 206  -2.875   1.145   1.781
  893    HA   GLU 206           HA       GLU 206  -4.673  -0.706   0.292
  894   1HB   GLU 206          2HB       GLU 206  -5.341  -1.488   2.726
  895   2HB   GLU 206          1HB       GLU 206  -3.958  -2.219   1.912
  896   1HG   GLU 206          2HG       GLU 206  -2.415  -1.108   3.230
  897   2HG   GLU 206          1HG       GLU 206  -3.495   0.255   3.526
  898    H    ILE 207           H        ILE 207  -6.572   0.338  -0.035
  899    HA   ILE 207           HA       ILE 207  -7.203   2.853   1.149
  900    HB   ILE 207           HB       ILE 207  -8.824   0.813  -0.374
  901   1HG1  ILE 207          2HG1      ILE 207  -8.843   3.318  -1.616
  902   2HG1  ILE 207          1HG1      ILE 207  -7.213   3.173  -0.959
  903   1HG2  ILE 207          1HG2      ILE 207  -9.797   3.003   1.310
  904   2HG2  ILE 207          3HG2      ILE 207 -10.306   3.164  -0.371
  905   3HG2  ILE 207          2HG2      ILE 207 -10.699   1.702   0.533
  906   1HD1  ILE 207          2HD1      ILE 207  -7.905   0.647  -2.077
  907   2HD1  ILE 207          1HD1      ILE 207  -8.318   1.882  -3.268
  908   3HD1  ILE 207          3HD1      ILE 207  -6.674   1.778  -2.637
  909    HA   PRO 208           HA       PRO 208  -8.695   1.230   5.035
  910   1HB   PRO 208          2HB       PRO 208  -9.227   3.688   6.142
  911   2HB   PRO 208          1HB       PRO 208  -7.601   2.988   6.050
  912   1HG   PRO 208          2HG       PRO 208  -8.788   5.192   4.432
  913   2HG   PRO 208          1HG       PRO 208  -7.090   4.879   4.826
  914   1HD   PRO 208          2HD       PRO 208  -8.361   4.297   2.361
  915   2HD   PRO 208          1HD       PRO 208  -6.767   3.710   2.882
  916    H    ILE 209           H        ILE 209 -10.738   2.323   6.476
  917    HA   ILE 209           HA       ILE 209 -13.002   2.783   4.606
  918    HB   ILE 209           HB       ILE 209 -13.131   0.739   6.837
  919   1HG1  ILE 209          2HG1      ILE 209 -13.035   0.110   3.885
  920   2HG1  ILE 209          1HG1      ILE 209 -11.561   0.196   4.849
  921   1HG2  ILE 209          3HG2      ILE 209 -14.972   1.625   4.613
  922   2HG2  ILE 209          2HG2      ILE 209 -15.166   0.062   5.406
  923   3HG2  ILE 209          1HG2      ILE 209 -15.305   1.549   6.343
  924   1HD1  ILE 209          1HD1      ILE 209 -13.629  -1.369   6.178
  925   2HD1  ILE 209          3HD1      ILE 209 -13.227  -2.027   4.592
  926   3HD1  ILE 209          2HD1      ILE 209 -11.962  -1.809   5.801
  927    H    TYR 210           H        TYR 210 -11.842   2.643   7.944
  928    HA   TYR 210           HA       TYR 210 -13.940   3.927   9.276
  929   1HB   TYR 210          2HB       TYR 210 -11.924   4.965  10.636
  930   2HB   TYR 210          1HB       TYR 210 -12.250   3.238  10.716
  931    HD1  TYR 210           HD1      TYR 210 -10.353   5.725   8.640
  932    HD2  TYR 210           HD2      TYR 210 -10.501   1.757  10.279
  933    HE1  TYR 210           HE1      TYR 210  -8.093   5.265   7.729
  934    HE2  TYR 210           HE2      TYR 210  -8.240   1.298   9.368
  935    HH   TYR 210           HH       TYR 210  -6.701   2.054   7.806
  936    H    LEU 211           HN       LEU 211 -13.402   6.337  10.241
  937    HA   LEU 211           HA       LEU 211 -12.983   8.078   7.841
  938   1HB   LEU 211          2HB       LEU 211 -15.322   7.787   9.364
  939   2HB   LEU 211          1HB       LEU 211 -14.607   9.301   9.919
  940    HG   LEU 211           HG       LEU 211 -16.082   9.727   8.006
  941   1HD1  LEU 211          2HD1      LEU 211 -13.169  10.186   7.938
  942   2HD1  LEU 211          1HD1      LEU 211 -13.967  10.358   6.374
  943   3HD1  LEU 211          3HD1      LEU 211 -14.494  11.335   7.745
  944   1HD2  LEU 211          3HD2      LEU 211 -14.805   7.312   7.034
  945   2HD2  LEU 211          2HD2      LEU 211 -16.254   8.120   6.434
  946   3HD2  LEU 211          1HD2      LEU 211 -14.665   8.608   5.845
   
  No H/Q in entry =         946
  Start of MODEL   10
    1   1H    SER   1          1HT       SER   1  -9.522  -9.249 -19.368
    2   2H    SER   1          3HT       SER   1 -10.811 -10.121 -20.042
    3   3H    SER   1          2HT       SER   1  -9.214 -10.641 -20.293
    4    HA   SER   1           HA       SER   1  -9.530  -9.604 -22.268
    5   1HB   SER   1          2HB       SER   1 -11.895  -8.902 -21.300
    6   2HB   SER   1          1HB       SER   1 -11.104  -7.339 -21.090
    7    HG   SER   1           HG       SER   1 -11.538  -7.082 -23.119
    8    H    ILE   2           H        ILE   2  -7.708  -9.023 -19.890
    9    HA   ILE   2           HA       ILE   2  -6.967  -6.345 -19.671
   10    HB   ILE   2           HB       ILE   2  -5.889  -8.256 -18.464
   11   1HG1  ILE   2          2HG1      ILE   2  -3.442  -7.180 -19.356
   12   2HG1  ILE   2          1HG1      ILE   2  -4.630  -5.896 -19.575
   13   1HG2  ILE   2          3HG2      ILE   2  -5.568  -9.389 -20.883
   14   2HG2  ILE   2          2HG2      ILE   2  -3.989  -8.620 -20.727
   15   3HG2  ILE   2          1HG2      ILE   2  -4.527  -9.779 -19.513
   16   1HD1  ILE   2          1HD1      ILE   2  -5.412  -6.622 -17.162
   17   2HD1  ILE   2          3HD1      ILE   2  -3.780  -7.284 -17.053
   18   3HD1  ILE   2          2HD1      ILE   2  -4.016  -5.562 -17.352
   19    H    GLN   3           H        GLN   3  -5.679  -4.928 -20.916
   20    HA   GLN   3           HA       GLN   3  -5.562  -5.602 -23.784
   21   1HB   GLN   3          2HB       GLN   3  -6.498  -3.422 -23.060
   22   2HB   GLN   3          1HB       GLN   3  -4.940  -3.002 -22.343
   23   1HG   GLN   3          2HG       GLN   3  -4.308  -2.199 -24.352
   24   2HG   GLN   3          1HG       GLN   3  -4.374  -3.846 -24.978
   25   1HE2  GLN   3          2HE2      GLN   3  -7.076  -1.187 -26.265
   26   2HE2  GLN   3          1HE2      GLN   3  -5.672  -0.757 -25.414
   27    H    ALA   4           H        ALA   4  -3.203  -3.321 -22.941
   28    HA   ALA   4           HA       ALA   4  -1.005  -5.048 -22.279
   29   1HB   ALA   4          1HB       ALA   4  -1.683  -4.596 -25.135
   30   2HB   ALA   4          3HB       ALA   4   0.020  -4.473 -24.699
   31   3HB   ALA   4          2HB       ALA   4  -0.866  -5.964 -24.380
   32    H    GLU   5           H        GLU   5  -2.223  -2.340 -21.777
   33    HA   GLU   5           HA       GLU   5  -0.047  -0.817 -21.074
   34   1HB   GLU   5          2HB       GLU   5   0.004   0.831 -23.093
   35   2HB   GLU   5          1HB       GLU   5   0.899  -0.683 -23.226
   36   1HG   GLU   5          2HG       GLU   5  -0.555  -1.564 -24.771
   37   2HG   GLU   5          1HG       GLU   5  -1.953  -0.743 -24.077
   38    H    GLU   6           H        GLU   6  -0.664   1.748 -21.413
   39    HA   GLU   6           HA       GLU   6  -2.273   3.432 -21.057
   40   1HB   GLU   6          2HB       GLU   6  -4.429   1.356 -21.456
   41   2HB   GLU   6          1HB       GLU   6  -4.514   3.094 -21.744
   42   1HG   GLU   6          2HG       GLU   6  -2.364   2.044 -23.307
   43   2HG   GLU   6          1HG       GLU   6  -3.783   1.034 -23.585
   44    H    TRP   7           H        TRP   7  -1.744   0.736 -19.235
   45    HA   TRP   7           HA       TRP   7  -2.284   1.803 -16.741
   46   1HB   TRP   7          2HB       TRP   7  -4.443   0.628 -16.142
   47   2HB   TRP   7          1HB       TRP   7  -4.634   1.996 -17.239
   48    HD1  TRP   7           HD1      TRP   7  -5.206   1.477 -19.773
   49    HE1  TRP   7           HE1      TRP   7  -6.171  -0.613 -20.934
   50    HE3  TRP   7           HE3      TRP   7  -4.470  -1.982 -16.097
   51    HZ2  TRP   7           HZ2      TRP   7  -6.571  -3.389 -20.375
   52    HZ3  TRP   7           HZ3      TRP   7  -5.142  -4.342 -16.436
   53    HH2  TRP   7           HH2      TRP   7  -6.192  -5.050 -18.569
   54    H    TYR   8           H        TYR   8  -1.964  -0.918 -18.827
   55    HA   TYR   8           HA       TYR   8  -0.960  -2.494 -16.520
   56   1HB   TYR   8          2HB       TYR   8  -2.892  -3.640 -16.726
   57   2HB   TYR   8          1HB       TYR   8  -3.173  -3.105 -18.374
   58    HD1  TYR   8           HD1      TYR   8  -2.031  -4.249 -20.276
   59    HD2  TYR   8           HD2      TYR   8  -1.802  -5.714 -16.246
   60    HE1  TYR   8           HE1      TYR   8  -1.282  -6.458 -21.122
   61    HE2  TYR   8           HE2      TYR   8  -1.047  -7.916 -17.092
   62    HH   TYR   8           HH       TYR   8  -1.429  -9.177 -19.530
   63    H    PHE   9           H        PHE   9   0.981  -3.417 -16.878
   64    HA   PHE   9           HA       PHE   9   2.171  -3.127 -19.579
   65   1HB   PHE   9          2HB       PHE   9   3.276  -3.476 -16.804
   66   2HB   PHE   9          1HB       PHE   9   4.283  -3.838 -18.205
   67    HD1  PHE   9           HD1      PHE   9   1.655  -1.299 -18.456
   68    HD2  PHE   9           HD2      PHE   9   5.824  -1.964 -17.648
   69    HE1  PHE   9           HE1      PHE   9   2.100   1.122 -18.754
   70    HE2  PHE   9           HE2      PHE   9   6.266   0.457 -17.947
   71    HZ   PHE   9           HZ       PHE   9   4.405   2.000 -18.499
   72    H    GLY  10           H        GLY  10   1.732  -5.606 -17.049
   73   1HA   GLY  10          2HA       GLY  10   0.974  -7.784 -18.396
   74   2HA   GLY  10          1HA       GLY  10   2.629  -7.675 -18.973
   75    H    LYS  11           H        LYS  11   3.692  -9.283 -17.945
   76    HA   LYS  11           HA       LYS  11   3.297  -9.580 -15.006
   77   1HB   LYS  11          2HB       LYS  11   4.532 -11.635 -16.851
   78   2HB   LYS  11          1HB       LYS  11   3.909 -11.879 -15.220
   79   1HG   LYS  11          2HG       LYS  11   1.684 -11.792 -15.913
   80   2HG   LYS  11          1HG       LYS  11   2.066 -10.853 -17.356
   81   1HD   LYS  11          2HD       LYS  11   2.372 -12.720 -18.591
   82   2HD   LYS  11          1HD       LYS  11   3.416 -13.437 -17.363
   83   1HE   LYS  11          2HE       LYS  11   1.703 -14.906 -17.075
   84   2HE   LYS  11          1HE       LYS  11   0.961 -13.600 -16.153
   85   1HZ   LYS  11          2HZ       LYS  11  -0.095 -12.829 -18.203
   86   2HZ   LYS  11          1HZ       LYS  11   0.573 -14.144 -19.046
   87   3HZ   LYS  11          3HZ       LYS  11  -0.561 -14.416 -17.815
   88    H    LEU  12           H        LEU  12   4.789  -7.673 -14.988
   89    HA   LEU  12           HA       LEU  12   7.623  -8.532 -15.368
   90   1HB   LEU  12          2HB       LEU  12   8.025  -6.562 -16.387
   91   2HB   LEU  12          1HB       LEU  12   6.285  -6.345 -16.445
   92    HG   LEU  12           HG       LEU  12   8.210  -5.243 -14.397
   93   1HD1  LEU  12          1HD1      LEU  12   6.368  -4.112 -16.502
   94   2HD1  LEU  12          3HD1      LEU  12   6.923  -3.120 -15.151
   95   3HD1  LEU  12          2HD1      LEU  12   8.091  -3.814 -16.277
   96   1HD2  LEU  12          2HD2      LEU  12   5.426  -5.959 -14.066
   97   2HD2  LEU  12          1HD2      LEU  12   6.585  -5.349 -12.881
   98   3HD2  LEU  12          3HD2      LEU  12   5.670  -4.219 -13.878
   99    H    GLY  13           H        GLY  13   8.961  -6.755 -13.779
  100   1HA   GLY  13          2HA       GLY  13   8.045  -7.613 -11.091
  101   2HA   GLY  13          1HA       GLY  13   9.659  -7.023 -11.483
  102    H    ARG  14           H        ARG  14   7.817  -6.093  -9.363
  103    HA   ARG  14           HA       ARG  14   6.585  -3.609 -10.031
  104   1HB   ARG  14          2HB       ARG  14   6.744  -3.104  -7.640
  105   2HB   ARG  14          1HB       ARG  14   6.292  -4.794  -7.856
  106   1HG   ARG  14          2HG       ARG  14   9.204  -4.160  -7.694
  107   2HG   ARG  14          1HG       ARG  14   8.268  -4.070  -6.202
  108   1HD   ARG  14          2HD       ARG  14   7.341  -6.416  -7.218
  109   2HD   ARG  14          1HD       ARG  14   8.989  -6.430  -7.845
  110    HE   ARG  14           HE       ARG  14   9.077  -5.729  -5.081
  111   1HH1  ARG  14          1HH1      ARG  14   9.055  -9.553  -6.144
  112   2HH1  ARG  14          2HH1      ARG  14   8.810  -8.311  -7.328
  113   1HH2  ARG  14          1HH2      ARG  14   9.198  -7.345  -3.474
  114   2HH2  ARG  14          2HH2      ARG  14   9.275  -9.006  -3.962
  115    H    LYS  15           H        LYS  15   9.873  -4.537  -9.735
  116    HA   LYS  15           HA       LYS  15  10.939  -1.888  -9.278
  117   1HB   LYS  15          2HB       LYS  15  12.317  -4.388 -10.287
  118   2HB   LYS  15          1HB       LYS  15  13.116  -2.945  -9.660
  119   1HG   LYS  15          2HG       LYS  15  12.432  -3.364  -7.461
  120   2HG   LYS  15          1HG       LYS  15  11.077  -4.371  -7.971
  121   1HD   LYS  15          2HD       LYS  15  12.392  -6.167  -7.606
  122   2HD   LYS  15          1HD       LYS  15  13.356  -5.654  -8.990
  123   1HE   LYS  15          2HE       LYS  15  14.737  -4.245  -7.497
  124   2HE   LYS  15          1HE       LYS  15  13.778  -4.776  -6.116
  125   1HZ   LYS  15          3HZ       LYS  15  15.308  -6.588  -7.903
  126   2HZ   LYS  15          2HZ       LYS  15  15.854  -6.037  -6.391
  127   3HZ   LYS  15          1HZ       LYS  15  14.476  -7.026  -6.491
  128    H    ASP  16           H        ASP  16  10.138  -3.908 -12.017
  129    HA   ASP  16           HA       ASP  16  11.579  -2.376 -13.959
  130   1HB   ASP  16          2HB       ASP  16  10.355  -4.811 -13.907
  131   2HB   ASP  16          1HB       ASP  16   9.172  -3.838 -14.743
  132    H    ALA  17           H        ALA  17   8.464  -2.240 -12.412
  133    HA   ALA  17           HA       ALA  17   7.228  -0.451 -14.314
  134   1HB   ALA  17          2HB       ALA  17   6.577  -1.135 -11.440
  135   2HB   ALA  17          1HB       ALA  17   5.578  -0.077 -12.438
  136   3HB   ALA  17          3HB       ALA  17   5.796  -1.768 -12.890
  137    H    GLU  18           H        GLU  18   8.683   0.024 -11.095
  138    HA   GLU  18           HA       GLU  18   8.399   2.867 -11.072
  139   1HB   GLU  18          2HB       GLU  18  10.023   2.858  -9.279
  140   2HB   GLU  18          1HB       GLU  18   8.997   1.438  -9.085
  141   1HG   GLU  18          2HG       GLU  18  10.902   0.226  -9.032
  142   2HG   GLU  18          1HG       GLU  18  11.044   0.559 -10.756
  143    H    ARG  19           H        ARG  19  10.755   0.741 -12.569
  144    HA   ARG  19           HA       ARG  19  12.572   2.956 -13.224
  145   1HB   ARG  19          2HB       ARG  19  12.697   0.084 -13.224
  146   2HB   ARG  19          1HB       ARG  19  13.129   0.675 -14.828
  147   1HG   ARG  19          2HG       ARG  19  14.395   2.412 -12.994
  148   2HG   ARG  19          1HG       ARG  19  14.667   0.781 -12.383
  149   1HD   ARG  19          2HD       ARG  19  14.995   1.082 -15.306
  150   2HD   ARG  19          1HD       ARG  19  16.181   1.953 -14.334
  151    HE   ARG  19           HE       ARG  19  15.706  -0.913 -13.712
  152   1HH1  ARG  19          1HH1      ARG  19  19.010   0.487 -15.372
  153   2HH1  ARG  19          2HH1      ARG  19  17.478   1.238 -15.669
  154   1HH2  ARG  19          1HH2      ARG  19  17.765  -1.731 -13.015
  155   2HH2  ARG  19          2HH2      ARG  19  19.173  -1.194 -13.870
  156    H    GLN  20           H        GLN  20   9.883   1.279 -14.678
  157    HA   GLN  20           HA       GLN  20  10.433   2.195 -17.391
  158   1HB   GLN  20          2HB       GLN  20   8.547   0.439 -16.102
  159   2HB   GLN  20          1HB       GLN  20   7.672   1.599 -17.102
  160   1HG   GLN  20          2HG       GLN  20   8.674   0.869 -19.064
  161   2HG   GLN  20          1HG       GLN  20  10.121   0.295 -18.234
  162   1HE2  GLN  20          2HE2      GLN  20   8.051  -2.681 -19.207
  163   2HE2  GLN  20          1HE2      GLN  20   8.777  -1.410 -20.066
  164    H    LEU  21           H        LEU  21   8.821   3.450 -14.577
  165    HA   LEU  21           HA       LEU  21   7.507   5.585 -16.152
  166   1HB   LEU  21          2HB       LEU  21   7.397   4.708 -13.274
  167   2HB   LEU  21          1HB       LEU  21   6.789   6.293 -13.750
  168    HG   LEU  21           HG       LEU  21   5.157   5.339 -15.204
  169   1HD1  LEU  21          1HD1      LEU  21   6.658   3.636 -16.214
  170   2HD1  LEU  21          3HD1      LEU  21   6.515   2.664 -14.750
  171   3HD1  LEU  21          2HD1      LEU  21   5.098   2.948 -15.761
  172   1HD2  LEU  21          3HD2      LEU  21   5.056   4.918 -12.548
  173   2HD2  LEU  21          2HD2      LEU  21   3.783   4.369 -13.638
  174   3HD2  LEU  21          1HD2      LEU  21   5.025   3.241 -13.094
  175    H    LEU  22           H        LEU  22   9.707   5.381 -13.344
  176    HA   LEU  22           HA       LEU  22  10.449   8.093 -13.239
  177   1HB   LEU  22          2HB       LEU  22  11.932   5.552 -12.566
  178   2HB   LEU  22          1HB       LEU  22  12.696   7.130 -12.367
  179    HG   LEU  22           HG       LEU  22  10.001   7.124 -11.277
  180   1HD1  LEU  22          3HD1      LEU  22  11.804   4.854 -10.631
  181   2HD1  LEU  22          2HD1      LEU  22  11.058   5.666  -9.255
  182   3HD1  LEU  22          1HD1      LEU  22  10.048   4.964 -10.519
  183   1HD2  LEU  22          2HD2      LEU  22  11.964   8.707 -10.854
  184   2HD2  LEU  22          1HD2      LEU  22  11.101   8.154  -9.420
  185   3HD2  LEU  22          3HD2      LEU  22  12.652   7.433  -9.848
  186    H    SER  23           H        SER  23  11.855   5.464 -15.202
  187    HA   SER  23           HA       SER  23  14.000   6.845 -16.364
  188   1HB   SER  23          2HB       SER  23  13.672   4.499 -16.841
  189   2HB   SER  23          1HB       SER  23  12.113   4.819 -17.598
  190    HG   SER  23           HG       SER  23  14.468   4.778 -18.745
  191    H    PHE  24           H        PHE  24  10.964   6.370 -18.186
  192    HA   PHE  24           HA       PHE  24  10.282   9.070 -18.585
  193   1HB   PHE  24          2HB       PHE  24  11.255   9.428 -20.890
  194   2HB   PHE  24          1HB       PHE  24  12.446   9.442 -19.590
  195    HD1  PHE  24           HD1      PHE  24  10.887   7.247 -22.177
  196    HD2  PHE  24           HD2      PHE  24  14.235   7.896 -19.566
  197    HE1  PHE  24           HE1      PHE  24  12.100   5.379 -23.268
  198    HE2  PHE  24           HE2      PHE  24  15.448   6.028 -20.657
  199    HZ   PHE  24           HZ       PHE  24  14.381   4.770 -22.508
  200    H    GLY  25           H        GLY  25   8.334   9.096 -19.657
  201   1HA   GLY  25          2HA       GLY  25   7.477   7.772 -21.899
  202   2HA   GLY  25          1HA       GLY  25   7.293   6.545 -20.647
  203    H    ASN  26           H        ASN  26   6.695   8.621 -18.587
  204    HA   ASN  26           HA       ASN  26   4.329  10.057 -19.437
  205   1HB   ASN  26          2HB       ASN  26   4.065   7.303 -18.346
  206   2HB   ASN  26          1HB       ASN  26   2.964   8.514 -17.688
  207   1HD2  ASN  26          2HD2      ASN  26   2.422   7.150 -21.468
  208   2HD2  ASN  26          1HD2      ASN  26   3.676   6.563 -20.487
  209    HA   PRO  27           HA       PRO  27   5.390  12.043 -15.654
  210   1HB   PRO  27          2HB       PRO  27   3.170  13.654 -15.463
  211   2HB   PRO  27          1HB       PRO  27   4.509  13.959 -16.579
  212   1HG   PRO  27          2HG       PRO  27   1.775  12.902 -17.155
  213   2HG   PRO  27          1HG       PRO  27   2.875  13.795 -18.215
  214   1HD   PRO  27          2HD       PRO  27   2.424  10.993 -18.251
  215   2HD   PRO  27          1HD       PRO  27   3.739  11.851 -19.081
  216    H    ARG  28           H        ARG  28   3.485  12.949 -13.756
  217    HA   ARG  28           HA       ARG  28   3.039  10.597 -12.201
  218   1HB   ARG  28          2HB       ARG  28   1.428  13.122 -11.858
  219   2HB   ARG  28          1HB       ARG  28   2.022  12.017 -10.618
  220   1HG   ARG  28          2HG       ARG  28   3.692  13.540 -10.367
  221   2HG   ARG  28          1HG       ARG  28   4.360  12.801 -11.823
  222   1HD   ARG  28          2HD       ARG  28   2.470  14.593 -12.805
  223   2HD   ARG  28          1HD       ARG  28   3.201  15.460 -11.455
  224    HE   ARG  28           HE       ARG  28   4.839  14.273 -13.660
  225   1HH1  ARG  28          2HH1      ARG  28   5.430  15.790 -10.850
  226   2HH1  ARG  28          1HH1      ARG  28   6.143  17.225 -11.508
  227   1HH2  ARG  28          1HH2      ARG  28   5.162  16.537 -14.762
  228   2HH2  ARG  28          2HH2      ARG  28   5.992  17.648 -13.723
  229    H    GLY  29           H        GLY  29   0.830   9.834 -11.477
  230   1HA   GLY  29          2HA       GLY  29  -1.469   9.356 -11.914
  231   2HA   GLY  29          1HA       GLY  29  -1.358  10.301 -13.399
  232    H    THR  30           H        THR  30   1.304   8.311 -13.315
  233    HA   THR  30           HA       THR  30   0.172   6.564 -15.367
  234    HB   THR  30           HB       THR  30   2.874   6.145 -14.115
  235    HG1  THR  30           HG1      THR  30   1.960   8.320 -15.615
  236   1HG2  THR  30          3HG2      THR  30   1.971   4.653 -15.923
  237   2HG2  THR  30          2HG2      THR  30   1.922   6.058 -16.989
  238   3HG2  THR  30          1HG2      THR  30   3.466   5.477 -16.365
  239    H    PHE  31           H        PHE  31  -1.464   5.622 -13.841
  240    HA   PHE  31           HA       PHE  31  -0.431   3.792 -11.784
  241   1HB   PHE  31          2HB       PHE  31  -3.191   4.528 -12.764
  242   2HB   PHE  31          1HB       PHE  31  -2.940   3.190 -11.646
  243    HD1  PHE  31           HD1      PHE  31  -1.266   6.544 -11.912
  244    HD2  PHE  31           HD2      PHE  31  -3.666   3.885  -9.538
  245    HE1  PHE  31           HE1      PHE  31  -1.165   8.141 -10.021
  246    HE2  PHE  31           HE2      PHE  31  -3.566   5.487  -7.649
  247    HZ   PHE  31           HZ       PHE  31  -2.315   7.614  -7.889
  248    H    LEU  32           H        LEU  32   0.820   2.503 -13.458
  249    HA   LEU  32           HA       LEU  32  -0.702   0.989 -15.425
  250   1HB   LEU  32          2HB       LEU  32   1.412  -0.085 -15.945
  251   2HB   LEU  32          1HB       LEU  32   1.698   1.643 -15.737
  252    HG   LEU  32           HG       LEU  32   2.182   1.001 -13.245
  253   1HD1  LEU  32          1HD1      LEU  32   2.089  -1.619 -14.668
  254   2HD1  LEU  32          3HD1      LEU  32   3.374  -1.389 -13.481
  255   3HD1  LEU  32          2HD1      LEU  32   1.685  -1.237 -12.995
  256   1HD2  LEU  32          3HD2      LEU  32   3.767   1.352 -15.529
  257   2HD2  LEU  32          2HD2      LEU  32   4.316   1.418 -13.855
  258   3HD2  LEU  32          1HD2      LEU  32   4.416  -0.095 -14.756
  259    H    ILE  33           H        ILE  33   0.034  -1.539 -15.336
  260    HA   ILE  33           HA       ILE  33  -0.587  -2.568 -12.607
  261    HB   ILE  33           HB       ILE  33  -2.021  -3.129 -15.199
  262   1HG1  ILE  33          2HG1      ILE  33  -2.832  -2.476 -12.360
  263   2HG1  ILE  33          1HG1      ILE  33  -3.050  -1.477 -13.797
  264   1HG2  ILE  33          3HG2      ILE  33  -1.981  -4.922 -12.757
  265   2HG2  ILE  33          2HG2      ILE  33  -3.062  -5.100 -14.137
  266   3HG2  ILE  33          1HG2      ILE  33  -1.327  -5.328 -14.344
  267   1HD1  ILE  33          3HD1      ILE  33  -4.372  -3.631 -14.650
  268   2HD1  ILE  33          2HD1      ILE  33  -4.572  -3.897 -12.917
  269   3HD1  ILE  33          1HD1      ILE  33  -5.163  -2.408 -13.656
  270    H    ARG  34           H        ARG  34  -0.145  -5.050 -12.600
  271    HA   ARG  34           HA       ARG  34   1.456  -6.341 -14.522
  272   1HB   ARG  34          2HB       ARG  34   3.724  -6.043 -13.334
  273   2HB   ARG  34          1HB       ARG  34   3.165  -4.711 -14.345
  274   1HG   ARG  34          2HG       ARG  34   3.537  -3.424 -12.510
  275   2HG   ARG  34          1HG       ARG  34   2.024  -4.103 -11.911
  276   1HD   ARG  34          2HD       ARG  34   3.366  -5.997 -10.917
  277   2HD   ARG  34          1HD       ARG  34   4.826  -5.112 -11.359
  278    HE   ARG  34           HE       ARG  34   3.229  -3.314  -9.897
  279   1HH1  ARG  34          2HH1      ARG  34   4.234  -6.542  -9.347
  280   2HH1  ARG  34          1HH1      ARG  34   4.740  -6.258  -7.714
  281   1HH2  ARG  34          1HH2      ARG  34   4.117  -2.850  -7.835
  282   2HH2  ARG  34          2HH2      ARG  34   4.674  -4.167  -6.859
  283    H    GLU  35           H        GLU  35   2.321  -8.355 -13.727
  284    HA   GLU  35           HA       GLU  35   0.846  -9.500 -11.565
  285   1HB   GLU  35          2HB       GLU  35   3.033 -10.347 -13.384
  286   2HB   GLU  35          1HB       GLU  35   2.838 -11.271 -11.903
  287   1HG   GLU  35          2HG       GLU  35   0.377 -11.452 -12.455
  288   2HG   GLU  35          1HG       GLU  35   0.748 -10.729 -14.022
  289    H    SER  36           H        SER  36   1.303  -9.642  -9.411
  290    HA   SER  36           HA       SER  36   3.690  -8.296  -8.369
  291   1HB   SER  36          2HB       SER  36   1.405  -9.738  -6.990
  292   2HB   SER  36          1HB       SER  36   2.690  -8.875  -6.159
  293    HG   SER  36           HG       SER  36   0.751  -7.633  -6.529
  294    H    GLU  37           H        GLU  37   5.526  -9.351  -7.746
  295    HA   GLU  37           HA       GLU  37   5.571 -12.310  -7.910
  296   1HB   GLU  37          2HB       GLU  37   7.734 -10.235  -7.508
  297   2HB   GLU  37          1HB       GLU  37   8.033 -11.971  -7.523
  298   1HG   GLU  37          2HG       GLU  37   8.407 -11.515  -9.759
  299   2HG   GLU  37          1HG       GLU  37   6.668 -11.805  -9.815
  300    H    THR  38           H        THR  38   4.417 -10.428  -5.704
  301    HA   THR  38           HA       THR  38   6.005 -11.107  -3.352
  302    HB   THR  38           HB       THR  38   4.451  -9.046  -3.744
  303    HG1  THR  38           HG1      THR  38   4.313 -10.536  -1.338
  304   1HG2  THR  38          1HG2      THR  38   2.463 -11.121  -2.789
  305   2HG2  THR  38          3HG2      THR  38   2.162  -9.384  -2.841
  306   3HG2  THR  38          2HG2      THR  38   2.430 -10.276  -4.338
  307    H    THR  39           H        THR  39   2.953 -12.141  -4.801
  308    HA   THR  39           HA       THR  39   2.950 -14.437  -2.871
  309    HB   THR  39           HB       THR  39   0.939 -12.770  -3.083
  310    HG1  THR  39           HG1      THR  39  -0.431 -14.864  -3.051
  311   1HG2  THR  39          1HG2      THR  39   1.026 -13.372  -5.695
  312   2HG2  THR  39          3HG2      THR  39  -0.062 -14.653  -5.159
  313   3HG2  THR  39          2HG2      THR  39  -0.482 -12.965  -4.874
  314    H    LYS  40           H        LYS  40   1.447 -16.287  -4.156
  315    HA   LYS  40           HA       LYS  40   3.133 -17.667  -5.840
  316   1HB   LYS  40          2HB       LYS  40   0.173 -17.607  -6.399
  317   2HB   LYS  40          1HB       LYS  40   1.276 -18.977  -6.504
  318   1HG   LYS  40          2HG       LYS  40   1.624 -18.597  -3.955
  319   2HG   LYS  40          1HG       LYS  40   0.140 -17.649  -4.053
  320   1HD   LYS  40          2HD       LYS  40  -1.156 -19.498  -4.296
  321   2HD   LYS  40          1HD       LYS  40  -0.026 -20.248  -5.422
  322   1HE   LYS  40          2HE       LYS  40   1.255 -20.192  -2.889
  323   2HE   LYS  40          1HE       LYS  40  -0.383 -20.785  -2.618
  324   1HZ   LYS  40          3HZ       LYS  40   0.035 -22.295  -4.575
  325   2HZ   LYS  40          2HZ       LYS  40   1.676 -21.878  -4.441
  326   3HZ   LYS  40          1HZ       LYS  40   0.887 -22.661  -3.155
  327    H    GLY  41           H        GLY  41   0.886 -15.105  -6.696
  328   1HA   GLY  41          2HA       GLY  41   2.274 -13.922  -8.734
  329   2HA   GLY  41          1HA       GLY  41   1.468 -15.268  -9.545
  330    H    ALA  42           H        ALA  42   0.773 -12.563  -7.347
  331    HA   ALA  42           HA       ALA  42  -2.053 -12.484  -8.187
  332   1HB   ALA  42          1HB       ALA  42  -0.454 -11.480  -5.981
  333   2HB   ALA  42          3HB       ALA  42  -1.412 -10.184  -6.694
  334   3HB   ALA  42          2HB       ALA  42  -2.208 -11.639  -6.093
  335    H    TYR  43           H        TYR  43  -2.348  -9.651  -8.185
  336    HA   TYR  43           HA       TYR  43  -0.733  -8.975 -10.599
  337   1HB   TYR  43          2HB       TYR  43  -3.581  -9.030 -10.283
  338   2HB   TYR  43          1HB       TYR  43  -3.065  -7.361 -10.541
  339    HD1  TYR  43           HD1      TYR  43  -0.796  -7.435 -12.229
  340    HD2  TYR  43           HD2      TYR  43  -4.236 -10.017 -12.296
  341    HE1  TYR  43           HE1      TYR  43  -0.374  -7.953 -14.626
  342    HE2  TYR  43           HE2      TYR  43  -3.808 -10.534 -14.681
  343    HH   TYR  43           HH       TYR  43  -1.653 -10.514 -16.201
  344    H    SER  44           H        SER  44  -1.129  -6.302 -10.807
  345    HA   SER  44           HA       SER  44  -0.884  -5.048  -8.173
  346   1HB   SER  44          2HB       SER  44   1.323  -5.898  -8.283
  347   2HB   SER  44          1HB       SER  44   1.473  -5.456  -9.983
  348    HG   SER  44           HG       SER  44   1.580  -3.853  -7.697
  349    H    LEU  45           H        LEU  45  -0.299  -2.747  -8.389
  350    HA   LEU  45           HA       LEU  45  -0.992  -1.559 -11.033
  351   1HB   LEU  45          2HB       LEU  45  -3.087  -1.635  -9.754
  352   2HB   LEU  45          1HB       LEU  45  -2.301  -0.847  -8.394
  353    HG   LEU  45           HG       LEU  45  -2.348   0.439 -11.117
  354   1HD1  LEU  45          2HD1      LEU  45  -4.674  -0.223  -9.996
  355   2HD1  LEU  45          1HD1      LEU  45  -4.330   1.202  -9.014
  356   3HD1  LEU  45          3HD1      LEU  45  -4.450   1.347 -10.769
  357   1HD2  LEU  45          2HD2      LEU  45  -1.728   1.242  -8.310
  358   2HD2  LEU  45          1HD2      LEU  45  -0.917   1.693  -9.810
  359   3HD2  LEU  45          3HD2      LEU  45  -2.446   2.454  -9.371
  360    H    SER  46           H        SER  46   1.119  -0.774 -11.277
  361    HA   SER  46           HA       SER  46   2.431   0.662  -9.096
  362   1HB   SER  46          2HB       SER  46   3.440   1.027 -11.851
  363   2HB   SER  46          1HB       SER  46   4.299   0.532 -10.397
  364    HG   SER  46           HG       SER  46   4.099  -1.437 -11.033
  365    H    ILE  47           H        ILE  47   2.677   2.938  -8.990
  366    HA   ILE  47           HA       ILE  47   1.107   4.479 -11.015
  367    HB   ILE  47           HB       ILE  47   0.061   5.789  -9.360
  368   1HG1  ILE  47          2HG1      ILE  47   1.962   4.588  -7.319
  369   2HG1  ILE  47          1HG1      ILE  47   2.129   6.196  -8.027
  370   1HG2  ILE  47          3HG2      ILE  47   0.268   2.899  -8.530
  371   2HG2  ILE  47          2HG2      ILE  47  -0.733   4.033  -7.620
  372   3HG2  ILE  47          1HG2      ILE  47  -1.071   3.727  -9.324
  373   1HD1  ILE  47          2HD1      ILE  47  -0.360   5.291  -6.559
  374   2HD1  ILE  47          1HD1      ILE  47   0.970   6.136  -5.767
  375   3HD1  ILE  47          3HD1      ILE  47   0.060   6.931  -7.053
  376    H    ARG  48           H        ARG  48   2.200   6.176 -11.878
  377    HA   ARG  48           HA       ARG  48   4.921   6.732 -10.884
  378   1HB   ARG  48          2HB       ARG  48   4.661   6.594 -13.288
  379   2HB   ARG  48          1HB       ARG  48   3.350   7.771 -13.258
  380   1HG   ARG  48          2HG       ARG  48   5.554   8.752 -13.955
  381   2HG   ARG  48          1HG       ARG  48   4.866   9.521 -12.525
  382   1HD   ARG  48          2HD       ARG  48   6.500   8.709 -11.142
  383   2HD   ARG  48          1HD       ARG  48   6.623   7.183 -12.017
  384    HE   ARG  48           HE       ARG  48   8.568   8.219 -12.881
  385   1HH1  ARG  48          2HH1      ARG  48   6.906  10.857 -11.835
  386   2HH1  ARG  48          1HH1      ARG  48   7.226  11.865 -13.208
  387   1HH2  ARG  48          1HH2      ARG  48   8.537   9.289 -15.125
  388   2HH2  ARG  48          2HH2      ARG  48   8.149  10.977 -15.070
  389    H    ASP  49           H        ASP  49   5.347   8.390  -9.489
  390    HA   ASP  49           HA       ASP  49   3.624  10.790  -9.567
  391   1HB   ASP  49          2HB       ASP  49   2.438   9.443  -7.954
  392   2HB   ASP  49          1HB       ASP  49   3.936   9.032  -7.119
  393    H    TRP  50           H        TRP  50   5.002  12.473  -9.566
  394    HA   TRP  50           HA       TRP  50   7.705  12.171  -8.347
  395   1HB   TRP  50          2HB       TRP  50   7.846  13.006 -10.577
  396   2HB   TRP  50          1HB       TRP  50   6.492  14.105 -10.333
  397    HD1  TRP  50           HD1      TRP  50  10.179  13.987 -10.204
  398    HE1  TRP  50           HE1      TRP  50  11.114  16.146  -9.139
  399    HE3  TRP  50           HE3      TRP  50   5.896  15.912  -8.344
  400    HZ2  TRP  50           HZ2      TRP  50  10.128  18.428  -7.706
  401    HZ3  TRP  50           HZ3      TRP  50   5.880  18.088  -7.135
  402    HH2  TRP  50           HH2      TRP  50   7.998  19.345  -6.814
  403    H    ASP  51           H        ASP  51   8.464  13.809  -6.859
  404    HA   ASP  51           HA       ASP  51   6.314  15.484  -5.644
  405   1HB   ASP  51          2HB       ASP  51   7.747  13.247  -4.437
  406   2HB   ASP  51          1HB       ASP  51   7.944  14.735  -3.510
  407    H    ASP  52           H        ASP  52   7.211  17.274  -4.318
  408    HA   ASP  52           HA       ASP  52   9.597  18.408  -5.614
  409   1HB   ASP  52          2HB       ASP  52   9.000  20.457  -4.525
  410   2HB   ASP  52          1HB       ASP  52   7.487  19.728  -5.062
  411    H    MET  53           H        MET  53  10.388  16.191  -4.209
  412    HA   MET  53           HA       MET  53  12.210  17.358  -2.295
  413   1HB   MET  53          2HB       MET  53  11.525  15.963  -0.382
  414   2HB   MET  53          1HB       MET  53  10.221  17.043  -0.876
  415   1HG   MET  53          2HG       MET  53   9.750  14.847  -2.457
  416   2HG   MET  53          1HG       MET  53  10.366  14.099  -0.983
  417   1HE   MET  53          1HE       MET  53   8.177  16.411  -2.689
  418   2HE   MET  53          3HE       MET  53   6.630  16.436  -1.832
  419   3HE   MET  53          2HE       MET  53   7.933  17.514  -1.337
  420    H    LYS  54           H        LYS  54  10.991  14.510  -3.967
  421    HA   LYS  54           HA       LYS  54  13.691  13.348  -3.698
  422   1HB   LYS  54          2HB       LYS  54  12.343  11.106  -3.982
  423   2HB   LYS  54          1HB       LYS  54  12.459  11.871  -2.396
  424   1HG   LYS  54          2HG       LYS  54  10.293  13.024  -2.826
  425   2HG   LYS  54          1HG       LYS  54  10.172  12.176  -4.368
  426   1HD   LYS  54          2HD       LYS  54   9.352  10.345  -3.345
  427   2HD   LYS  54          1HD       LYS  54  10.741  10.289  -2.259
  428   1HE   LYS  54          2HE       LYS  54   8.953  12.464  -1.545
  429   2HE   LYS  54          1HE       LYS  54   8.094  10.924  -1.565
  430   1HZ   LYS  54          1HZ       LYS  54  10.075  10.053  -0.257
  431   2HZ   LYS  54          3HZ       LYS  54  10.477  11.679   0.011
  432   3HZ   LYS  54          2HZ       LYS  54   8.989  11.071   0.564
  433    H    GLY  55           H        GLY  55  11.470  14.582  -5.888
  434   1HA   GLY  55          2HA       GLY  55  11.803  14.682  -8.230
  435   2HA   GLY  55          1HA       GLY  55  12.925  13.337  -8.087
  436    H    ASP  56           H        ASP  56  11.615  12.466  -9.963
  437    HA   ASP  56           HA       ASP  56   8.864  11.794  -9.649
  438   1HB   ASP  56          2HB       ASP  56  10.761  10.084 -11.250
  439   2HB   ASP  56          1HB       ASP  56   9.105  10.554 -11.624
  440    H    HIS  57           H        HIS  57   8.058   9.492  -9.403
  441    HA   HIS  57           HA       HIS  57   9.791   7.588  -8.033
  442   1HB   HIS  57          2HB       HIS  57   8.002   9.399  -6.530
  443   2HB   HIS  57          1HB       HIS  57   7.830   7.693  -6.129
  444    HD1  HIS  57           HD1      HIS  57   9.665   6.626  -4.755
  445    HD2  HIS  57           HD2      HIS  57  10.731  10.404  -6.154
  446    HE1  HIS  57           HE1      HIS  57  11.854   7.216  -3.626
  447    H    VAL  58           H        VAL  58   7.984   5.881  -6.999
  448    HA   VAL  58           HA       VAL  58   5.641   5.643  -8.703
  449    HB   VAL  58           HB       VAL  58   8.164   4.229  -9.319
  450   1HG1  VAL  58          1HG1      VAL  58   5.480   2.811  -9.250
  451   2HG1  VAL  58          3HG1      VAL  58   6.813   2.275 -10.276
  452   3HG1  VAL  58          2HG1      VAL  58   6.997   2.277  -8.522
  453   1HG2  VAL  58          1HG2      VAL  58   5.659   5.049 -10.779
  454   2HG2  VAL  58          3HG2      VAL  58   7.270   5.753 -10.910
  455   3HG2  VAL  58          2HG2      VAL  58   6.957   4.140 -11.555
  456    H    LYS  59           H        LYS  59   4.155   4.910  -7.326
  457    HA   LYS  59           HA       LYS  59   4.971   3.171  -5.055
  458   1HB   LYS  59          2HB       LYS  59   3.293   5.317  -5.104
  459   2HB   LYS  59          1HB       LYS  59   2.141   4.007  -5.358
  460   1HG   LYS  59          2HG       LYS  59   2.663   2.983  -3.308
  461   2HG   LYS  59          1HG       LYS  59   4.218   3.806  -3.187
  462   1HD   LYS  59          2HD       LYS  59   1.569   5.270  -3.095
  463   2HD   LYS  59          1HD       LYS  59   2.403   4.702  -1.648
  464   1HE   LYS  59          2HE       LYS  59   3.900   6.352  -3.664
  465   2HE   LYS  59          1HE       LYS  59   2.826   7.150  -2.515
  466   1HZ   LYS  59          3HZ       LYS  59   4.025   5.892  -0.739
  467   2HZ   LYS  59          2HZ       LYS  59   5.159   5.421  -1.914
  468   3HZ   LYS  59          1HZ       LYS  59   4.959   7.065  -1.532
  469    H    HIS  60           H        HIS  60   2.642   1.711  -4.685
  470    HA   HIS  60           HA       HIS  60   1.854   0.501  -7.232
  471   1HB   HIS  60          2HB       HIS  60   3.340  -1.240  -5.263
  472   2HB   HIS  60          1HB       HIS  60   2.768  -1.683  -6.866
  473    HD1  HIS  60           HD1      HIS  60   4.235  -1.106  -8.852
  474    HD2  HIS  60           HD2      HIS  60   5.622   0.582  -5.302
  475    HE1  HIS  60           HE1      HIS  60   6.528  -0.161  -9.359
  476    H    TYR  61           H        TYR  61   0.184  -1.052  -6.983
  477    HA   TYR  61           HA       TYR  61  -1.000  -1.262  -4.254
  478   1HB   TYR  61          2HB       TYR  61  -2.268  -0.199  -6.754
  479   2HB   TYR  61          1HB       TYR  61  -3.267  -1.127  -5.643
  480    HD1  TYR  61           HD1      TYR  61  -3.247  -0.437  -3.163
  481    HD2  TYR  61           HD2      TYR  61  -1.795   2.050  -6.347
  482    HE1  TYR  61           HE1      TYR  61  -3.444   1.555  -1.694
  483    HE2  TYR  61           HE2      TYR  61  -1.989   4.040  -4.882
  484    HH   TYR  61           HH       TYR  61  -2.206   3.941  -1.661
  485    H    LYS  62           H        LYS  62  -0.483  -3.417  -4.026
  486    HA   LYS  62           HA       LYS  62  -0.460  -5.391  -6.026
  487   1HB   LYS  62          2HB       LYS  62   0.549  -5.912  -3.943
  488   2HB   LYS  62          1HB       LYS  62  -0.918  -5.537  -3.045
  489   1HG   LYS  62          2HG       LYS  62  -1.289  -7.620  -5.085
  490   2HG   LYS  62          1HG       LYS  62  -0.134  -8.063  -3.828
  491   1HD   LYS  62          2HD       LYS  62  -2.986  -7.120  -3.410
  492   2HD   LYS  62          1HD       LYS  62  -2.360  -8.741  -3.116
  493   1HE   LYS  62          2HE       LYS  62  -0.670  -7.516  -1.532
  494   2HE   LYS  62          1HE       LYS  62  -1.851  -6.208  -1.573
  495   1HZ   LYS  62          3HZ       LYS  62  -3.310  -8.506  -1.189
  496   2HZ   LYS  62          2HZ       LYS  62  -1.957  -8.680  -0.177
  497   3HZ   LYS  62          1HZ       LYS  62  -2.963  -7.319  -0.030
  498    H    ILE  63           H        ILE  63  -2.100  -6.005  -7.293
  499    HA   ILE  63           HA       ILE  63  -4.891  -5.696  -6.391
  500    HB   ILE  63           HB       ILE  63  -3.582  -6.399  -9.015
  501   1HG1  ILE  63          2HG1      ILE  63  -5.645  -4.434  -9.163
  502   2HG1  ILE  63          1HG1      ILE  63  -4.648  -4.047  -7.762
  503   1HG2  ILE  63          1HG2      ILE  63  -6.509  -6.642  -8.260
  504   2HG2  ILE  63          3HG2      ILE  63  -5.942  -6.544  -9.928
  505   3HG2  ILE  63          2HG2      ILE  63  -5.465  -7.905  -8.912
  506   1HD1  ILE  63          3HD1      ILE  63  -3.011  -4.858 -10.018
  507   2HD1  ILE  63          2HD1      ILE  63  -4.048  -3.495 -10.444
  508   3HD1  ILE  63          1HD1      ILE  63  -2.946  -3.373  -9.072
  509    H    ARG  64           H        ARG  64  -6.387  -7.469  -6.354
  510    HA   ARG  64           HA       ARG  64  -5.172 -10.189  -6.374
  511   1HB   ARG  64          2HB       ARG  64  -6.092  -8.770  -4.053
  512   2HB   ARG  64          1HB       ARG  64  -7.180 -10.123  -4.355
  513   1HG   ARG  64          2HG       ARG  64  -5.183 -10.684  -2.906
  514   2HG   ARG  64          1HG       ARG  64  -5.353 -11.695  -4.341
  515   1HD   ARG  64          2HD       ARG  64  -3.614 -10.559  -5.483
  516   2HD   ARG  64          1HD       ARG  64  -3.663  -9.193  -4.370
  517    HE   ARG  64           HE       ARG  64  -1.851 -11.178  -4.009
  518   1HH1  ARG  64          2HH1      ARG  64  -4.244 -12.625  -2.688
  519   2HH1  ARG  64          1HH1      ARG  64  -3.942 -12.266  -1.020
  520   1HH2  ARG  64          1HH2      ARG  64  -1.663  -9.744  -1.703
  521   2HH2  ARG  64          2HH2      ARG  64  -2.482 -10.633  -0.463
  522    H    LYS  65           H        LYS  65  -6.549 -11.759  -7.224
  523    HA   LYS  65           HA       LYS  65  -9.195 -10.737  -8.157
  524   1HB   LYS  65          2HB       LYS  65  -8.099 -11.267 -10.140
  525   2HB   LYS  65          1HB       LYS  65  -7.157 -12.553  -9.398
  526   1HG   LYS  65          2HG       LYS  65  -9.372 -13.866  -9.204
  527   2HG   LYS  65          1HG       LYS  65 -10.062 -12.654 -10.276
  528   1HD   LYS  65          2HD       LYS  65  -8.966 -13.460 -12.092
  529   2HD   LYS  65          1HD       LYS  65  -7.477 -13.730 -11.189
  530   1HE   LYS  65          2HE       LYS  65  -8.166 -15.916 -11.695
  531   2HE   LYS  65          1HE       LYS  65  -8.806 -15.684 -10.069
  532   1HZ   LYS  65          1HZ       LYS  65 -10.917 -14.967 -11.118
  533   2HZ   LYS  65          3HZ       LYS  65 -10.283 -15.410 -12.627
  534   3HZ   LYS  65          2HZ       LYS  65 -10.519 -16.589 -11.427
  535    H    LEU  66           H        LEU  66 -10.974 -11.719  -7.370
  536    HA   LEU  66           HA       LEU  66 -10.592 -14.083  -5.650
  537   1HB   LEU  66          2HB       LEU  66 -13.056 -12.433  -6.283
  538   2HB   LEU  66          1HB       LEU  66 -13.053 -13.828  -5.211
  539    HG   LEU  66           HG       LEU  66 -12.769 -12.154  -3.664
  540   1HD1  LEU  66          1HD1      LEU  66 -10.667 -13.672  -3.807
  541   2HD1  LEU  66          3HD1      LEU  66  -9.871 -12.254  -4.490
  542   3HD1  LEU  66          2HD1      LEU  66 -10.551 -12.186  -2.865
  543   1HD2  LEU  66          1HD2      LEU  66 -12.799 -10.398  -5.433
  544   2HD2  LEU  66          3HD2      LEU  66 -11.683 -10.027  -4.117
  545   3HD2  LEU  66          2HD2      LEU  66 -11.067 -10.641  -5.653
  546    H    ASP  67           H        ASP  67 -11.154 -16.134  -6.325
  547    HA   ASP  67           HA       ASP  67 -11.804 -16.553  -9.127
  548   1HB   ASP  67          2HB       ASP  67 -11.172 -18.179  -6.778
  549   2HB   ASP  67          1HB       ASP  67 -12.400 -18.915  -7.800
  550    H    ASN  68           H        ASN  68 -13.522 -15.897  -6.283
  551    HA   ASN  68           HA       ASN  68 -16.065 -17.081  -7.117
  552   1HB   ASN  68          2HB       ASN  68 -15.445 -15.103  -4.913
  553   2HB   ASN  68          1HB       ASN  68 -16.905 -16.085  -5.062
  554   1HD2  ASN  68          2HD2      ASN  68 -13.761 -17.640  -3.149
  555   2HD2  ASN  68          1HD2      ASN  68 -13.946 -15.986  -3.482
  556    H    GLY  69           H        GLY  69 -14.317 -14.296  -7.954
  557   1HA   GLY  69          2HA       GLY  69 -16.801 -13.141  -9.004
  558   2HA   GLY  69          1HA       GLY  69 -15.941 -12.137  -7.852
  559    H    GLY  70           H        GLY  70 -13.958 -11.190  -8.488
  560   1HA   GLY  70          2HA       GLY  70 -12.951 -11.741 -11.194
  561   2HA   GLY  70          1HA       GLY  70 -13.690 -10.160 -10.979
  562    H    TYR  71           H        TYR  71 -12.353  -8.587 -10.426
  563    HA   TYR  71           HA       TYR  71  -9.813  -9.304  -9.019
  564   1HB   TYR  71          2HB       TYR  71 -10.302  -7.346 -11.264
  565   2HB   TYR  71          1HB       TYR  71  -8.843  -7.313 -10.275
  566    HD1  TYR  71           HD1      TYR  71 -10.939  -9.654 -12.317
  567    HD2  TYR  71           HD2      TYR  71  -7.033  -8.661 -10.839
  568    HE1  TYR  71           HE1      TYR  71  -9.960 -11.462 -13.703
  569    HE2  TYR  71           HE2      TYR  71  -6.047 -10.472 -12.225
  570    HH   TYR  71           HH       TYR  71  -6.514 -12.277 -13.487
  571    H    TYR  72           H        TYR  72  -8.831  -7.228  -7.999
  572    HA   TYR  72           HA       TYR  72 -10.451  -4.983  -7.371
  573   1HB   TYR  72          2HB       TYR  72 -11.467  -5.504  -5.285
  574   2HB   TYR  72          1HB       TYR  72 -11.849  -6.874  -6.321
  575    HD1  TYR  72           HD1      TYR  72 -10.355  -8.961  -6.194
  576    HD2  TYR  72           HD2      TYR  72 -10.237  -5.788  -3.300
  577    HE1  TYR  72           HE1      TYR  72  -9.185 -10.452  -4.608
  578    HE2  TYR  72           HE2      TYR  72  -9.060  -7.270  -1.714
  579    HH   TYR  72           HH       TYR  72  -8.585 -10.701  -2.416
  580    H    ILE  73           H        ILE  73  -8.865  -3.550  -6.746
  581    HA   ILE  73           HA       ILE  73  -6.415  -4.576  -5.474
  582    HB   ILE  73           HB       ILE  73  -6.919  -1.637  -5.531
  583   1HG1  ILE  73          2HG1      ILE  73  -6.640  -3.316  -8.044
  584   2HG1  ILE  73          1HG1      ILE  73  -7.961  -2.220  -7.647
  585   1HG2  ILE  73          3HG2      ILE  73  -4.685  -3.572  -5.953
  586   2HG2  ILE  73          2HG2      ILE  73  -4.553  -1.975  -6.691
  587   3HG2  ILE  73          1HG2      ILE  73  -4.743  -2.126  -4.943
  588   1HD1  ILE  73          1HD1      ILE  73  -5.101  -1.267  -7.873
  589   2HD1  ILE  73          3HD1      ILE  73  -6.187  -1.318  -9.262
  590   3HD1  ILE  73          2HD1      ILE  73  -6.575  -0.298  -7.877
  591    H    THR  74           H        THR  74  -9.457  -3.233  -4.681
  592    HA   THR  74           HA       THR  74  -8.883  -3.554  -1.807
  593    HB   THR  74           HB       THR  74  -8.810  -1.313  -1.493
  594    HG1  THR  74           HG1      THR  74 -10.734  -0.545  -1.049
  595   1HG2  THR  74          3HG2      THR  74  -8.441  -1.067  -3.991
  596   2HG2  THR  74          2HG2      THR  74 -10.180  -0.812  -4.143
  597   3HG2  THR  74          1HG2      THR  74  -9.201   0.321  -3.212
  598    H    THR  75           H        THR  75 -10.725  -4.283  -0.713
  599    HA   THR  75           HA       THR  75 -12.667  -5.677  -2.257
  600    HB   THR  75           HB       THR  75 -13.754  -6.163  -0.150
  601    HG1  THR  75           HG1      THR  75 -13.552  -4.890   1.553
  602   1HG2  THR  75          1HG2      THR  75 -10.988  -6.466  -0.679
  603   2HG2  THR  75          3HG2      THR  75 -11.141  -6.104   1.042
  604   3HG2  THR  75          2HG2      THR  75 -12.005  -7.478   0.350
  605    H    ARG  76           H        ARG  76 -12.525  -2.363  -1.634
  606    HA   ARG  76           HA       ARG  76 -15.354  -1.821  -1.418
  607   1HB   ARG  76          2HB       ARG  76 -13.140  -0.326  -0.989
  608   2HB   ARG  76          1HB       ARG  76 -13.575   0.240  -2.602
  609   1HG   ARG  76          2HG       ARG  76 -14.777   1.670  -1.147
  610   2HG   ARG  76          1HG       ARG  76 -15.972   0.478  -1.660
  611   1HD   ARG  76          2HD       ARG  76 -14.828  -0.739   0.538
  612   2HD   ARG  76          1HD       ARG  76 -14.836   0.961   1.008
  613    HE   ARG  76           HE       ARG  76 -17.370  -0.055  -0.097
  614   1HH1  ARG  76          1HH1      ARG  76 -16.712   0.463   3.781
  615   2HH1  ARG  76          2HH1      ARG  76 -15.393   0.166   2.699
  616   1HH2  ARG  76          1HH2      ARG  76 -19.101   0.539   1.267
  617   2HH2  ARG  76          2HH2      ARG  76 -18.812   0.676   2.970
  618    H    ALA  77           H        ALA  77 -13.310  -2.690  -4.067
  619    HA   ALA  77           HA       ALA  77 -15.596  -2.444  -5.891
  620   1HB   ALA  77          1HB       ALA  77 -13.085  -0.818  -6.365
  621   2HB   ALA  77          3HB       ALA  77 -14.407  -1.007  -7.519
  622   3HB   ALA  77          2HB       ALA  77 -14.682  -0.172  -5.989
  623    H    GLN  78           H        GLN  78 -15.524  -4.306  -7.030
  624    HA   GLN  78           HA       GLN  78 -12.887  -5.395  -7.837
  625   1HB   GLN  78          2HB       GLN  78 -15.302  -7.130  -7.430
  626   2HB   GLN  78          1HB       GLN  78 -13.604  -7.540  -7.294
  627   1HG   GLN  78          2HG       GLN  78 -13.816  -5.637  -5.357
  628   2HG   GLN  78          1HG       GLN  78 -15.412  -6.373  -5.291
  629   1HE2  GLN  78          2HE2      GLN  78 -13.967  -8.811  -3.173
  630   2HE2  GLN  78          1HE2      GLN  78 -15.090  -7.545  -3.310
  631    H    PHE  79           H        PHE  79 -13.157  -6.863  -9.832
  632    HA   PHE  79           HA       PHE  79 -15.475  -6.343 -11.529
  633   1HB   PHE  79          2HB       PHE  79 -12.775  -5.135 -12.061
  634   2HB   PHE  79          1HB       PHE  79 -13.973  -5.375 -13.343
  635    HD1  PHE  79           HD1      PHE  79 -16.306  -4.474 -13.009
  636    HD2  PHE  79           HD2      PHE  79 -13.006  -3.371 -10.504
  637    HE1  PHE  79           HE1      PHE  79 -17.594  -2.522 -12.168
  638    HE2  PHE  79           HE2      PHE  79 -14.294  -1.451  -9.642
  639    HZ   PHE  79           HZ       PHE  79 -16.587  -1.009 -10.475
  640    H    GLU  80           H        GLU  80 -15.852  -8.121 -12.590
  641    HA   GLU  80           HA       GLU  80 -14.618 -10.512 -12.533
  642   1HB   GLU  80          2HB       GLU  80 -15.396 -10.744 -15.051
  643   2HB   GLU  80          1HB       GLU  80 -16.578 -10.566 -13.753
  644   1HG   GLU  80          2HG       GLU  80 -15.603  -7.982 -14.693
  645   2HG   GLU  80          1HG       GLU  80 -16.338  -8.918 -15.993
  646    H    THR  81           H        THR  81 -13.360  -7.820 -14.510
  647    HA   THR  81           HA       THR  81 -11.023  -9.604 -15.035
  648    HB   THR  81           HB       THR  81 -11.890  -9.765 -17.161
  649    HG1  THR  81           HG1      THR  81 -11.137  -7.233 -17.842
  650   1HG2  THR  81          1HG2      THR  81 -13.877  -8.281 -16.389
  651   2HG2  THR  81          3HG2      THR  81 -12.953  -6.967 -17.114
  652   3HG2  THR  81          2HG2      THR  81 -13.485  -8.323 -18.107
  653    H    LEU  82           H        LEU  82  -9.229  -8.177 -16.130
  654    HA   LEU  82           HA       LEU  82  -8.672  -6.005 -14.249
  655   1HB   LEU  82          2HB       LEU  82  -7.144  -7.378 -16.449
  656   2HB   LEU  82          1HB       LEU  82  -6.568  -5.838 -15.808
  657    HG   LEU  82           HG       LEU  82  -7.330  -8.034 -13.906
  658   1HD1  LEU  82          1HD1      LEU  82  -5.596  -8.658 -15.866
  659   2HD1  LEU  82          3HD1      LEU  82  -4.486  -7.831 -14.770
  660   3HD1  LEU  82          2HD1      LEU  82  -5.398  -9.235 -14.211
  661   1HD2  LEU  82          3HD2      LEU  82  -5.844  -5.480 -13.895
  662   2HD2  LEU  82          2HD2      LEU  82  -6.737  -6.270 -12.595
  663   3HD2  LEU  82          1HD2      LEU  82  -5.091  -6.778 -12.970
  664    H    GLN  83           H        GLN  83  -9.528  -6.400 -17.639
  665    HA   GLN  83           HA       GLN  83  -9.144  -3.628 -18.346
  666   1HB   GLN  83          2HB       GLN  83  -9.889  -6.021 -19.684
  667   2HB   GLN  83          1HB       GLN  83 -11.206  -4.873 -19.928
  668   1HG   GLN  83          2HG       GLN  83  -8.307  -4.112 -20.339
  669   2HG   GLN  83          1HG       GLN  83  -9.295  -4.785 -21.636
  670   1HE2  GLN  83          2HE2      GLN  83  -9.549  -0.896 -21.026
  671   2HE2  GLN  83          1HE2      GLN  83  -8.221  -1.878 -20.634
  672    H    GLN  84           H        GLN  84 -11.732  -5.526 -16.937
  673    HA   GLN  84           HA       GLN  84 -13.749  -3.449 -17.205
  674   1HB   GLN  84          2HB       GLN  84 -13.580  -6.048 -15.707
  675   2HB   GLN  84          1HB       GLN  84 -14.899  -4.927 -15.409
  676   1HG   GLN  84          2HG       GLN  84 -15.120  -6.810 -17.277
  677   2HG   GLN  84          1HG       GLN  84 -15.817  -5.217 -17.512
  678   1HE2  GLN  84          2HE2      GLN  84 -13.451  -4.255 -20.025
  679   2HE2  GLN  84          1HE2      GLN  84 -14.525  -3.652 -18.860
  680    H    LEU  85           H        LEU  85 -11.319  -4.342 -14.862
  681    HA   LEU  85           HA       LEU  85 -12.393  -2.579 -12.780
  682   1HB   LEU  85          2HB       LEU  85 -10.865  -3.581 -11.427
  683   2HB   LEU  85          1HB       LEU  85 -10.653  -4.715 -12.757
  684    HG   LEU  85           HG       LEU  85  -8.993  -2.730 -13.560
  685   1HD1  LEU  85          1HD1      LEU  85  -9.677  -1.970 -10.967
  686   2HD1  LEU  85          3HD1      LEU  85  -8.090  -2.727 -10.797
  687   3HD1  LEU  85          2HD1      LEU  85  -8.307  -1.373 -11.906
  688   1HD2  LEU  85          1HD2      LEU  85  -8.775  -5.317 -12.342
  689   2HD2  LEU  85          3HD2      LEU  85  -7.733  -4.555 -13.542
  690   3HD2  LEU  85          2HD2      LEU  85  -7.438  -4.289 -11.822
  691    H    VAL  86           H        VAL  86 -10.021  -2.366 -15.361
  692    HA   VAL  86           HA       VAL  86  -9.020   0.207 -14.472
  693    HB   VAL  86           HB       VAL  86  -7.993   0.321 -16.737
  694   1HG1  VAL  86          3HG1      VAL  86  -7.594  -1.755 -14.770
  695   2HG1  VAL  86          2HG1      VAL  86  -7.212  -2.373 -16.378
  696   3HG1  VAL  86          1HG1      VAL  86  -6.394  -0.935 -15.768
  697   1HG2  VAL  86          1HG2      VAL  86  -9.547  -2.244 -17.175
  698   2HG2  VAL  86          3HG2      VAL  86  -9.843  -0.706 -17.986
  699   3HG2  VAL  86          2HG2      VAL  86  -8.343  -1.587 -18.283
  700    H    GLN  87           H        GLN  87 -11.681  -1.064 -16.173
  701    HA   GLN  87           HA       GLN  87 -12.488   1.287 -17.613
  702   1HB   GLN  87          2HB       GLN  87 -13.220  -1.067 -18.104
  703   2HB   GLN  87          1HB       GLN  87 -14.197  -1.007 -16.646
  704   1HG   GLN  87          2HG       GLN  87 -15.591   0.694 -17.501
  705   2HG   GLN  87          1HG       GLN  87 -14.456   1.098 -18.788
  706   1HE2  GLN  87          2HE2      GLN  87 -17.319  -1.542 -19.590
  707   2HE2  GLN  87          1HE2      GLN  87 -17.363  -0.432 -18.306
  708    H    HIS  88           H        HIS  88 -13.449  -0.191 -14.544
  709    HA   HIS  88           HA       HIS  88 -15.309   1.957 -13.930
  710   1HB   HIS  88          2HB       HIS  88 -15.332  -0.554 -13.172
  711   2HB   HIS  88          1HB       HIS  88 -14.263   0.021 -11.899
  712    HD1  HIS  88           HD1      HIS  88 -17.770   0.427 -13.226
  713    HD2  HIS  88           HD2      HIS  88 -15.512   1.637  -9.939
  714    HE1  HIS  88           HE1      HIS  88 -19.397   1.456 -11.579
  715    H    TYR  89           H        TYR  89 -12.097   0.977 -13.033
  716    HA   TYR  89           HA       TYR  89 -11.693   2.983 -10.996
  717   1HB   TYR  89          2HB       TYR  89  -9.856   1.207 -12.588
  718   2HB   TYR  89          1HB       TYR  89  -9.250   2.350 -11.398
  719    HD1  TYR  89           HD1      TYR  89 -12.132  -0.060 -11.497
  720    HD2  TYR  89           HD2      TYR  89  -8.620   1.296  -9.440
  721    HE1  TYR  89           HE1      TYR  89 -12.512  -1.744  -9.737
  722    HE2  TYR  89           HE2      TYR  89  -9.008  -0.392  -7.667
  723    HH   TYR  89           HH       TYR  89 -11.039  -1.661  -6.754
  724    H    SER  90           H        SER  90 -11.695   2.980 -14.417
  725    HA   SER  90           HA       SER  90  -9.813   5.117 -14.831
  726   1HB   SER  90          2HB       SER  90 -11.597   3.479 -16.463
  727   2HB   SER  90          1HB       SER  90 -11.549   5.158 -16.997
  728    HG   SER  90           HG       SER  90  -9.891   3.980 -17.970
  729    H    GLU  91           H        GLU  91 -13.283   4.880 -14.342
  730    HA   GLU  91           HA       GLU  91 -13.660   7.773 -14.749
  731   1HB   GLU  91          2HB       GLU  91 -16.026   7.252 -14.139
  732   2HB   GLU  91          1HB       GLU  91 -15.441   6.264 -15.476
  733   1HG   GLU  91          2HG       GLU  91 -15.590   4.345 -14.273
  734   2HG   GLU  91          1HG       GLU  91 -14.926   5.101 -12.824
  735    H    ARG  92           H        ARG  92 -13.043   5.511 -12.227
  736    HA   ARG  92           HA       ARG  92 -13.145   7.750 -10.259
  737   1HB   ARG  92          2HB       ARG  92 -14.048   5.058  -9.350
  738   2HB   ARG  92          1HB       ARG  92 -14.507   6.650  -8.751
  739   1HG   ARG  92          2HG       ARG  92 -15.554   6.871 -11.192
  740   2HG   ARG  92          1HG       ARG  92 -15.590   5.111 -11.077
  741   1HD   ARG  92          2HD       ARG  92 -17.692   5.918 -10.219
  742   2HD   ARG  92          1HD       ARG  92 -16.740   5.379  -8.836
  743    HE   ARG  92           HE       ARG  92 -16.093   7.998  -8.869
  744   1HH1  ARG  92          2HH1      ARG  92 -18.751   7.955 -10.603
  745   2HH1  ARG  92          1HH1      ARG  92 -19.857   8.558  -9.416
  746   1HH2  ARG  92          1HH2      ARG  92 -17.670   8.104  -6.763
  747   2HH2  ARG  92          2HH2      ARG  92 -19.244   8.643  -7.241
  748    H    ALA  93           H        ALA  93 -11.584   7.556  -8.614
  749    HA   ALA  93           HA       ALA  93  -9.206   6.119  -9.238
  750   1HB   ALA  93          1HB       ALA  93 -10.166   7.271  -6.600
  751   2HB   ALA  93          3HB       ALA  93  -8.535   6.659  -6.875
  752   3HB   ALA  93          2HB       ALA  93  -9.115   8.060  -7.777
  753    H    ALA  94           H        ALA  94 -12.100   5.191  -7.565
  754    HA   ALA  94           HA       ALA  94 -12.786   3.001  -7.004
  755   1HB   ALA  94          1HB       ALA  94 -10.511   2.481  -8.512
  756   2HB   ALA  94          3HB       ALA  94 -10.155   1.725  -6.960
  757   3HB   ALA  94          2HB       ALA  94 -11.607   1.270  -7.850
  758    H    GLY  95           H        GLY  95 -10.392   4.904  -5.546
  759   1HA   GLY  95          2HA       GLY  95 -10.673   5.174  -3.084
  760   2HA   GLY  95          1HA       GLY  95 -10.808   3.421  -2.992
  761    H    LEU  96           H        LEU  96  -8.476   3.803  -5.254
  762    HA   LEU  96           HA       LEU  96  -6.357   3.504  -3.203
  763   1HB   LEU  96          2HB       LEU  96  -4.986   2.728  -5.151
  764   2HB   LEU  96          1HB       LEU  96  -6.450   1.776  -4.913
  765    HG   LEU  96           HG       LEU  96  -6.857   4.120  -6.642
  766   1HD1  LEU  96          3HD1      LEU  96  -4.902   1.939  -7.392
  767   2HD1  LEU  96          2HD1      LEU  96  -5.727   2.948  -8.584
  768   3HD1  LEU  96          1HD1      LEU  96  -4.633   3.683  -7.412
  769   1HD2  LEU  96          3HD2      LEU  96  -7.332   1.139  -6.948
  770   2HD2  LEU  96          2HD2      LEU  96  -8.500   2.315  -6.352
  771   3HD2  LEU  96          1HD2      LEU  96  -7.956   2.386  -8.026
  772    H    SER  97           H        SER  97  -4.178   4.345  -4.831
  773    HA   SER  97           HA       SER  97  -4.030   7.090  -4.221
  774   1HB   SER  97          2HB       SER  97  -2.522   5.314  -6.122
  775   2HB   SER  97          1HB       SER  97  -2.215   7.050  -6.113
  776    HG   SER  97           HG       SER  97  -1.073   6.736  -4.404
  777    H    SER  98           H        SER  98  -5.502   5.476  -6.956
  778    HA   SER  98           HA       SER  98  -7.108   7.561  -7.787
  779   1HB   SER  98          2HB       SER  98  -5.747   9.167  -8.591
  780   2HB   SER  98          1HB       SER  98  -4.332   8.134  -8.403
  781    HG   SER  98           HG       SER  98  -5.383   8.876 -10.634
  782    H    ARG  99           H        ARG  99  -7.366   7.470 -10.398
  783    HA   ARG  99           HA       ARG  99  -8.246   4.821 -10.988
  784   1HB   ARG  99          2HB       ARG  99  -8.553   5.699 -13.308
  785   2HB   ARG  99          1HB       ARG  99  -9.253   6.749 -12.078
  786   1HG   ARG  99          2HG       ARG  99  -6.901   7.923 -12.145
  787   2HG   ARG  99          1HG       ARG  99  -6.776   7.155 -13.728
  788   1HD   ARG  99          2HD       ARG  99  -9.262   8.153 -13.951
  789   2HD   ARG  99          1HD       ARG  99  -8.604   9.324 -12.808
  790    HE   ARG  99           HE       ARG  99  -6.863   9.854 -14.490
  791   1HH1  ARG  99          2HH1      ARG  99  -8.511   7.191 -15.665
  792   2HH1  ARG  99          1HH1      ARG  99  -8.780   7.829 -17.252
  793   1HH2  ARG  99          1HH2      ARG  99  -7.648  11.007 -16.454
  794   2HH2  ARG  99          2HH2      ARG  99  -8.292   9.990 -17.699
  795    H    LEU 100           H        LEU 100  -7.418   4.208 -13.520
  796    HA   LEU 100           HA       LEU 100  -4.701   3.202 -13.001
  797   1HB   LEU 100          2HB       LEU 100  -5.498   2.625 -15.706
  798   2HB   LEU 100          1HB       LEU 100  -5.232   1.507 -14.380
  799    HG   LEU 100           HG       LEU 100  -7.461   1.137 -15.138
  800   1HD1  LEU 100          3HD1      LEU 100  -6.939   2.171 -12.535
  801   2HD1  LEU 100          2HD1      LEU 100  -8.542   2.703 -13.044
  802   3HD1  LEU 100          1HD1      LEU 100  -8.145   0.980 -13.027
  803   1HD2  LEU 100          3HD2      LEU 100  -7.481   4.087 -15.390
  804   2HD2  LEU 100          2HD2      LEU 100  -8.236   2.859 -16.406
  805   3HD2  LEU 100          1HD2      LEU 100  -9.001   3.344 -14.893
  806    H    VAL 101           H        VAL 101  -3.350   3.192 -15.286
  807    HA   VAL 101           HA       VAL 101  -2.200   5.723 -15.550
  808    HB   VAL 101           HB       VAL 101  -2.419   3.449 -17.530
  809   1HG1  VAL 101          2HG1      VAL 101  -2.080   5.674 -18.669
  810   2HG1  VAL 101          1HG1      VAL 101  -0.590   5.847 -17.737
  811   3HG1  VAL 101          3HG1      VAL 101  -0.761   4.523 -18.894
  812   1HG2  VAL 101          2HG2      VAL 101  -0.419   4.391 -15.503
  813   2HG2  VAL 101          1HG2      VAL 101  -1.048   2.769 -15.766
  814   3HG2  VAL 101          3HG2      VAL 101   0.119   3.453 -16.894
  815    H    VAL 102           H        VAL 102  -2.852   7.602 -16.494
  816    HA   VAL 102           HA       VAL 102  -5.443   8.085 -17.417
  817    HB   VAL 102           HB       VAL 102  -2.874   9.476 -18.230
  818   1HG1  VAL 102          3HG1      VAL 102  -4.971   9.822 -19.698
  819   2HG1  VAL 102          2HG1      VAL 102  -5.657  10.642 -18.297
  820   3HG1  VAL 102          1HG1      VAL 102  -4.191  11.266 -19.052
  821   1HG2  VAL 102          2HG2      VAL 102  -4.470   9.413 -15.806
  822   2HG2  VAL 102          1HG2      VAL 102  -2.910  10.185 -16.090
  823   3HG2  VAL 102          3HG2      VAL 102  -4.402  11.045 -16.472
  824    HA   PRO 103           HA       PRO 103  -5.469   6.164 -21.393
  825   1HB   PRO 103          2HB       PRO 103  -7.792   7.320 -22.302
  826   2HB   PRO 103          1HB       PRO 103  -7.751   5.985 -21.141
  827   1HG   PRO 103          2HG       PRO 103  -8.325   8.879 -20.672
  828   2HG   PRO 103          1HG       PRO 103  -8.869   7.468 -19.753
  829   1HD   PRO 103          2HD       PRO 103  -6.765   9.224 -19.026
  830   2HD   PRO 103          1HD       PRO 103  -7.107   7.644 -18.292
  831    H    SER 104           H        SER 104  -5.516   6.838 -23.744
  832    HA   SER 104           HA       SER 104  -4.529   8.157 -25.428
  833   1HB   SER 104          2HB       SER 104  -6.637   9.283 -25.416
  834   2HB   SER 104          1HB       SER 104  -6.258  10.123 -23.913
  835    HG   SER 104           HG       SER 104  -4.511  10.471 -26.045
  836    H    HIS 105           H        HIS 105  -2.596   7.681 -23.667
  837    HA   HIS 105           HA       HIS 105  -1.492   9.807 -22.176
  838   1HB   HIS 105          2HB       HIS 105   0.669   8.651 -22.444
  839   2HB   HIS 105          1HB       HIS 105  -0.619   7.494 -22.109
  840    HD1  HIS 105           HD1      HIS 105   1.802   8.543 -24.738
  841    HD2  HIS 105           HD2      HIS 105  -1.415   5.915 -24.394
  842    HE1  HIS 105           HE1      HIS 105   1.888   7.038 -26.771
  843    H    LYS 106           HN       LYS 106  -1.189   9.065 -25.637
  844    HA   LYS 106           HA       LYS 106   0.789  10.787 -26.470
  845   1HB   LYS 106          2HB       LYS 106  -1.292   9.439 -27.720
  846   2HB   LYS 106          1HB       LYS 106  -1.608  11.129 -28.112
  847   1HG   LYS 106          2HG       LYS 106   0.789  11.343 -28.834
  848   2HG   LYS 106          1HG       LYS 106   0.970   9.605 -28.589
  849   1HD   LYS 106          2HD       LYS 106  -0.070   9.131 -30.538
  850   2HD   LYS 106          1HD       LYS 106  -1.388  10.250 -30.187
  851   1HE   LYS 106          2HE       LYS 106  -0.173  12.108 -31.058
  852   2HE   LYS 106          1HE       LYS 106   1.340  11.203 -31.081
  853   1HZ   LYS 106          3HZ       LYS 106  -0.122   9.651 -32.624
  854   2HZ   LYS 106          2HZ       LYS 106  -0.905  11.126 -32.939
  855   3HZ   LYS 106          1HZ       LYS 106   0.760  10.963 -33.237
  856   1H    GLU 201          3HT       GLU 201   9.716  -0.133   4.603
  857   2H    GLU 201          2HT       GLU 201  10.954  -1.003   5.373
  858   3H    GLU 201          1HT       GLU 201  11.256  -0.219   3.897
  859    HA   GLU 201           HA       GLU 201  10.471  -1.900   2.692
  860   1HB   GLU 201          2HB       GLU 201  11.674  -2.891   4.905
  861   2HB   GLU 201          1HB       GLU 201  10.081  -3.630   5.075
  862   1HG   GLU 201          2HG       GLU 201  10.244  -4.528   2.786
  863   2HG   GLU 201          1HG       GLU 201  11.833  -3.784   2.604
  864    HA   PRO 202           HA       PRO 202   6.043  -1.333   3.864
  865   1HB   PRO 202          2HB       PRO 202   5.341  -0.071   1.523
  866   2HB   PRO 202          1HB       PRO 202   5.925   0.786   2.960
  867   1HG   PRO 202          2HG       PRO 202   7.356   0.215   0.407
  868   2HG   PRO 202          1HG       PRO 202   7.608   1.532   1.564
  869   1HD   PRO 202          2HD       PRO 202   9.200  -0.797   1.330
  870   2HD   PRO 202          1HD       PRO 202   9.232   0.359   2.678
  871    H    GLN 203           H        GLN 203   4.138  -2.278   2.679
  872    HA   GLN 203           HA       GLN 203   5.030  -4.476   0.865
  873   1HB   GLN 203          2HB       GLN 203   2.606  -4.226   2.669
  874   2HB   GLN 203          1HB       GLN 203   2.860  -5.561   1.544
  875   1HG   GLN 203          2HG       GLN 203   5.266  -5.499   2.846
  876   2HG   GLN 203          1HG       GLN 203   4.166  -5.009   4.134
  877   1HE2  GLN 203          2HE2      GLN 203   4.276  -8.867   3.040
  878   2HE2  GLN 203          1HE2      GLN 203   5.421  -7.728   2.521
  879   1HN   PTR 204          1HN       PTR 204   1.697  -3.446   1.225
  880    HA   PTR 204           HA       PTR 204   1.773  -2.067  -1.399
  881   1HB   PTR 204          1HB       PTR 204  -0.339  -3.488  -1.985
  882    HD1  PTR 204           HD1      PTR 204   1.320  -2.656  -3.816
  883    HD2  PTR 204           HD2      PTR 204   1.948  -6.167  -1.419
  884    HE1  PTR 204           HE1      PTR 204   2.932  -3.518  -5.495
  885    HE2  PTR 204           HE2      PTR 204   3.558  -7.026  -3.096
  886    H    GLU 205           H        GLU 205   0.973  -0.127  -0.662
  887    HA   GLU 205           HA       GLU 205  -0.710   0.411   1.467
  888   1HB   GLU 205          2HB       GLU 205  -0.812   1.739  -1.261
  889   2HB   GLU 205          1HB       GLU 205  -1.455   2.421   0.233
  890   1HG   GLU 205          2HG       GLU 205   1.207   1.643   0.798
  891   2HG   GLU 205          1HG       GLU 205   1.253   2.483  -0.753
  892    H    GLU 206           H        GLU 206  -2.652  -0.467   1.980
  893    HA   GLU 206           HA       GLU 206  -4.488  -1.199  -0.266
  894   1HB   GLU 206          2HB       GLU 206  -5.370  -2.957   1.107
  895   2HB   GLU 206          1HB       GLU 206  -3.614  -3.074   1.223
  896   1HG   GLU 206          2HG       GLU 206  -3.640  -1.861   3.348
  897   2HG   GLU 206          1HG       GLU 206  -5.386  -1.642   3.225
  898    H    ILE 207           H        ILE 207  -6.492  -0.245  -0.278
  899    HA   ILE 207           HA       ILE 207  -7.075   2.067   1.174
  900    HB   ILE 207           HB       ILE 207  -8.868   0.018  -0.130
  901   1HG1  ILE 207          2HG1      ILE 207  -9.254   2.082  -1.616
  902   2HG1  ILE 207          1HG1      ILE 207  -7.889   2.806  -0.767
  903   1HG2  ILE 207          2HG2      ILE 207  -9.621   2.039   1.811
  904   2HG2  ILE 207          1HG2      ILE 207 -10.336   2.391   0.238
  905   3HG2  ILE 207          3HG2      ILE 207 -10.633   0.835   1.013
  906   1HD1  ILE 207          3HD1      ILE 207  -7.625   0.057  -1.957
  907   2HD1  ILE 207          2HD1      ILE 207  -7.446   1.482  -2.981
  908   3HD1  ILE 207          1HD1      ILE 207  -6.365   1.240  -1.609
  909    HA   PRO 208           HA       PRO 208  -7.914   0.411   5.202
  910   1HB   PRO 208          2HB       PRO 208  -8.758   2.774   6.324
  911   2HB   PRO 208          1HB       PRO 208  -7.055   2.380   6.039
  912   1HG   PRO 208          2HG       PRO 208  -8.821   4.259   4.543
  913   2HG   PRO 208          1HG       PRO 208  -7.059   4.281   4.726
  914   1HD   PRO 208          2HD       PRO 208  -8.481   3.373   2.451
  915   2HD   PRO 208          1HD       PRO 208  -6.757   3.105   2.782
  916    H    ILE 209           H        ILE 209  -9.919   1.049   6.880
  917    HA   ILE 209           HA       ILE 209 -12.453   1.099   5.326
  918    HB   ILE 209           HB       ILE 209 -11.771  -1.006   7.402
  919   1HG1  ILE 209          2HG1      ILE 209 -12.483  -2.190   4.957
  920   2HG1  ILE 209          1HG1      ILE 209 -11.393  -0.874   4.522
  921   1HG2  ILE 209          3HG2      ILE 209 -14.221  -0.005   6.974
  922   2HG2  ILE 209          2HG2      ILE 209 -14.166  -1.141   5.625
  923   3HG2  ILE 209          1HG2      ILE 209 -13.959  -1.723   7.277
  924   1HD1  ILE 209          2HD1      ILE 209 -10.248  -2.062   6.800
  925   2HD1  ILE 209          1HD1      ILE 209 -10.774  -3.406   5.787
  926   3HD1  ILE 209          3HD1      ILE 209  -9.674  -2.192   5.138
  927    H    TYR 210           H        TYR 210 -10.856   1.194   8.486
  928    HA   TYR 210           HA       TYR 210 -13.113   2.115   9.985
  929   1HB   TYR 210          2HB       TYR 210 -10.201   1.915  10.378
  930   2HB   TYR 210          1HB       TYR 210 -10.954   3.246  11.257
  931    HD1  TYR 210           HD1      TYR 210 -11.495  -0.389  10.500
  932    HD2  TYR 210           HD2      TYR 210 -11.953   2.815  13.322
  933    HE1  TYR 210           HE1      TYR 210 -12.378  -1.991  12.175
  934    HE2  TYR 210           HE2      TYR 210 -12.837   1.215  14.997
  935    HH   TYR 210           HH       TYR 210 -13.914  -0.977  15.052
  936    H    LEU 211           HN       LEU 211 -12.467   4.481  11.168
  937    HA   LEU 211           HA       LEU 211 -12.720   6.391   8.893
  938   1HB   LEU 211          2HB       LEU 211 -14.133   6.093  11.334
  939   2HB   LEU 211          1HB       LEU 211 -13.214   7.594  11.464
  940    HG   LEU 211           HG       LEU 211 -14.466   7.242   8.836
  941   1HD1  LEU 211          2HD1      LEU 211 -16.022   6.603  11.175
  942   2HD1  LEU 211          1HD1      LEU 211 -16.612   8.109  10.474
  943   3HD1  LEU 211          3HD1      LEU 211 -16.537   6.648   9.490
  944   1HD2  LEU 211          1HD2      LEU 211 -13.708   9.307  10.706
  945   2HD2  LEU 211          3HD2      LEU 211 -14.096   9.459   8.992
  946   3HD2  LEU 211          2HD2      LEU 211 -15.380   9.548  10.198
   
  No H/Q in entry =         946
  Start of MODEL   11
    1   1H    SER   1          3HT       SER   1  -3.499  -8.253 -22.858
    2   2H    SER   1          2HT       SER   1  -3.774  -9.911 -22.609
    3   3H    SER   1          1HT       SER   1  -3.238  -9.353 -24.122
    4    HA   SER   1           HA       SER   1  -5.316  -9.130 -24.801
    5   1HB   SER   1          2HB       SER   1  -5.532 -10.829 -22.708
    6   2HB   SER   1          1HB       SER   1  -6.563  -9.519 -22.132
    7    HG   SER   1           HG       SER   1  -7.468  -9.658 -24.381
    8    H    ILE   2           H        ILE   2  -5.473  -7.841 -21.459
    9    HA   ILE   2           HA       ILE   2  -7.243  -5.718 -22.017
   10    HB   ILE   2           HB       ILE   2  -5.907  -4.580 -20.045
   11   1HG1  ILE   2          2HG1      ILE   2  -4.994  -7.444 -19.722
   12   2HG1  ILE   2          1HG1      ILE   2  -3.963  -6.215 -20.453
   13   1HG2  ILE   2          2HG2      ILE   2  -7.782  -6.856 -20.152
   14   2HG2  ILE   2          1HG2      ILE   2  -6.939  -6.671 -18.614
   15   3HG2  ILE   2          3HG2      ILE   2  -7.900  -5.340 -19.258
   16   1HD1  ILE   2          1HD1      ILE   2  -5.251  -5.952 -17.720
   17   2HD1  ILE   2          3HD1      ILE   2  -3.594  -6.494 -17.982
   18   3HD1  ILE   2          2HD1      ILE   2  -4.068  -4.858 -18.441
   19    H    GLN   3           H        GLN   3  -6.066  -3.307 -21.394
   20    HA   GLN   3           HA       GLN   3  -5.185  -2.248 -23.779
   21   1HB   GLN   3          2HB       GLN   3  -5.012  -1.458 -20.983
   22   2HB   GLN   3          1HB       GLN   3  -3.635  -0.868 -21.913
   23   1HG   GLN   3          2HG       GLN   3  -6.368  -0.597 -23.105
   24   2HG   GLN   3          1HG       GLN   3  -5.908   0.511 -21.813
   25   1HE2  GLN   3          2HE2      GLN   3  -3.111   0.677 -24.760
   26   2HE2  GLN   3          1HE2      GLN   3  -3.375  -0.752 -23.884
   27    H    ALA   4           H        ALA   4  -3.079  -3.603 -21.265
   28    HA   ALA   4           HA       ALA   4  -0.840  -4.315 -21.374
   29   1HB   ALA   4          3HB       ALA   4  -2.276  -5.680 -23.208
   30   2HB   ALA   4          2HB       ALA   4  -1.089  -4.915 -24.264
   31   3HB   ALA   4          1HB       ALA   4  -0.554  -5.951 -22.940
   32    H    GLU   5           H        GLU   5  -1.631  -1.489 -22.391
   33    HA   GLU   5           HA       GLU   5   1.077  -0.781 -23.235
   34   1HB   GLU   5          2HB       GLU   5  -1.248  -0.526 -25.159
   35   2HB   GLU   5          1HB       GLU   5   0.275   0.340 -25.355
   36   1HG   GLU   5          2HG       GLU   5   1.443  -1.911 -25.246
   37   2HG   GLU   5          1HG       GLU   5  -0.152  -2.655 -25.350
   38    H    GLU   6           H        GLU   6  -0.959  -0.066 -21.119
   39    HA   GLU   6           HA       GLU   6  -0.582   2.837 -21.341
   40   1HB   GLU   6          2HB       GLU   6  -3.306   1.549 -21.434
   41   2HB   GLU   6          1HB       GLU   6  -3.082   3.199 -20.854
   42   1HG   GLU   6          2HG       GLU   6  -2.323   2.120 -23.584
   43   2HG   GLU   6          1HG       GLU   6  -3.603   3.279 -23.227
   44    H    TRP   7           H        TRP   7  -2.505   0.462 -19.487
   45    HA   TRP   7           HA       TRP   7  -1.325   1.651 -17.012
   46   1HB   TRP   7          2HB       TRP   7  -3.530   0.966 -15.932
   47   2HB   TRP   7          1HB       TRP   7  -3.623   2.308 -17.071
   48    HD1  TRP   7           HD1      TRP   7  -5.087   2.027 -19.166
   49    HE1  TRP   7           HE1      TRP   7  -6.554   0.123 -20.098
   50    HE3  TRP   7           HE3      TRP   7  -3.663  -1.782 -16.076
   51    HZ2  TRP   7           HZ2      TRP   7  -7.054  -2.648 -19.603
   52    HZ3  TRP   7           HZ3      TRP   7  -4.646  -4.042 -16.330
   53    HH2  TRP   7           HH2      TRP   7  -6.339  -4.478 -18.090
   54    H    TYR   8           H        TYR   8  -1.207  -1.000 -18.883
   55    HA   TYR   8           HA       TYR   8  -0.528  -2.728 -16.582
   56   1HB   TYR   8          2HB       TYR   8  -2.658  -3.575 -16.815
   57   2HB   TYR   8          1HB       TYR   8  -2.755  -3.184 -18.525
   58    HD1  TYR   8           HD1      TYR   8  -1.323  -5.556 -16.049
   59    HD2  TYR   8           HD2      TYR   8  -2.131  -4.767 -20.187
   60    HE1  TYR   8           HE1      TYR   8  -0.734  -7.897 -16.616
   61    HE2  TYR   8           HE2      TYR   8  -1.557  -7.110 -20.754
   62    HH   TYR   8           HH       TYR   8  -0.202  -9.294 -18.350
   63    H    PHE   9           H        PHE   9   1.596  -2.874 -17.100
   64    HA   PHE   9           HA       PHE   9   2.617  -3.028 -19.777
   65   1HB   PHE   9          2HB       PHE   9   3.748  -3.403 -17.029
   66   2HB   PHE   9          1HB       PHE   9   4.711  -3.879 -18.428
   67    HD1  PHE   9           HD1      PHE   9   2.210  -1.155 -18.519
   68    HD2  PHE   9           HD2      PHE   9   6.389  -2.119 -18.179
   69    HE1  PHE   9           HE1      PHE   9   2.795   1.222 -18.913
   70    HE2  PHE   9           HE2      PHE   9   6.968   0.259 -18.574
   71    HZ   PHE   9           HZ       PHE   9   5.171   1.929 -18.941
   72    H    GLY  10           H        GLY  10   1.968  -5.518 -17.313
   73   1HA   GLY  10          2HA       GLY  10   1.177  -7.614 -18.789
   74   2HA   GLY  10          1HA       GLY  10   2.881  -7.599 -19.212
   75    H    LYS  11           H        LYS  11   3.946  -9.103 -18.067
   76    HA   LYS  11           HA       LYS  11   3.167  -9.535 -15.222
   77   1HB   LYS  11          2HB       LYS  11   4.536 -11.541 -17.034
   78   2HB   LYS  11          1HB       LYS  11   3.840 -11.840 -15.442
   79   1HG   LYS  11          2HG       LYS  11   1.652 -11.747 -16.232
   80   2HG   LYS  11          1HG       LYS  11   2.085 -10.733 -17.609
   81   1HD   LYS  11          2HD       LYS  11   3.145 -12.601 -18.729
   82   2HD   LYS  11          1HD       LYS  11   2.946 -13.624 -17.306
   83   1HE   LYS  11          2HE       LYS  11   0.916 -14.245 -18.054
   84   2HE   LYS  11          1HE       LYS  11   0.381 -12.566 -17.963
   85   1HZ   LYS  11          1HZ       LYS  11   1.777 -12.467 -20.196
   86   2HZ   LYS  11          3HZ       LYS  11   1.317 -14.098 -20.258
   87   3HZ   LYS  11          2HZ       LYS  11   0.130 -12.886 -20.170
   88    H    LEU  12           H        LEU  12   4.682  -7.629 -15.028
   89    HA   LEU  12           HA       LEU  12   7.529  -8.525 -15.111
   90   1HB   LEU  12          2HB       LEU  12   8.008  -6.542 -16.062
   91   2HB   LEU  12          1HB       LEU  12   6.281  -6.250 -16.182
   92    HG   LEU  12           HG       LEU  12   8.137  -5.350 -13.974
   93   1HD1  LEU  12          1HD1      LEU  12   6.511  -3.995 -16.127
   94   2HD1  LEU  12          3HD1      LEU  12   7.075  -3.114 -14.704
   95   3HD1  LEU  12          2HD1      LEU  12   8.241  -3.848 -15.811
   96   1HD2  LEU  12          3HD2      LEU  12   5.297  -5.892 -13.880
   97   2HD2  LEU  12          2HD2      LEU  12   6.401  -5.403 -12.587
   98   3HD2  LEU  12          1HD2      LEU  12   5.638  -4.181 -13.602
   99    H    GLY  13           H        GLY  13   8.745  -6.901 -13.313
  100   1HA   GLY  13          2HA       GLY  13   7.444  -7.722 -10.764
  101   2HA   GLY  13          1HA       GLY  13   9.154  -7.337 -10.955
  102    H    ARG  14           H        ARG  14   7.293  -6.177  -9.001
  103    HA   ARG  14           HA       ARG  14   6.385  -3.585  -9.756
  104   1HB   ARG  14          2HB       ARG  14   6.581  -3.056  -7.318
  105   2HB   ARG  14          1HB       ARG  14   5.736  -4.572  -7.626
  106   1HG   ARG  14          2HG       ARG  14   7.249  -5.171  -5.935
  107   2HG   ARG  14          1HG       ARG  14   8.110  -5.645  -7.399
  108   1HD   ARG  14          2HD       ARG  14   9.793  -4.260  -6.838
  109   2HD   ARG  14          1HD       ARG  14   8.680  -2.893  -6.925
  110    HE   ARG  14           HE       ARG  14   8.117  -3.495  -4.484
  111   1HH1  ARG  14          1HH2      ARG  14   9.482  -5.500  -3.383
  112   2HH1  ARG  14          2HH2      ARG  14  11.101  -4.972  -3.069
  113   1HH2  ARG  14          2HH1      ARG  14  10.915  -2.257  -5.217
  114   2HH2  ARG  14          1HH1      ARG  14  11.913  -3.136  -4.107
  115    H    LYS  15           H        LYS  15   9.560  -4.807  -9.172
  116    HA   LYS  15           HA       LYS  15  10.816  -2.268  -8.646
  117   1HB   LYS  15          2HB       LYS  15  11.744  -4.555  -8.009
  118   2HB   LYS  15          1HB       LYS  15  12.140  -4.766  -9.715
  119   1HG   LYS  15          2HG       LYS  15  13.302  -2.430  -9.460
  120   2HG   LYS  15          1HG       LYS  15  13.277  -2.805  -7.737
  121   1HD   LYS  15          2HD       LYS  15  14.580  -4.785  -8.055
  122   2HD   LYS  15          1HD       LYS  15  14.360  -4.732  -9.804
  123   1HE   LYS  15          2HE       LYS  15  16.225  -3.487  -9.990
  124   2HE   LYS  15          1HE       LYS  15  15.478  -2.234  -9.000
  125   1HZ   LYS  15          1HZ       LYS  15  16.157  -4.036  -7.150
  126   2HZ   LYS  15          3HZ       LYS  15  17.411  -4.262  -8.271
  127   3HZ   LYS  15          2HZ       LYS  15  17.137  -2.724  -7.599
  128    H    ASP  16           H        ASP  16  10.028  -4.201 -11.449
  129    HA   ASP  16           HA       ASP  16  11.644  -2.726 -13.295
  130   1HB   ASP  16          2HB       ASP  16  10.262  -5.089 -13.316
  131   2HB   ASP  16          1HB       ASP  16   9.216  -4.037 -14.229
  132    H    ALA  17           H        ALA  17   8.572  -2.363 -11.779
  133    HA   ALA  17           HA       ALA  17   7.449  -0.519 -13.721
  134   1HB   ALA  17          1HB       ALA  17   6.692  -1.174 -10.867
  135   2HB   ALA  17          3HB       ALA  17   5.765  -0.091 -11.907
  136   3HB   ALA  17          2HB       ALA  17   5.935  -1.795 -12.335
  137    H    GLU  18           H        GLU  18   9.226  -0.245 -10.686
  138    HA   GLU  18           HA       GLU  18   8.980   2.638 -10.529
  139   1HB   GLU  18          2HB       GLU  18  10.828   2.463  -8.877
  140   2HB   GLU  18          1HB       GLU  18   9.563   1.280  -8.544
  141   1HG   GLU  18          2HG       GLU  18  10.844  -0.510  -9.360
  142   2HG   GLU  18          1HG       GLU  18  11.904   0.549 -10.291
  143    H    ARG  19           H        ARG  19  11.100   0.413 -12.148
  144    HA   ARG  19           HA       ARG  19  13.042   2.510 -12.862
  145   1HB   ARG  19          2HB       ARG  19  12.816  -0.435 -13.212
  146   2HB   ARG  19          1HB       ARG  19  13.738   0.437 -14.437
  147   1HG   ARG  19          2HG       ARG  19  14.341   1.308 -11.699
  148   2HG   ARG  19          1HG       ARG  19  14.726  -0.389 -11.991
  149   1HD   ARG  19          2HD       ARG  19  16.247   0.118 -13.700
  150   2HD   ARG  19          1HD       ARG  19  15.534   1.703 -13.996
  151    HE   ARG  19           HE       ARG  19  17.287   2.402 -12.569
  152   1HH1  ARG  19          2HH1      ARG  19  16.982  -0.808 -11.791
  153   2HH1  ARG  19          1HH1      ARG  19  17.219  -0.619 -10.086
  154   1HH2  ARG  19          1HH2      ARG  19  17.033   2.842 -10.174
  155   2HH2  ARG  19          2HH2      ARG  19  17.248   1.447  -9.170
  156    H    GLN  20           H        GLN  20  10.260   0.931 -14.287
  157    HA   GLN  20           HA       GLN  20  10.828   2.009 -16.963
  158   1HB   GLN  20          2HB       GLN  20   8.553   0.405 -15.784
  159   2HB   GLN  20          1HB       GLN  20   8.481   1.060 -17.420
  160   1HG   GLN  20          2HG       GLN  20  10.551  -0.864 -16.321
  161   2HG   GLN  20          1HG       GLN  20   9.333  -1.209 -17.548
  162   1HE2  GLN  20          2HE2      GLN  20  12.828   0.053 -18.840
  163   2HE2  GLN  20          1HE2      GLN  20  12.539  -0.790 -17.396
  164    H    LEU  21           H        LEU  21   9.141   2.960 -14.103
  165    HA   LEU  21           HA       LEU  21   7.455   4.914 -15.516
  166   1HB   LEU  21          2HB       LEU  21   7.571   3.755 -12.849
  167   2HB   LEU  21          1HB       LEU  21   7.402   5.507 -12.786
  168    HG   LEU  21           HG       LEU  21   5.493   5.347 -14.383
  169   1HD1  LEU  21          1HD1      LEU  21   6.344   2.496 -14.305
  170   2HD1  LEU  21          3HD1      LEU  21   4.607   2.797 -14.339
  171   3HD1  LEU  21          2HD1      LEU  21   5.635   3.423 -15.628
  172   1HD2  LEU  21          1HD2      LEU  21   5.369   5.114 -11.764
  173   2HD2  LEU  21          3HD2      LEU  21   3.932   4.797 -12.735
  174   3HD2  LEU  21          2HD2      LEU  21   4.899   3.454 -12.126
  175    H    LEU  22           H        LEU  22  10.148   4.991 -13.181
  176    HA   LEU  22           HA       LEU  22  10.475   7.865 -13.414
  177   1HB   LEU  22          2HB       LEU  22  12.515   5.851 -12.431
  178   2HB   LEU  22          1HB       LEU  22  12.439   7.569 -12.043
  179    HG   LEU  22           HG       LEU  22  10.521   5.389 -11.193
  180   1HD1  LEU  22          1HD1      LEU  22  12.757   6.193  -9.968
  181   2HD1  LEU  22          3HD1      LEU  22  11.682   7.465  -9.387
  182   3HD1  LEU  22          2HD1      LEU  22  11.306   5.774  -9.057
  183   1HD2  LEU  22          2HD2      LEU  22  10.147   8.354 -11.400
  184   2HD2  LEU  22          1HD2      LEU  22   8.981   7.060 -11.673
  185   3HD2  LEU  22          3HD2      LEU  22   9.436   7.505 -10.028
  186    H    SER  23           H        SER  23  11.797   5.056 -15.072
  187    HA   SER  23           HA       SER  23  13.661   6.827 -16.577
  188   1HB   SER  23          2HB       SER  23  14.356   4.550 -15.546
  189   2HB   SER  23          1HB       SER  23  13.457   3.833 -16.884
  190    HG   SER  23           HG       SER  23  14.758   5.179 -18.280
  191    H    PHE  24           H        PHE  24  11.775   7.812 -17.711
  192    HA   PHE  24           HA       PHE  24  11.410   6.806 -20.319
  193   1HB   PHE  24          2HB       PHE  24   9.828   5.403 -18.416
  194   2HB   PHE  24          1HB       PHE  24   8.735   6.424 -19.351
  195    HD1  PHE  24           HD1      PHE  24   9.545   6.526 -21.994
  196    HD2  PHE  24           HD2      PHE  24  10.093   3.255 -19.265
  197    HE1  PHE  24           HE1      PHE  24   9.715   4.959 -23.908
  198    HE2  PHE  24           HE2      PHE  24  10.264   1.687 -21.179
  199    HZ   PHE  24           HZ       PHE  24  10.075   2.540 -23.500
  200    H    GLY  25           H        GLY  25   9.827   8.532 -17.660
  201   1HA   GLY  25          2HA       GLY  25   9.737  11.053 -18.144
  202   2HA   GLY  25          1HA       GLY  25   8.936  10.585 -19.643
  203    H    ASN  26           H        ASN  26   7.467   8.380 -18.305
  204    HA   ASN  26           HA       ASN  26   5.007   9.510 -17.797
  205   1HB   ASN  26          2HB       ASN  26   6.294   7.118 -16.463
  206   2HB   ASN  26          1HB       ASN  26   4.596   7.541 -16.240
  207   1HD2  ASN  26          2HD2      ASN  26   4.504   5.219 -19.071
  208   2HD2  ASN  26          1HD2      ASN  26   4.675   5.176 -17.382
  209    HA   PRO  27           HA       PRO  27   6.230  11.868 -14.132
  210   1HB   PRO  27          2HB       PRO  27   4.256  13.755 -14.457
  211   2HB   PRO  27          1HB       PRO  27   5.823  13.822 -15.280
  212   1HG   PRO  27          2HG       PRO  27   3.143  13.083 -16.375
  213   2HG   PRO  27          1HG       PRO  27   4.543  13.771 -17.212
  214   1HD   PRO  27          2HD       PRO  27   3.740  11.051 -17.260
  215   2HD   PRO  27          1HD       PRO  27   5.301  11.688 -17.816
  216    H    ARG  28           H        ARG  28   4.886  12.511 -12.165
  217    HA   ARG  28           HA       ARG  28   3.432  10.433 -11.060
  218   1HB   ARG  28          2HB       ARG  28   4.049  12.267  -9.650
  219   2HB   ARG  28          1HB       ARG  28   3.136  13.414 -10.629
  220   1HG   ARG  28          2HG       ARG  28   1.038  12.191 -10.012
  221   2HG   ARG  28          1HG       ARG  28   1.992  11.174  -8.933
  222   1HD   ARG  28          2HD       ARG  28   1.273  12.829  -7.460
  223   2HD   ARG  28          1HD       ARG  28   2.822  13.493  -7.980
  224    HE   ARG  28           HE       ARG  28   0.580  14.345  -9.648
  225   1HH1  ARG  28          2HH1      ARG  28   1.932  14.779  -6.531
  226   2HH1  ARG  28          1HH1      ARG  28   1.784  16.504  -6.549
  227   1HH2  ARG  28          1HH2      ARG  28   0.601  16.633  -9.806
  228   2HH2  ARG  28          2HH2      ARG  28   1.031  17.554  -8.404
  229    H    GLY  29           H        GLY  29   1.127  10.039 -10.793
  230   1HA   GLY  29          2HA       GLY  29  -1.191  10.434 -11.400
  231   2HA   GLY  29          1HA       GLY  29  -0.636  11.403 -12.764
  232    H    THR  30           H        THR  30   1.391   8.867 -12.844
  233    HA   THR  30           HA       THR  30  -0.209   7.515 -14.924
  234    HB   THR  30           HB       THR  30   2.448   6.420 -14.251
  235    HG1  THR  30           HG1      THR  30   2.075   9.105 -15.070
  236   1HG2  THR  30          2HG2      THR  30   1.132   7.485 -16.763
  237   2HG2  THR  30          1HG2      THR  30   2.712   6.705 -16.717
  238   3HG2  THR  30          3HG2      THR  30   1.266   5.794 -16.285
  239    H    PHE  31           H        PHE  31  -0.553   5.188 -14.871
  240    HA   PHE  31           HA       PHE  31  -0.133   3.882 -12.242
  241   1HB   PHE  31          2HB       PHE  31  -2.821   4.111 -13.628
  242   2HB   PHE  31          1HB       PHE  31  -2.497   3.088 -12.230
  243    HD1  PHE  31           HD1      PHE  31  -2.359   6.633 -13.409
  244    HD2  PHE  31           HD2      PHE  31  -2.583   3.972 -10.044
  245    HE1  PHE  31           HE1      PHE  31  -2.735   8.568 -11.904
  246    HE2  PHE  31           HE2      PHE  31  -2.959   5.907  -8.539
  247    HZ   PHE  31           HZ       PHE  31  -3.035   8.204  -9.469
  248    H    LEU  32           H        LEU  32   1.247   2.352 -13.113
  249    HA   LEU  32           HA       LEU  32   0.487   0.891 -15.561
  250   1HB   LEU  32          2HB       LEU  32   2.800   1.379 -15.462
  251   2HB   LEU  32          1HB       LEU  32   2.906   0.961 -13.755
  252    HG   LEU  32           HG       LEU  32   2.160  -1.135 -15.784
  253   1HD1  LEU  32          2HD1      LEU  32   4.252  -0.058 -16.570
  254   2HD1  LEU  32          1HD1      LEU  32   4.972  -0.330 -14.983
  255   3HD1  LEU  32          3HD1      LEU  32   4.538  -1.703 -16.001
  256   1HD2  LEU  32          2HD2      LEU  32   2.428  -1.074 -13.000
  257   2HD2  LEU  32          1HD2      LEU  32   2.360  -2.521 -14.005
  258   3HD2  LEU  32          3HD2      LEU  32   3.919  -1.828 -13.563
  259    H    ILE  33           H        ILE  33   0.412  -1.524 -15.499
  260    HA   ILE  33           HA       ILE  33  -0.314  -2.622 -12.823
  261    HB   ILE  33           HB       ILE  33  -1.900  -2.798 -15.387
  262   1HG1  ILE  33          2HG1      ILE  33  -2.525  -2.034 -12.527
  263   2HG1  ILE  33          1HG1      ILE  33  -2.515  -0.970 -13.933
  264   1HG2  ILE  33          1HG2      ILE  33  -1.482  -5.087 -14.256
  265   2HG2  ILE  33          3HG2      ILE  33  -2.489  -4.467 -12.950
  266   3HG2  ILE  33          2HG2      ILE  33  -3.150  -4.626 -14.574
  267   1HD1  ILE  33          2HD1      ILE  33  -4.247  -2.959 -14.728
  268   2HD1  ILE  33          1HD1      ILE  33  -4.597  -2.830 -13.004
  269   3HD1  ILE  33          3HD1      ILE  33  -4.740  -1.411 -14.041
  270    H    ARG  34           H        ARG  34   0.034  -4.978 -12.706
  271    HA   ARG  34           HA       ARG  34   1.114  -6.501 -14.854
  272   1HB   ARG  34          2HB       ARG  34   3.528  -6.478 -14.122
  273   2HB   ARG  34          1HB       ARG  34   2.976  -4.965 -14.841
  274   1HG   ARG  34          2HG       ARG  34   3.913  -4.074 -12.943
  275   2HG   ARG  34          1HG       ARG  34   2.344  -4.490 -12.256
  276   1HD   ARG  34          2HD       ARG  34   3.168  -6.415 -11.207
  277   2HD   ARG  34          1HD       ARG  34   4.551  -6.532 -12.294
  278    HE   ARG  34           HE       ARG  34   5.527  -4.578 -11.084
  279   1HH1  ARG  34          1HH2      ARG  34   3.672  -3.233  -9.536
  280   2HH1  ARG  34          2HH2      ARG  34   3.627  -4.037  -8.001
  281   1HH2  ARG  34          2HH1      ARG  34   5.123  -6.935  -9.179
  282   2HH2  ARG  34          1HH1      ARG  34   4.450  -6.132  -7.800
  283    H    GLU  35           H        GLU  35   2.017  -8.557 -14.125
  284    HA   GLU  35           HA       GLU  35   0.634  -9.712 -11.940
  285   1HB   GLU  35          2HB       GLU  35   2.856 -10.516 -13.741
  286   2HB   GLU  35          1HB       GLU  35   2.654 -11.443 -12.265
  287   1HG   GLU  35          2HG       GLU  35   0.137 -11.507 -12.924
  288   2HG   GLU  35          1HG       GLU  35   0.710 -11.047 -14.528
  289    H    SER  36           H        SER  36   1.123  -9.933  -9.798
  290    HA   SER  36           HA       SER  36   3.231  -8.367  -8.610
  291   1HB   SER  36          2HB       SER  36   1.449 -10.549  -7.486
  292   2HB   SER  36          1HB       SER  36   2.548  -9.579  -6.517
  293    HG   SER  36           HG       SER  36   0.142  -8.972  -7.049
  294    H    GLU  37           H        GLU  37   4.484  -9.719  -6.779
  295    HA   GLU  37           HA       GLU  37   5.654 -12.196  -7.930
  296   1HB   GLU  37          2HB       GLU  37   7.091  -9.648  -7.241
  297   2HB   GLU  37          1HB       GLU  37   7.915 -11.200  -7.112
  298   1HG   GLU  37          2HG       GLU  37   7.019 -11.601  -9.532
  299   2HG   GLU  37          1HG       GLU  37   6.803  -9.851  -9.565
  300    H    THR  38           H        THR  38   3.976 -11.029  -5.557
  301    HA   THR  38           HA       THR  38   5.636 -11.900  -3.272
  302    HB   THR  38           HB       THR  38   3.968  -9.842  -3.413
  303    HG1  THR  38           HG1      THR  38   3.973 -11.582  -1.179
  304   1HG2  THR  38          2HG2      THR  38   2.147 -12.129  -2.616
  305   2HG2  THR  38          1HG2      THR  38   1.749 -10.418  -2.463
  306   3HG2  THR  38          3HG2      THR  38   1.991 -11.129  -4.060
  307    H    THR  39           H        THR  39   2.721 -12.790  -5.035
  308    HA   THR  39           HA       THR  39   2.657 -15.334  -3.449
  309    HB   THR  39           HB       THR  39   0.644 -13.684  -3.475
  310    HG1  THR  39           HG1      THR  39   0.100 -15.529  -2.606
  311   1HG2  THR  39          1HG2      THR  39   0.885 -13.872  -6.169
  312   2HG2  THR  39          3HG2      THR  39  -0.306 -15.138  -5.872
  313   3HG2  THR  39          2HG2      THR  39  -0.630 -13.485  -5.354
  314    H    LYS  40           H        LYS  40   1.245 -16.991  -5.021
  315    HA   LYS  40           HA       LYS  40   2.991 -18.108  -6.832
  316   1HB   LYS  40          2HB       LYS  40   0.047 -18.008  -7.462
  317   2HB   LYS  40          1HB       LYS  40   1.174 -19.340  -7.711
  318   1HG   LYS  40          2HG       LYS  40   1.433 -19.335  -5.138
  319   2HG   LYS  40          1HG       LYS  40  -0.027 -18.346  -5.129
  320   1HD   LYS  40          2HD       LYS  40   0.275 -21.131  -6.291
  321   2HD   LYS  40          1HD       LYS  40  -0.686 -20.670  -4.887
  322   1HE   LYS  40          2HE       LYS  40  -1.910 -19.064  -6.517
  323   2HE   LYS  40          1HE       LYS  40  -1.181 -20.038  -7.795
  324   1HZ   LYS  40          2HZ       LYS  40  -2.709 -21.239  -5.562
  325   2HZ   LYS  40          1HZ       LYS  40  -3.455 -20.739  -7.004
  326   3HZ   LYS  40          3HZ       LYS  40  -2.272 -21.955  -7.039
  327    H    GLY  41           H        GLY  41   0.743 -15.463  -7.378
  328   1HA   GLY  41          2HA       GLY  41   2.157 -14.020  -9.220
  329   2HA   GLY  41          1HA       GLY  41   1.381 -15.254 -10.213
  330    H    ALA  42           H        ALA  42   0.613 -12.847  -7.711
  331    HA   ALA  42           HA       ALA  42  -2.206 -12.710  -8.503
  332   1HB   ALA  42          1HB       ALA  42  -0.611 -11.872  -6.280
  333   2HB   ALA  42          3HB       ALA  42  -1.381 -10.442  -6.965
  334   3HB   ALA  42          2HB       ALA  42  -2.368 -11.807  -6.438
  335    H    TYR  43           H        TYR  43  -2.439  -9.844  -8.363
  336    HA   TYR  43           HA       TYR  43  -0.941  -9.129 -10.839
  337   1HB   TYR  43          2HB       TYR  43  -3.764  -9.207 -10.467
  338   2HB   TYR  43          1HB       TYR  43  -3.275  -7.519 -10.632
  339    HD1  TYR  43           HD1      TYR  43  -0.939  -7.601 -12.353
  340    HD2  TYR  43           HD2      TYR  43  -4.554  -9.932 -12.559
  341    HE1  TYR  43           HE1      TYR  43  -0.581  -7.967 -14.782
  342    HE2  TYR  43           HE2      TYR  43  -4.188 -10.296 -14.980
  343    HH   TYR  43           HH       TYR  43  -2.203 -10.308 -16.551
  344    H    SER  44           H        SER  44  -1.295  -6.476 -11.017
  345    HA   SER  44           HA       SER  44  -1.021  -5.207  -8.404
  346   1HB   SER  44          2HB       SER  44   1.354  -5.396 -10.230
  347   2HB   SER  44          1HB       SER  44   1.280  -4.612  -8.640
  348    HG   SER  44           HG       SER  44   1.517  -7.267  -9.295
  349    H    LEU  45           H        LEU  45  -0.506  -2.876  -8.616
  350    HA   LEU  45           HA       LEU  45  -0.971  -1.783 -11.341
  351   1HB   LEU  45          2HB       LEU  45  -3.195  -1.948 -10.228
  352   2HB   LEU  45          1HB       LEU  45  -2.592  -0.904  -8.945
  353    HG   LEU  45           HG       LEU  45  -2.317  -0.026 -11.793
  354   1HD1  LEU  45          3HD1      LEU  45  -4.741  -0.825 -11.102
  355   2HD1  LEU  45          2HD1      LEU  45  -4.761   0.708 -10.228
  356   3HD1  LEU  45          1HD1      LEU  45  -4.518   0.691 -11.976
  357   1HD2  LEU  45          3HD2      LEU  45  -2.442   1.217  -9.071
  358   2HD2  LEU  45          2HD2      LEU  45  -1.279   1.484 -10.368
  359   3HD2  LEU  45          1HD2      LEU  45  -2.895   2.180 -10.478
  360    H    SER  46           H        SER  46   1.247  -1.106 -11.179
  361    HA   SER  46           HA       SER  46   2.220   0.514  -9.021
  362   1HB   SER  46          2HB       SER  46   3.840  -0.518 -10.449
  363   2HB   SER  46          1HB       SER  46   3.145   0.241 -11.877
  364    HG   SER  46           HG       SER  46   3.805   2.227 -11.117
  365    H    ILE  47           H        ILE  47   2.877   2.782  -9.323
  366    HA   ILE  47           HA       ILE  47   1.337   4.399 -11.227
  367    HB   ILE  47           HB       ILE  47  -0.028   5.567  -9.698
  368   1HG1  ILE  47          2HG1      ILE  47   1.577   4.259  -7.476
  369   2HG1  ILE  47          1HG1      ILE  47   1.671   5.952  -7.962
  370   1HG2  ILE  47          1HG2      ILE  47  -0.843   3.282 -10.130
  371   2HG2  ILE  47          3HG2      ILE  47   0.062   2.691  -8.737
  372   3HG2  ILE  47          2HG2      ILE  47  -1.283   3.808  -8.505
  373   1HD1  ILE  47          3HD1      ILE  47  -0.948   4.711  -7.132
  374   2HD1  ILE  47          2HD1      ILE  47   0.167   5.379  -5.940
  375   3HD1  ILE  47          1HD1      ILE  47  -0.512   6.420  -7.193
  376    H    ARG  48           H        ARG  48   2.695   5.999 -11.849
  377    HA   ARG  48           HA       ARG  48   5.165   6.513 -10.433
  378   1HB   ARG  48          2HB       ARG  48   4.137   7.087 -12.985
  379   2HB   ARG  48          1HB       ARG  48   4.408   8.661 -12.235
  380   1HG   ARG  48          2HG       ARG  48   6.586   6.780 -11.709
  381   2HG   ARG  48          1HG       ARG  48   6.355   7.077 -13.432
  382   1HD   ARG  48          2HD       ARG  48   6.169   9.606 -12.580
  383   2HD   ARG  48          1HD       ARG  48   7.159   8.970 -11.266
  384    HE   ARG  48           HE       ARG  48   8.516   8.049 -13.429
  385   1HH1  ARG  48          2HH1      ARG  48   7.539  11.094 -12.210
  386   2HH1  ARG  48          1HH1      ARG  48   8.494  12.011 -13.327
  387   1HH2  ARG  48          1HH2      ARG  48   9.580   9.229 -15.090
  388   2HH2  ARG  48          2HH2      ARG  48   9.650  10.955 -14.958
  389    H    ASP  49           H        ASP  49   5.686   8.243  -9.054
  390    HA   ASP  49           HA       ASP  49   3.580  10.268  -8.542
  391   1HB   ASP  49          2HB       ASP  49   3.516   8.131  -6.965
  392   2HB   ASP  49          1HB       ASP  49   4.829   8.981  -6.149
  393    H    TRP  50           H        TRP  50   5.859  10.948  -9.832
  394    HA   TRP  50           HA       TRP  50   8.112  11.623  -8.192
  395   1HB   TRP  50          2HB       TRP  50   8.482  11.766 -10.532
  396   2HB   TRP  50          1HB       TRP  50   7.014  12.702 -10.794
  397    HD1  TRP  50           HD1      TRP  50  10.667  13.089  -9.989
  398    HE1  TRP  50           HE1      TRP  50  11.230  15.590  -9.717
  399    HE3  TRP  50           HE3      TRP  50   5.987  14.999 -10.004
  400    HZ2  TRP  50           HZ2      TRP  50   9.842  18.098  -9.584
  401    HZ3  TRP  50           HZ3      TRP  50   5.604  17.443  -9.814
  402    HH2  TRP  50           HH2      TRP  50   7.527  18.996  -9.608
  403    H    ASP  51           H        ASP  51   8.665  14.000  -7.665
  404    HA   ASP  51           HA       ASP  51   6.313  15.681  -7.060
  405   1HB   ASP  51          2HB       ASP  51   7.457  13.963  -5.101
  406   2HB   ASP  51          1HB       ASP  51   7.932  15.611  -4.689
  407    H    ASP  52           H        ASP  52   6.944  17.883  -6.493
  408    HA   ASP  52           HA       ASP  52   9.478  18.657  -7.762
  409   1HB   ASP  52          2HB       ASP  52   8.657  20.894  -7.652
  410   2HB   ASP  52          1HB       ASP  52   7.253  19.894  -8.019
  411    H    MET  53           H        MET  53   9.637  17.191  -5.186
  412    HA   MET  53           HA       MET  53  11.505  18.971  -3.897
  413   1HB   MET  53          2HB       MET  53  10.271  18.636  -1.621
  414   2HB   MET  53          1HB       MET  53   9.716  19.906  -2.709
  415   1HG   MET  53          2HG       MET  53   7.676  18.952  -2.692
  416   2HG   MET  53          1HG       MET  53   8.369  17.553  -3.512
  417   1HE   MET  53          1HE       MET  53   9.311  15.836  -2.776
  418   2HE   MET  53          3HE       MET  53   9.614  15.267  -1.129
  419   3HE   MET  53          2HE       MET  53   8.078  14.916  -1.917
  420    H    LYS  54           H        LYS  54  11.763  16.412  -5.107
  421    HA   LYS  54           HA       LYS  54  13.245  15.036  -3.148
  422   1HB   LYS  54          2HB       LYS  54  11.832  13.099  -2.671
  423   2HB   LYS  54          1HB       LYS  54  11.008  14.573  -2.163
  424   1HG   LYS  54          2HG       LYS  54   9.298  14.157  -3.570
  425   2HG   LYS  54          1HG       LYS  54  10.405  14.011  -4.934
  426   1HD   LYS  54          2HD       LYS  54  10.239  11.762  -4.914
  427   2HD   LYS  54          1HD       LYS  54  10.597  11.699  -3.188
  428   1HE   LYS  54          2HE       LYS  54   7.930  12.763  -3.702
  429   2HE   LYS  54          1HE       LYS  54   8.132  11.146  -4.379
  430   1HZ   LYS  54          1HZ       LYS  54   9.168  10.600  -2.120
  431   2HZ   LYS  54          3HZ       LYS  54   8.423  12.023  -1.576
  432   3HZ   LYS  54          2HZ       LYS  54   7.478  10.759  -2.205
  433    H    GLY  55           H        GLY  55  11.469  14.901  -6.185
  434   1HA   GLY  55          2HA       GLY  55  12.870  14.249  -8.141
  435   2HA   GLY  55          1HA       GLY  55  13.473  12.946  -7.127
  436    H    ASP  56           H        ASP  56  12.604  11.685  -9.089
  437    HA   ASP  56           HA       ASP  56   9.680  11.456  -9.189
  438   1HB   ASP  56          2HB       ASP  56  11.483   9.485 -10.542
  439   2HB   ASP  56          1HB       ASP  56  10.006  10.240 -11.127
  440    H    HIS  57           H        HIS  57   8.757   9.158  -9.051
  441    HA   HIS  57           HA       HIS  57  10.146   7.170  -7.492
  442   1HB   HIS  57          2HB       HIS  57   8.384   9.148  -6.103
  443   2HB   HIS  57          1HB       HIS  57   8.295   7.463  -5.595
  444    HD1  HIS  57           HD1      HIS  57   9.557   9.767  -3.824
  445    HD2  HIS  57           HD2      HIS  57  11.710   7.103  -6.201
  446    HE1  HIS  57           HE1      HIS  57  11.900   9.687  -2.868
  447    H    VAL  58           H        VAL  58   8.203   5.639  -6.549
  448    HA   VAL  58           HA       VAL  58   5.830   5.664  -8.248
  449    HB   VAL  58           HB       VAL  58   7.610   4.775  -9.768
  450   1HG1  VAL  58          3HG1      VAL  58   8.009   3.040  -7.410
  451   2HG1  VAL  58          2HG1      VAL  58   8.062   2.225  -8.975
  452   3HG1  VAL  58          1HG1      VAL  58   9.162   3.567  -8.636
  453   1HG2  VAL  58          1HG2      VAL  58   5.407   2.899  -8.883
  454   2HG2  VAL  58          3HG2      VAL  58   5.382   4.028 -10.238
  455   3HG2  VAL  58          2HG2      VAL  58   6.414   2.596 -10.302
  456    H    LYS  59           H        LYS  59   4.287   4.148  -7.533
  457    HA   LYS  59           HA       LYS  59   5.006   2.561  -5.113
  458   1HB   LYS  59          2HB       LYS  59   2.405   4.080  -5.488
  459   2HB   LYS  59          1HB       LYS  59   2.935   3.215  -4.044
  460   1HG   LYS  59          2HG       LYS  59   4.611   4.815  -3.563
  461   2HG   LYS  59          1HG       LYS  59   4.559   5.486  -5.194
  462   1HD   LYS  59          2HD       LYS  59   2.734   6.789  -4.739
  463   2HD   LYS  59          1HD       LYS  59   2.007   5.577  -3.685
  464   1HE   LYS  59          2HE       LYS  59   2.652   6.942  -1.989
  465   2HE   LYS  59          1HE       LYS  59   4.266   6.291  -2.277
  466   1HZ   LYS  59          2HZ       LYS  59   3.367   8.518  -3.948
  467   2HZ   LYS  59          1HZ       LYS  59   3.789   8.861  -2.339
  468   3HZ   LYS  59          3HZ       LYS  59   4.924   8.148  -3.379
  469    H    HIS  60           H        HIS  60   2.711   1.144  -4.746
  470    HA   HIS  60           HA       HIS  60   1.684   0.302  -7.359
  471   1HB   HIS  60          2HB       HIS  60   2.916  -1.893  -5.763
  472   2HB   HIS  60          1HB       HIS  60   2.630  -1.800  -7.496
  473    HD1  HIS  60           HD1      HIS  60   4.604  -1.201  -8.898
  474    HD2  HIS  60           HD2      HIS  60   5.132  -0.032  -4.933
  475    HE1  HIS  60           HE1      HIS  60   6.960  -0.289  -8.731
  476    H    TYR  61           H        TYR  61  -0.171  -0.862  -7.258
  477    HA   TYR  61           HA       TYR  61  -1.323  -1.247  -4.521
  478   1HB   TYR  61          2HB       TYR  61  -2.592  -0.563  -7.179
  479   2HB   TYR  61          1HB       TYR  61  -3.553  -1.290  -5.896
  480    HD1  TYR  61           HD1      TYR  61  -2.966  -0.137  -3.462
  481    HD2  TYR  61           HD2      TYR  61  -2.682   1.739  -7.315
  482    HE1  TYR  61           HE1      TYR  61  -3.181   2.091  -2.394
  483    HE2  TYR  61           HE2      TYR  61  -2.895   3.965  -6.250
  484    HH   TYR  61           HH       TYR  61  -2.359   4.899  -3.820
  485    H    LYS  62           H        LYS  62  -0.627  -3.340  -4.162
  486    HA   LYS  62           HA       LYS  62  -0.408  -5.411  -6.035
  487   1HB   LYS  62          2HB       LYS  62   0.533  -5.908  -3.963
  488   2HB   LYS  62          1HB       LYS  62  -0.860  -5.313  -3.066
  489   1HG   LYS  62          2HG       LYS  62  -0.788  -7.731  -2.896
  490   2HG   LYS  62          1HG       LYS  62  -2.165  -7.280  -3.903
  491   1HD   LYS  62          2HD       LYS  62  -1.032  -9.091  -5.017
  492   2HD   LYS  62          1HD       LYS  62  -0.667  -7.620  -5.919
  493   1HE   LYS  62          2HE       LYS  62   1.259  -9.325  -5.185
  494   2HE   LYS  62          1HE       LYS  62   1.540  -7.584  -5.235
  495   1HZ   LYS  62          3HZ       LYS  62   0.590  -8.994  -2.808
  496   2HZ   LYS  62          2HZ       LYS  62   2.236  -8.740  -3.140
  497   3HZ   LYS  62          1HZ       LYS  62   1.197  -7.414  -2.923
  498    H    ILE  63           H        ILE  63  -1.974  -6.058  -7.396
  499    HA   ILE  63           HA       ILE  63  -4.798  -5.787  -6.674
  500    HB   ILE  63           HB       ILE  63  -3.250  -6.480  -9.128
  501   1HG1  ILE  63          2HG1      ILE  63  -5.237  -4.932  -9.955
  502   2HG1  ILE  63          1HG1      ILE  63  -5.364  -4.560  -8.235
  503   1HG2  ILE  63          3HG2      ILE  63  -4.897  -8.333  -8.962
  504   2HG2  ILE  63          2HG2      ILE  63  -6.193  -7.151  -8.788
  505   3HG2  ILE  63          1HG2      ILE  63  -5.280  -7.243 -10.295
  506   1HD1  ILE  63          3HD1      ILE  63  -2.673  -4.383  -8.587
  507   2HD1  ILE  63          2HD1      ILE  63  -3.241  -3.855 -10.171
  508   3HD1  ILE  63          1HD1      ILE  63  -3.765  -3.006  -8.718
  509    H    ARG  64           H        ARG  64  -6.086  -7.351  -5.942
  510    HA   ARG  64           HA       ARG  64  -5.084 -10.165  -5.954
  511   1HB   ARG  64          2HB       ARG  64  -6.744  -8.712  -3.868
  512   2HB   ARG  64          1HB       ARG  64  -6.454 -10.450  -3.857
  513   1HG   ARG  64          2HG       ARG  64  -4.456  -8.211  -3.501
  514   2HG   ARG  64          1HG       ARG  64  -4.796  -9.553  -2.410
  515   1HD   ARG  64          2HD       ARG  64  -4.007 -11.069  -4.358
  516   2HD   ARG  64          1HD       ARG  64  -3.312  -9.596  -5.036
  517    HE   ARG  64           HE       ARG  64  -1.715  -9.576  -3.261
  518   1HH1  ARG  64          2HH1      ARG  64  -4.377 -11.563  -2.436
  519   2HH1  ARG  64          1HH1      ARG  64  -3.478 -12.564  -1.346
  520   1HH2  ARG  64          1HH2      ARG  64  -0.440 -11.040  -2.033
  521   2HH2  ARG  64          2HH2      ARG  64  -1.249 -12.268  -1.118
  522    H    LYS  65           H        LYS  65  -6.403 -11.443  -7.205
  523    HA   LYS  65           HA       LYS  65  -9.117 -10.376  -7.806
  524   1HB   LYS  65          2HB       LYS  65  -7.724 -10.642  -9.789
  525   2HB   LYS  65          1HB       LYS  65  -7.365 -12.311  -9.349
  526   1HG   LYS  65          2HG       LYS  65 -10.049 -12.454  -9.329
  527   2HG   LYS  65          1HG       LYS  65  -9.860 -11.145 -10.493
  528   1HD   LYS  65          2HD       LYS  65  -8.096 -12.690 -11.614
  529   2HD   LYS  65          1HD       LYS  65  -8.836 -13.976 -10.660
  530   1HE   LYS  65          2HE       LYS  65 -10.844 -12.316 -11.967
  531   2HE   LYS  65          1HE       LYS  65  -9.731 -13.028 -13.135
  532   1HZ   LYS  65          1HZ       LYS  65 -10.975 -14.625 -10.978
  533   2HZ   LYS  65          3HZ       LYS  65 -11.736 -14.399 -12.477
  534   3HZ   LYS  65          2HZ       LYS  65 -10.226 -15.176 -12.401
  535    H    LEU  66           H        LEU  66 -10.893 -11.648  -7.500
  536    HA   LEU  66           HA       LEU  66 -10.671 -13.780  -5.581
  537   1HB   LEU  66          2HB       LEU  66 -12.915 -12.570  -7.150
  538   2HB   LEU  66          1HB       LEU  66 -13.178 -14.113  -6.348
  539    HG   LEU  66           HG       LEU  66 -12.855 -13.197  -4.216
  540   1HD1  LEU  66          2HD1      LEU  66 -11.463 -10.929  -5.656
  541   2HD1  LEU  66          1HD1      LEU  66 -11.846 -10.894  -3.932
  542   3HD1  LEU  66          3HD1      LEU  66 -10.734 -12.109  -4.563
  543   1HD2  LEU  66          1HD2      LEU  66 -14.525 -11.746  -6.038
  544   2HD2  LEU  66          3HD2      LEU  66 -14.747 -11.979  -4.301
  545   3HD2  LEU  66          2HD2      LEU  66 -13.810 -10.606  -4.895
  546    H    ASP  67           H        ASP  67 -11.059 -16.024  -5.913
  547    HA   ASP  67           HA       ASP  67 -10.144 -17.034  -8.475
  548   1HB   ASP  67          2HB       ASP  67 -10.768 -18.106  -5.834
  549   2HB   ASP  67          1HB       ASP  67 -11.375 -19.148  -7.117
  550    H    ASN  68           H        ASN  68 -13.113 -16.072  -7.109
  551    HA   ASN  68           HA       ASN  68 -14.742 -17.619  -9.044
  552   1HB   ASN  68          2HB       ASN  68 -15.606 -15.523  -7.026
  553   2HB   ASN  68          1HB       ASN  68 -16.656 -16.646  -7.892
  554   1HD2  ASN  68          2HD2      ASN  68 -14.968 -17.836  -4.457
  555   2HD2  ASN  68          1HD2      ASN  68 -14.986 -16.220  -4.975
  556    H    GLY  69           H        GLY  69 -12.946 -14.811  -9.014
  557   1HA   GLY  69          2HA       GLY  69 -12.812 -13.468 -11.051
  558   2HA   GLY  69          1HA       GLY  69 -14.543 -13.704 -11.248
  559    H    GLY  70           H        GLY  70 -12.153 -12.157  -9.125
  560   1HA   GLY  70          2HA       GLY  70 -14.014  -9.933  -8.735
  561   2HA   GLY  70          1HA       GLY  70 -13.442 -10.751  -7.295
  562    H    TYR  71           H        TYR  71 -12.290  -8.998 -10.186
  563    HA   TYR  71           HA       TYR  71  -9.595  -8.733  -9.132
  564   1HB   TYR  71          2HB       TYR  71 -11.116  -7.564 -11.441
  565   2HB   TYR  71          1HB       TYR  71  -9.607  -6.799 -10.941
  566    HD1  TYR  71           HD1      TYR  71  -7.534  -8.313 -10.672
  567    HD2  TYR  71           HD2      TYR  71 -11.090  -9.499 -12.768
  568    HE1  TYR  71           HE1      TYR  71  -6.255 -10.086 -11.847
  569    HE2  TYR  71           HE2      TYR  71  -9.813 -11.265 -13.948
  570    HH   TYR  71           HH       TYR  71  -7.760 -12.072 -14.376
  571    H    TYR  72           H        TYR  72  -9.037  -7.363  -7.496
  572    HA   TYR  72           HA       TYR  72 -10.366  -4.715  -7.305
  573   1HB   TYR  72          2HB       TYR  72 -11.046  -5.003  -4.997
  574   2HB   TYR  72          1HB       TYR  72 -11.760  -6.292  -5.951
  575    HD1  TYR  72           HD1      TYR  72  -9.182  -5.469  -3.450
  576    HD2  TYR  72           HD2      TYR  72 -11.019  -8.602  -5.734
  577    HE1  TYR  72           HE1      TYR  72  -8.074  -7.146  -2.028
  578    HE2  TYR  72           HE2      TYR  72  -9.902 -10.282  -4.325
  579    HH   TYR  72           HH       TYR  72  -8.514  -9.578  -1.369
  580    H    ILE  73           H        ILE  73  -8.816  -3.197  -6.697
  581    HA   ILE  73           HA       ILE  73  -6.177  -4.151  -5.799
  582    HB   ILE  73           HB       ILE  73  -7.351  -1.480  -6.532
  583   1HG1  ILE  73          2HG1      ILE  73  -4.698  -2.808  -7.118
  584   2HG1  ILE  73          1HG1      ILE  73  -6.116  -2.873  -8.165
  585   1HG2  ILE  73          2HG2      ILE  73  -4.932  -1.845  -4.759
  586   2HG2  ILE  73          1HG2      ILE  73  -5.302  -0.356  -5.630
  587   3HG2  ILE  73          3HG2      ILE  73  -6.399  -0.944  -4.379
  588   1HD1  ILE  73          2HD1      ILE  73  -6.089  -0.403  -8.338
  589   2HD1  ILE  73          1HD1      ILE  73  -4.648  -0.355  -7.324
  590   3HD1  ILE  73          3HD1      ILE  73  -4.580  -1.106  -8.917
  591    H    THR  74           H        THR  74  -9.126  -2.833  -4.580
  592    HA   THR  74           HA       THR  74  -8.166  -3.251  -1.797
  593    HB   THR  74           HB       THR  74  -8.474  -1.035  -1.449
  594    HG1  THR  74           HG1      THR  74 -10.296  -1.404  -0.443
  595   1HG2  THR  74          2HG2      THR  74  -8.520  -0.771  -3.994
  596   2HG2  THR  74          1HG2      THR  74 -10.278  -0.768  -3.855
  597   3HG2  THR  74          3HG2      THR  74  -9.330   0.493  -3.068
  598    H    THR  75           H        THR  75  -9.658  -4.357  -0.534
  599    HA   THR  75           HA       THR  75 -11.525  -6.011  -1.932
  600    HB   THR  75           HB       THR  75 -12.148  -6.852   0.268
  601    HG1  THR  75           HG1      THR  75 -10.557  -4.761   1.320
  602   1HG2  THR  75          2HG2      THR  75  -9.515  -6.635  -0.800
  603   2HG2  THR  75          1HG2      THR  75  -9.390  -6.539   0.961
  604   3HG2  THR  75          3HG2      THR  75 -10.177  -7.927   0.209
  605    H    ARG  76           H        ARG  76 -11.884  -2.797  -1.116
  606    HA   ARG  76           HA       ARG  76 -14.686  -2.835  -0.365
  607   1HB   ARG  76          2HB       ARG  76 -13.062  -0.956   0.149
  608   2HB   ARG  76          1HB       ARG  76 -13.125  -0.530  -1.561
  609   1HG   ARG  76          2HG       ARG  76 -14.793   0.845  -0.669
  610   2HG   ARG  76          1HG       ARG  76 -15.726  -0.561  -1.185
  611   1HD   ARG  76          2HD       ARG  76 -14.966  -1.320   1.333
  612   2HD   ARG  76          1HD       ARG  76 -15.147   0.422   1.541
  613    HE   ARG  76           HE       ARG  76 -17.434  -0.439   0.149
  614   1HH1  ARG  76          2HH1      ARG  76 -16.151  -2.301   2.574
  615   2HH1  ARG  76          1HH1      ARG  76 -17.464  -2.105   3.687
  616   1HH2  ARG  76          1HH2      ARG  76 -19.015   0.379   1.830
  617   2HH2  ARG  76          2HH2      ARG  76 -19.085  -0.587   3.266
  618    H    ALA  77           H        ALA  77 -12.966  -3.185  -3.331
  619    HA   ALA  77           HA       ALA  77 -15.525  -3.265  -4.783
  620   1HB   ALA  77          2HB       ALA  77 -13.360  -1.265  -5.478
  621   2HB   ALA  77          1HB       ALA  77 -14.699  -1.681  -6.551
  622   3HB   ALA  77          3HB       ALA  77 -15.018  -0.909  -4.996
  623    H    GLN  78           H        GLN  78 -15.396  -5.053  -6.006
  624    HA   GLN  78           HA       GLN  78 -12.807  -5.767  -7.267
  625   1HB   GLN  78          2HB       GLN  78 -13.973  -8.167  -7.162
  626   2HB   GLN  78          1HB       GLN  78 -13.001  -7.576  -5.819
  627   1HG   GLN  78          2HG       GLN  78 -15.878  -6.819  -5.848
  628   2HG   GLN  78          1HG       GLN  78 -15.496  -8.496  -5.478
  629   1HE2  GLN  78          2HE2      GLN  78 -13.375  -6.138  -2.949
  630   2HE2  GLN  78          1HE2      GLN  78 -13.065  -6.144  -4.617
  631    H    PHE  79           H        PHE  79 -13.246  -7.254  -9.240
  632    HA   PHE  79           HA       PHE  79 -15.857  -6.651 -10.534
  633   1HB   PHE  79          2HB       PHE  79 -13.138  -5.871 -11.609
  634   2HB   PHE  79          1HB       PHE  79 -14.569  -5.990 -12.632
  635    HD1  PHE  79           HD1      PHE  79 -13.374  -4.425  -9.457
  636    HD2  PHE  79           HD2      PHE  79 -16.016  -4.158 -12.828
  637    HE1  PHE  79           HE1      PHE  79 -14.092  -2.182  -8.710
  638    HE2  PHE  79           HE2      PHE  79 -16.734  -1.901 -12.086
  639    HZ   PHE  79           HZ       PHE  79 -15.769  -0.909 -10.025
  640    H    GLU  80           H        GLU  80 -15.228  -7.640 -13.058
  641    HA   GLU  80           HA       GLU  80 -14.723 -10.484 -12.363
  642   1HB   GLU  80          2HB       GLU  80 -15.862 -11.003 -14.472
  643   2HB   GLU  80          1HB       GLU  80 -16.860  -9.923 -13.500
  644   1HG   GLU  80          2HG       GLU  80 -15.465  -8.083 -14.880
  645   2HG   GLU  80          1HG       GLU  80 -15.437  -9.397 -16.057
  646    H    THR  81           H        THR  81 -13.493  -7.806 -14.239
  647    HA   THR  81           HA       THR  81 -11.162  -9.507 -14.980
  648    HB   THR  81           HB       THR  81 -12.206  -9.588 -17.062
  649    HG1  THR  81           HG1      THR  81 -11.344  -7.049 -17.625
  650   1HG2  THR  81          2HG2      THR  81 -14.063  -8.019 -16.123
  651   2HG2  THR  81          1HG2      THR  81 -13.109  -6.741 -16.872
  652   3HG2  THR  81          3HG2      THR  81 -13.774  -8.041 -17.858
  653    H    LEU  82           H        LEU  82  -9.438  -7.952 -16.018
  654    HA   LEU  82           HA       LEU  82  -9.040  -5.791 -14.089
  655   1HB   LEU  82          2HB       LEU  82  -7.369  -6.877 -16.365
  656   2HB   LEU  82          1HB       LEU  82  -6.889  -5.455 -15.439
  657    HG   LEU  82           HG       LEU  82  -7.351  -8.260 -14.381
  658   1HD1  LEU  82          3HD1      LEU  82  -4.976  -6.508 -14.890
  659   2HD1  LEU  82          2HD1      LEU  82  -4.939  -7.591 -13.496
  660   3HD1  LEU  82          1HD1      LEU  82  -5.159  -8.248 -15.118
  661   1HD2  LEU  82          1HD2      LEU  82  -6.902  -5.641 -12.929
  662   2HD2  LEU  82          3HD2      LEU  82  -8.256  -6.757 -12.732
  663   3HD2  LEU  82          2HD2      LEU  82  -6.647  -7.216 -12.179
  664    H    GLN  83           H        GLN  83  -9.732  -6.179 -17.522
  665    HA   GLN  83           HA       GLN  83  -9.565  -3.408 -18.223
  666   1HB   GLN  83          2HB       GLN  83  -9.654  -5.238 -19.902
  667   2HB   GLN  83          1HB       GLN  83 -11.319  -5.572 -19.427
  668   1HG   GLN  83          2HG       GLN  83 -12.052  -3.408 -20.180
  669   2HG   GLN  83          1HG       GLN  83 -10.390  -2.862 -20.410
  670   1HE2  GLN  83          2HE2      GLN  83 -12.023  -4.185 -23.639
  671   2HE2  GLN  83          1HE2      GLN  83 -12.674  -3.198 -22.422
  672    H    GLN  84           H        GLN  84 -11.881  -5.295 -16.483
  673    HA   GLN  84           HA       GLN  84 -14.080  -3.400 -16.821
  674   1HB   GLN  84          2HB       GLN  84 -13.645  -5.957 -15.357
  675   2HB   GLN  84          1HB       GLN  84 -14.954  -4.906 -14.839
  676   1HG   GLN  84          2HG       GLN  84 -15.424  -6.721 -16.673
  677   2HG   GLN  84          1HG       GLN  84 -16.108  -5.119 -16.846
  678   1HE2  GLN  84          2HE2      GLN  84 -14.192  -6.403 -19.959
  679   2HE2  GLN  84          1HE2      GLN  84 -15.150  -7.283 -18.869
  680    H    LEU  85           H        LEU  85 -11.673  -4.154 -14.332
  681    HA   LEU  85           HA       LEU  85 -12.805  -2.239 -12.428
  682   1HB   LEU  85          2HB       LEU  85 -11.094  -2.865 -10.995
  683   2HB   LEU  85          1HB       LEU  85 -11.129  -4.282 -12.042
  684    HG   LEU  85           HG       LEU  85  -9.473  -2.532 -13.407
  685   1HD1  LEU  85          2HD1      LEU  85  -9.453  -1.901 -10.541
  686   2HD1  LEU  85          1HD1      LEU  85  -7.857  -2.302 -11.180
  687   3HD1  LEU  85          3HD1      LEU  85  -8.790  -0.990 -11.900
  688   1HD2  LEU  85          1HD2      LEU  85  -9.400  -5.082 -12.333
  689   2HD2  LEU  85          3HD2      LEU  85  -8.161  -4.336 -13.342
  690   3HD2  LEU  85          2HD2      LEU  85  -8.024  -4.269 -11.583
  691    H    VAL  86           H        VAL  86 -10.605  -2.105 -15.089
  692    HA   VAL  86           HA       VAL  86  -9.618   0.551 -14.392
  693    HB   VAL  86           HB       VAL  86  -8.596   0.493 -16.665
  694   1HG1  VAL  86          1HG1      VAL  86  -8.258  -1.777 -14.736
  695   2HG1  VAL  86          3HG1      VAL  86  -7.380  -1.828 -16.265
  696   3HG1  VAL  86          2HG1      VAL  86  -7.130  -0.486 -15.149
  697   1HG2  VAL  86          3HG2      VAL  86 -10.475  -0.758 -17.723
  698   2HG2  VAL  86          2HG2      VAL  86  -8.897  -1.466 -18.078
  699   3HG2  VAL  86          1HG2      VAL  86  -9.943  -2.203 -16.868
  700    H    GLN  87           H        GLN  87 -12.151  -0.989 -16.124
  701    HA   GLN  87           HA       GLN  87 -13.054   1.197 -17.726
  702   1HB   GLN  87          2HB       GLN  87 -13.743  -1.203 -17.982
  703   2HB   GLN  87          1HB       GLN  87 -14.689  -1.037 -16.512
  704   1HG   GLN  87          2HG       GLN  87 -16.149   0.541 -17.483
  705   2HG   GLN  87          1HG       GLN  87 -15.057   0.851 -18.833
  706   1HE2  GLN  87          2HE2      GLN  87 -16.523  -2.944 -19.082
  707   2HE2  GLN  87          1HE2      GLN  87 -15.595  -2.458 -17.746
  708    H    HIS  88           H        HIS  88 -13.906   0.013 -14.517
  709    HA   HIS  88           HA       HIS  88 -15.806   2.168 -14.048
  710   1HB   HIS  88          2HB       HIS  88 -15.752  -0.285 -13.100
  711   2HB   HIS  88          1HB       HIS  88 -14.696   0.427 -11.888
  712    HD1  HIS  88           HD1      HIS  88 -18.003   1.460 -13.517
  713    HD2  HIS  88           HD2      HIS  88 -16.204   1.312  -9.758
  714    HE1  HIS  88           HE1      HIS  88 -19.710   2.348 -11.870
  715    H    TYR  89           H        TYR  89 -12.547   1.315 -13.186
  716    HA   TYR  89           HA       TYR  89 -12.179   3.477 -11.287
  717   1HB   TYR  89          2HB       TYR  89 -10.290   1.600 -12.700
  718   2HB   TYR  89          1HB       TYR  89  -9.754   2.792 -11.525
  719    HD1  TYR  89           HD1      TYR  89 -12.977   0.973 -11.243
  720    HD2  TYR  89           HD2      TYR  89  -8.902   1.220  -9.918
  721    HE1  TYR  89           HE1      TYR  89 -13.487  -0.576  -9.415
  722    HE2  TYR  89           HE2      TYR  89  -9.415  -0.359  -8.077
  723    HH   TYR  89           HH       TYR  89 -11.241  -2.238  -7.724
  724    H    SER  90           H        SER  90 -12.181   3.244 -14.684
  725    HA   SER  90           HA       SER  90 -10.255   5.313 -15.242
  726   1HB   SER  90          2HB       SER  90 -12.090   3.619 -16.763
  727   2HB   SER  90          1HB       SER  90 -12.013   5.264 -17.387
  728    HG   SER  90           HG       SER  90  -9.699   5.028 -17.337
  729    H    GLU  91           H        GLU  91 -13.672   5.135 -14.584
  730    HA   GLU  91           HA       GLU  91 -14.026   8.028 -15.130
  731   1HB   GLU  91          2HB       GLU  91 -16.009   5.920 -14.209
  732   2HB   GLU  91          1HB       GLU  91 -16.411   7.584 -14.633
  733   1HG   GLU  91          2HG       GLU  91 -14.959   6.718 -16.828
  734   2HG   GLU  91          1HG       GLU  91 -15.888   5.288 -16.381
  735    H    ARG  92           H        ARG  92 -13.394   5.829 -12.565
  736    HA   ARG  92           HA       ARG  92 -13.578   8.099 -10.640
  737   1HB   ARG  92          2HB       ARG  92 -14.409   5.420  -9.636
  738   2HB   ARG  92          1HB       ARG  92 -14.956   7.021  -9.143
  739   1HG   ARG  92          2HG       ARG  92 -16.209   7.222 -11.284
  740   2HG   ARG  92          1HG       ARG  92 -15.712   5.583 -11.706
  741   1HD   ARG  92          2HD       ARG  92 -17.907   5.409 -10.746
  742   2HD   ARG  92          1HD       ARG  92 -16.776   4.824  -9.526
  743    HE   ARG  92           HE       ARG  92 -17.196   7.623  -9.129
  744   1HH1  ARG  92          2HH1      ARG  92 -19.933   6.186  -9.722
  745   2HH1  ARG  92          1HH1      ARG  92 -20.489   5.959  -8.098
  746   1HH2  ARG  92          1HH2      ARG  92 -17.406   6.639  -6.664
  747   2HH2  ARG  92          2HH2      ARG  92 -19.060   6.215  -6.367
  748    H    ALA  93           H        ALA  93 -12.035   7.953  -8.946
  749    HA   ALA  93           HA       ALA  93  -9.600   6.611  -9.547
  750   1HB   ALA  93          1HB       ALA  93 -10.635   7.644  -6.885
  751   2HB   ALA  93          3HB       ALA  93  -8.968   7.150  -7.187
  752   3HB   ALA  93          2HB       ALA  93  -9.646   8.538  -8.041
  753    H    ALA  94           H        ALA  94 -12.459   5.584  -7.830
  754    HA   ALA  94           HA       ALA  94 -13.089   3.373  -7.297
  755   1HB   ALA  94          3HB       ALA  94 -10.875   2.935  -8.922
  756   2HB   ALA  94          2HB       ALA  94 -10.448   2.128  -7.413
  757   3HB   ALA  94          1HB       ALA  94 -11.933   1.691  -8.258
  758    H    GLY  95           H        GLY  95 -10.708   5.296  -5.880
  759   1HA   GLY  95          2HA       GLY  95 -10.878   5.450  -3.396
  760   2HA   GLY  95          1HA       GLY  95 -10.924   3.692  -3.376
  761    H    LEU  96           H        LEU  96  -8.748   4.077  -5.699
  762    HA   LEU  96           HA       LEU  96  -6.510   3.883  -3.786
  763   1HB   LEU  96          2HB       LEU  96  -5.226   3.208  -5.816
  764   2HB   LEU  96          1HB       LEU  96  -6.656   2.212  -5.555
  765    HG   LEU  96           HG       LEU  96  -7.241   4.596  -7.146
  766   1HD1  LEU  96          2HD1      LEU  96  -5.092   2.670  -8.009
  767   2HD1  LEU  96          1HD1      LEU  96  -6.095   3.517  -9.187
  768   3HD1  LEU  96          3HD1      LEU  96  -5.080   4.432  -8.074
  769   1HD2  LEU  96          3HD2      LEU  96  -7.509   1.615  -7.641
  770   2HD2  LEU  96          2HD2      LEU  96  -8.732   2.649  -6.903
  771   3HD2  LEU  96          1HD2      LEU  96  -8.280   2.886  -8.590
  772    H    SER  97           H        SER  97  -4.449   4.842  -5.476
  773    HA   SER  97           HA       SER  97  -4.338   7.571  -4.804
  774   1HB   SER  97          2HB       SER  97  -2.864   5.789  -6.669
  775   2HB   SER  97          1HB       SER  97  -2.726   7.520  -6.978
  776    HG   SER  97           HG       SER  97  -1.926   7.822  -4.950
  777    H    SER  98           H        SER  98  -5.925   5.997  -7.492
  778    HA   SER  98           HA       SER  98  -7.647   8.042  -8.173
  779   1HB   SER  98          2HB       SER  98  -4.901   8.624  -9.076
  780   2HB   SER  98          1HB       SER  98  -6.124   8.760 -10.340
  781    HG   SER  98           HG       SER  98  -6.905  10.458  -9.397
  782    H    ARG  99           H        ARG  99  -7.993   8.012 -10.805
  783    HA   ARG  99           HA       ARG  99  -8.927   5.436 -11.445
  784   1HB   ARG  99          2HB       ARG  99  -8.021   7.566 -13.406
  785   2HB   ARG  99          1HB       ARG  99  -9.138   6.244 -13.744
  786   1HG   ARG  99          2HG       ARG  99 -10.860   7.206 -12.534
  787   2HG   ARG  99          1HG       ARG  99  -9.762   8.061 -11.451
  788   1HD   ARG  99          2HD       ARG  99  -9.372   8.979 -14.161
  789   2HD   ARG  99          1HD       ARG  99 -11.077   9.104 -13.728
  790    HE   ARG  99           HE       ARG  99  -9.883  10.201 -11.539
  791   1HH1  ARG  99          2HH1      ARG  99  -7.474  10.712 -13.287
  792   2HH1  ARG  99          1HH1      ARG  99  -7.806  12.303 -13.886
  793   1HH2  ARG  99          1HH2      ARG  99 -11.161  12.219 -13.016
  794   2HH2  ARG  99          2HH2      ARG  99  -9.893  13.156 -13.732
  795    H    LEU 100           H        LEU 100  -7.961   4.607 -13.856
  796    HA   LEU 100           HA       LEU 100  -5.509   3.276 -13.094
  797   1HB   LEU 100          2HB       LEU 100  -6.355   3.372 -15.965
  798   2HB   LEU 100          1HB       LEU 100  -5.703   2.027 -15.039
  799    HG   LEU 100           HG       LEU 100  -7.890   1.343 -15.194
  800   1HD1  LEU 100          3HD1      LEU 100  -7.250   2.382 -12.707
  801   2HD1  LEU 100          2HD1      LEU 100  -8.843   3.054 -13.052
  802   3HD1  LEU 100          1HD1      LEU 100  -8.598   1.304 -13.067
  803   1HD2  LEU 100          1HD2      LEU 100  -8.302   4.117 -15.867
  804   2HD2  LEU 100          3HD2      LEU 100  -9.265   2.711 -16.315
  805   3HD2  LEU 100          2HD2      LEU 100  -9.580   3.548 -14.796
  806    H    VAL 101           H        VAL 101  -4.209   3.358 -15.698
  807    HA   VAL 101           HA       VAL 101  -2.351   5.459 -15.261
  808    HB   VAL 101           HB       VAL 101  -2.107   3.309 -16.673
  809   1HG1  VAL 101          3HG1      VAL 101  -4.130   4.490 -18.148
  810   2HG1  VAL 101          2HG1      VAL 101  -2.691   4.834 -19.109
  811   3HG1  VAL 101          1HG1      VAL 101  -3.102   3.167 -18.702
  812   1HG2  VAL 101          3HG2      VAL 101  -0.725   5.717 -16.650
  813   2HG2  VAL 101          2HG2      VAL 101  -0.161   4.207 -17.372
  814   3HG2  VAL 101          1HG2      VAL 101  -0.984   5.407 -18.368
  815    H    VAL 102           H        VAL 102  -2.130   7.508 -16.217
  816    HA   VAL 102           HA       VAL 102  -4.479   8.976 -16.801
  817    HB   VAL 102           HB       VAL 102  -2.446  10.124 -16.149
  818   1HG1  VAL 102          3HG1      VAL 102  -1.141   8.287 -17.671
  819   2HG1  VAL 102          2HG1      VAL 102  -1.075   9.687 -18.741
  820   3HG1  VAL 102          1HG1      VAL 102  -0.401   9.788 -17.115
  821   1HG2  VAL 102          3HG2      VAL 102  -3.403  10.696 -18.956
  822   2HG2  VAL 102          2HG2      VAL 102  -3.810  11.548 -17.466
  823   3HG2  VAL 102          1HG2      VAL 102  -2.199  11.714 -18.165
  824    HA   PRO 103           HA       PRO 103  -5.266   7.731 -20.958
  825   1HB   PRO 103          2HB       PRO 103  -7.008   9.762 -21.602
  826   2HB   PRO 103          1HB       PRO 103  -7.449   8.368 -20.604
  827   1HG   PRO 103          2HG       PRO 103  -6.901  11.187 -19.775
  828   2HG   PRO 103          1HG       PRO 103  -7.932   9.974 -19.001
  829   1HD   PRO 103          2HD       PRO 103  -5.331  10.712 -18.169
  830   2HD   PRO 103          1HD       PRO 103  -6.222   9.273 -17.634
  831    H    SER 104           H        SER 104  -4.550  11.178 -20.347
  832    HA   SER 104           HA       SER 104  -3.286  11.315 -23.049
  833   1HB   SER 104          2HB       SER 104  -5.073  13.043 -21.873
  834   2HB   SER 104          1HB       SER 104  -3.529  13.811 -21.501
  835    HG   SER 104           HG       SER 104  -3.980  12.832 -24.083
  836    H    HIS 105           H        HIS 105  -1.773   9.921 -21.274
  837    HA   HIS 105           HA       HIS 105  -0.079  11.171 -19.478
  838   1HB   HIS 105          2HB       HIS 105   1.575   9.496 -19.990
  839   2HB   HIS 105          1HB       HIS 105  -0.006   8.741 -20.199
  840    HD1  HIS 105           HD1      HIS 105   3.124   9.322 -21.941
  841    HD2  HIS 105           HD2      HIS 105  -0.850   8.803 -23.086
  842    HE1  HIS 105           HE1      HIS 105   3.159   8.741 -24.406
  843    H    LYS 106           HN       LYS 106  -0.019  11.425 -23.001
  844    HA   LYS 106           HA       LYS 106   1.134  12.919 -24.395
  845   1HB   LYS 106          2HB       LYS 106   0.213  14.687 -23.039
  846   2HB   LYS 106          1HB       LYS 106   1.373  14.375 -21.748
  847   1HG   LYS 106          2HG       LYS 106   3.098  15.416 -22.861
  848   2HG   LYS 106          1HG       LYS 106   2.483  14.964 -24.451
  849   1HD   LYS 106          2HD       LYS 106   1.261  16.867 -24.640
  850   2HD   LYS 106          1HD       LYS 106   0.701  16.775 -22.970
  851   1HE   LYS 106          2HE       LYS 106   2.320  18.182 -22.242
  852   2HE   LYS 106          1HE       LYS 106   3.565  17.370 -23.191
  853   1HZ   LYS 106          3HZ       LYS 106   1.778  18.722 -24.904
  854   2HZ   LYS 106          2HZ       LYS 106   2.352  19.803 -23.727
  855   3HZ   LYS 106          1HZ       LYS 106   3.446  18.954 -24.712
  856   1H    GLU 201          3HT       GLU 201  -4.548  -8.936   3.625
  857   2H    GLU 201          2HT       GLU 201  -4.157 -10.223   2.586
  858   3H    GLU 201          1HT       GLU 201  -4.760 -10.537   4.143
  859    HA   GLU 201           HA       GLU 201  -2.785 -10.253   5.136
  860   1HB   GLU 201          2HB       GLU 201  -1.811 -10.457   2.271
  861   2HB   GLU 201          1HB       GLU 201  -0.935 -10.949   3.720
  862   1HG   GLU 201          2HG       GLU 201  -3.161 -12.392   4.098
  863   2HG   GLU 201          1HG       GLU 201  -3.214 -12.285   2.339
  864    HA   PRO 202           HA       PRO 202  -1.296  -6.127   4.948
  865   1HB   PRO 202          2HB       PRO 202   1.074  -6.471   6.301
  866   2HB   PRO 202          1HB       PRO 202  -0.512  -6.457   7.093
  867   1HG   PRO 202          2HG       PRO 202   1.277  -8.772   6.513
  868   2HG   PRO 202          1HG       PRO 202   0.061  -8.585   7.788
  869   1HD   PRO 202          2HD       PRO 202  -0.265 -10.054   5.388
  870   2HD   PRO 202          1HD       PRO 202  -1.561  -9.580   6.508
  871    H    GLN 203           H        GLN 203  -0.762  -5.662   2.779
  872    HA   GLN 203           HA       GLN 203   2.074  -5.729   2.096
  873   1HB   GLN 203          2HB       GLN 203   0.531  -7.953   1.339
  874   2HB   GLN 203          1HB       GLN 203   0.676  -6.972  -0.121
  875   1HG   GLN 203          2HG       GLN 203   2.754  -7.801  -0.381
  876   2HG   GLN 203          1HG       GLN 203   3.225  -6.912   1.068
  877   1HE2  GLN 203          2HE2      GLN 203   4.082 -10.344   1.959
  878   2HE2  GLN 203          1HE2      GLN 203   4.701  -9.048   1.055
  879   1HN   PTR 204          1HN       PTR 204   2.532  -4.338   0.305
  880    HA   PTR 204           HA       PTR 204   2.147  -2.398  -0.962
  881   1HB   PTR 204          1HB       PTR 204   0.017  -2.546  -2.376
  882    HD1  PTR 204           HD1      PTR 204   1.949  -5.635  -1.451
  883    HD2  PTR 204           HD2      PTR 204   1.128  -2.632  -4.416
  884    HE1  PTR 204           HE1      PTR 204   3.540  -6.735  -3.003
  885    HE2  PTR 204           HE2      PTR 204   2.721  -3.737  -5.970
  886    H    GLU 205           H        GLU 205   0.193  -0.700  -1.408
  887    HA   GLU 205           HA       GLU 205  -0.828  -0.035   1.312
  888   1HB   GLU 205          2HB       GLU 205  -0.798   1.833  -1.057
  889   2HB   GLU 205          1HB       GLU 205  -0.810   2.236   0.660
  890   1HG   GLU 205          2HG       GLU 205   1.469   1.089   0.806
  891   2HG   GLU 205          1HG       GLU 205   1.474   1.093  -0.959
  892    H    GLU 206           H        GLU 206  -2.954  -0.411   1.668
  893    HA   GLU 206           HA       GLU 206  -4.765  -0.627  -0.692
  894   1HB   GLU 206          2HB       GLU 206  -5.061  -1.607   2.164
  895   2HB   GLU 206          1HB       GLU 206  -6.305  -1.770   0.923
  896   1HG   GLU 206          2HG       GLU 206  -3.546  -2.743   0.296
  897   2HG   GLU 206          1HG       GLU 206  -4.556  -3.722   1.359
  898    H    ILE 207           H        ILE 207  -7.064   0.198  -0.224
  899    HA   ILE 207           HA       ILE 207  -6.939   2.670   1.455
  900    HB   ILE 207           HB       ILE 207  -8.472   3.701  -0.276
  901   1HG1  ILE 207          2HG1      ILE 207  -9.007   1.353  -1.231
  902   2HG1  ILE 207          1HG1      ILE 207  -8.779   2.667  -2.381
  903   1HG2  ILE 207          1HG2      ILE 207  -5.664   2.865  -1.039
  904   2HG2  ILE 207          3HG2      ILE 207  -6.590   4.076  -1.925
  905   3HG2  ILE 207          2HG2      ILE 207  -6.156   4.358  -0.240
  906   1HD1  ILE 207          3HD1      ILE 207  -6.238   1.418  -1.739
  907   2HD1  ILE 207          2HD1      ILE 207  -7.391   0.221  -2.325
  908   3HD1  ILE 207          1HD1      ILE 207  -7.006   1.630  -3.313
  909    HA   PRO 208           HA       PRO 208 -10.549   0.085   2.678
  910   1HB   PRO 208          2HB       PRO 208  -9.962   0.139   5.364
  911   2HB   PRO 208          1HB       PRO 208  -9.337  -1.090   4.250
  912   1HG   PRO 208          2HG       PRO 208  -7.916   1.228   5.476
  913   2HG   PRO 208          1HG       PRO 208  -7.261  -0.317   4.908
  914   1HD   PRO 208          2HD       PRO 208  -7.128   2.150   3.523
  915   2HD   PRO 208          1HD       PRO 208  -6.782   0.547   2.839
  916    H    ILE 209           H        ILE 209 -12.180   0.746   4.549
  917    HA   ILE 209           HA       ILE 209 -12.132   3.657   5.101
  918    HB   ILE 209           HB       ILE 209 -13.311   3.257   2.882
  919   1HG1  ILE 209          2HG1      ILE 209 -15.479   4.263   4.576
  920   2HG1  ILE 209          1HG1      ILE 209 -13.912   4.954   5.001
  921   1HG2  ILE 209          1HG2      ILE 209 -14.351   1.077   3.797
  922   2HG2  ILE 209          3HG2      ILE 209 -15.523   2.124   4.596
  923   3HG2  ILE 209          2HG2      ILE 209 -15.393   2.128   2.837
  924   1HD1  ILE 209          1HD1      ILE 209 -13.726   5.150   2.331
  925   2HD1  ILE 209          3HD1      ILE 209 -15.481   5.223   2.481
  926   3HD1  ILE 209          2HD1      ILE 209 -14.474   6.410   3.311
  927    H    TYR 210           H        TYR 210 -12.262   0.796   6.412
  928    HA   TYR 210           HA       TYR 210 -14.536   1.421   8.246
  929   1HB   TYR 210          2HB       TYR 210 -13.949  -1.148   8.844
  930   2HB   TYR 210          1HB       TYR 210 -15.109  -0.703   7.596
  931    HD1  TYR 210           HD1      TYR 210 -14.401  -0.649   5.195
  932    HD2  TYR 210           HD2      TYR 210 -11.840  -2.150   8.300
  933    HE1  TYR 210           HE1      TYR 210 -12.988  -1.765   3.489
  934    HE2  TYR 210           HE2      TYR 210 -10.427  -3.266   6.594
  935    HH   TYR 210           HH       TYR 210 -11.010  -2.797   3.134
  936    H    LEU 211           HN       LEU 211 -14.128   0.876  10.554
  937    HA   LEU 211           HA       LEU 211 -12.821   1.004  12.498
  938   1HB   LEU 211          2HB       LEU 211 -10.431   0.246  10.820
  939   2HB   LEU 211          1HB       LEU 211 -10.749  -0.134  12.513
  940    HG   LEU 211           HG       LEU 211 -12.427  -1.178  10.218
  941   1HD1  LEU 211          3HD1      LEU 211  -9.814  -1.998  11.167
  942   2HD1  LEU 211          2HD1      LEU 211 -10.999  -3.276  11.439
  943   3HD1  LEU 211          1HD1      LEU 211 -10.753  -2.632   9.815
  944   1HD2  LEU 211          2HD2      LEU 211 -13.425  -1.001  12.547
  945   2HD2  LEU 211          1HD2      LEU 211 -13.390  -2.631  11.875
  946   3HD2  LEU 211          3HD2      LEU 211 -12.194  -2.146  13.078
   
  No H/Q in entry =         946
  Start of MODEL   12
    1   1H    SER   1          3HT       SER   1  -6.870 -11.022 -22.553
    2   2H    SER   1          2HT       SER   1  -6.071 -12.171 -23.515
    3   3H    SER   1          1HT       SER   1  -5.231 -11.359 -22.281
    4    HA   SER   1           HA       SER   1  -4.517 -10.064 -23.958
    5   1HB   SER   1          2HB       SER   1  -6.760 -11.395 -25.315
    6   2HB   SER   1          1HB       SER   1  -6.479  -9.747 -25.873
    7    HG   SER   1           HG       SER   1  -5.128 -11.890 -26.516
    8    H    ILE   2           H        ILE   2  -5.725  -9.092 -21.677
    9    HA   ILE   2           HA       ILE   2  -7.895  -7.281 -22.139
   10    HB   ILE   2           HB       ILE   2  -7.113  -6.183 -20.037
   11   1HG1  ILE   2          2HG1      ILE   2  -4.815  -8.142 -20.350
   12   2HG1  ILE   2          1HG1      ILE   2  -4.701  -6.383 -20.383
   13   1HG2  ILE   2          1HG2      ILE   2  -7.400  -9.165 -20.261
   14   2HG2  ILE   2          3HG2      ILE   2  -7.074  -8.439 -18.687
   15   3HG2  ILE   2          2HG2      ILE   2  -8.525  -7.987 -19.584
   16   1HD1  ILE   2          2HD1      ILE   2  -6.035  -7.519 -17.994
   17   2HD1  ILE   2          1HD1      ILE   2  -4.315  -7.878 -18.137
   18   3HD1  ILE   2          3HD1      ILE   2  -4.866  -6.203 -18.111
   19    H    GLN   3           H        GLN   3  -7.369  -4.773 -21.650
   20    HA   GLN   3           HA       GLN   3  -6.313  -3.617 -23.937
   21   1HB   GLN   3          2HB       GLN   3  -7.438  -2.580 -21.743
   22   2HB   GLN   3          1HB       GLN   3  -5.755  -2.196 -21.373
   23   1HG   GLN   3          2HG       GLN   3  -6.502  -0.313 -22.591
   24   2HG   GLN   3          1HG       GLN   3  -5.654  -1.278 -23.798
   25   1HE2  GLN   3          2HE2      GLN   3  -8.695  -0.702 -25.630
   26   2HE2  GLN   3          1HE2      GLN   3  -7.126  -0.099 -25.386
   27    H    ALA   4           H        ALA   4  -4.538  -3.979 -20.878
   28    HA   ALA   4           HA       ALA   4  -2.219  -3.860 -20.478
   29   1HB   ALA   4          3HB       ALA   4  -2.829  -6.132 -21.770
   30   2HB   ALA   4          2HB       ALA   4  -1.732  -5.422 -22.955
   31   3HB   ALA   4          1HB       ALA   4  -1.178  -5.719 -21.309
   32    H    GLU   5           H        GLU   5  -2.010  -1.599 -21.015
   33    HA   GLU   5           HA       GLU   5  -0.130  -1.124 -23.182
   34   1HB   GLU   5          2HB       GLU   5  -2.979  -0.154 -23.386
   35   2HB   GLU   5          1HB       GLU   5  -1.662   0.708 -24.179
   36   1HG   GLU   5          2HG       GLU   5  -1.038  -1.709 -25.059
   37   2HG   GLU   5          1HG       GLU   5  -2.739  -2.034 -24.728
   38    H    GLU   6           H        GLU   6  -2.263   0.221 -20.680
   39    HA   GLU   6           HA       GLU   6  -0.083   2.140 -20.036
   40   1HB   GLU   6          2HB       GLU   6  -3.009   2.903 -20.221
   41   2HB   GLU   6          1HB       GLU   6  -1.675   3.973 -19.786
   42   1HG   GLU   6          2HG       GLU   6  -1.883   4.447 -22.054
   43   2HG   GLU   6          1HG       GLU   6  -0.686   3.153 -22.101
   44    H    TRP   7           H        TRP   7  -3.072   0.543 -18.976
   45    HA   TRP   7           HA       TRP   7  -2.345   1.154 -16.171
   46   1HB   TRP   7          2HB       TRP   7  -4.627   0.225 -15.667
   47   2HB   TRP   7          1HB       TRP   7  -4.654   1.642 -16.714
   48    HD1  TRP   7           HD1      TRP   7  -5.595   1.371 -19.110
   49    HE1  TRP   7           HE1      TRP   7  -6.658  -0.588 -20.407
   50    HE3  TRP   7           HE3      TRP   7  -4.507  -2.473 -15.937
   51    HZ2  TRP   7           HZ2      TRP   7  -6.999  -3.419 -20.129
   52    HZ3  TRP   7           HZ3      TRP   7  -5.206  -4.788 -16.477
   53    HH2  TRP   7           HH2      TRP   7  -6.450  -5.264 -18.564
   54    H    TYR   8           H        TYR   8  -1.777  -1.214 -18.430
   55    HA   TYR   8           HA       TYR   8  -1.025  -3.142 -16.357
   56   1HB   TYR   8          2HB       TYR   8  -3.152  -3.973 -16.550
   57   2HB   TYR   8          1HB       TYR   8  -3.310  -3.528 -18.243
   58    HD1  TYR   8           HD1      TYR   8  -1.115  -5.712 -16.117
   59    HD2  TYR   8           HD2      TYR   8  -3.345  -5.270 -19.749
   60    HE1  TYR   8           HE1      TYR   8  -0.506  -8.023 -16.769
   61    HE2  TYR   8           HE2      TYR   8  -2.745  -7.582 -20.408
   62    HH   TYR   8           HH       TYR   8  -2.066  -9.740 -19.101
   63    H    PHE   9           H        PHE   9   0.891  -3.934 -16.895
   64    HA   PHE   9           HA       PHE   9   1.835  -3.623 -19.684
   65   1HB   PHE   9          2HB       PHE   9   3.163  -3.966 -17.009
   66   2HB   PHE   9          1HB       PHE   9   4.063  -4.309 -18.485
   67    HD1  PHE   9           HD1      PHE   9   1.380  -1.808 -18.529
   68    HD2  PHE   9           HD2      PHE   9   5.611  -2.399 -18.029
   69    HE1  PHE   9           HE1      PHE   9   1.760   0.619 -18.848
   70    HE2  PHE   9           HE2      PHE   9   5.985   0.028 -18.348
   71    HZ   PHE   9           HZ       PHE   9   4.062   1.537 -18.758
   72    H    GLY  10           H        GLY  10   1.404  -6.128 -17.202
   73   1HA   GLY  10          2HA       GLY  10   0.686  -8.299 -18.566
   74   2HA   GLY  10          1HA       GLY  10   2.340  -8.170 -19.142
   75    H    LYS  11           H        LYS  11   3.776  -9.322 -18.015
   76    HA   LYS  11           HA       LYS  11   3.120 -10.085 -15.204
   77   1HB   LYS  11          2HB       LYS  11   5.123 -11.425 -17.040
   78   2HB   LYS  11          1HB       LYS  11   4.427 -12.065 -15.552
   79   1HG   LYS  11          2HG       LYS  11   2.510 -12.728 -16.589
   80   2HG   LYS  11          1HG       LYS  11   2.442 -11.278 -17.592
   81   1HD   LYS  11          2HD       LYS  11   2.847 -13.074 -19.109
   82   2HD   LYS  11          1HD       LYS  11   4.409 -12.281 -18.900
   83   1HE   LYS  11          2HE       LYS  11   5.255 -14.005 -17.573
   84   2HE   LYS  11          1HE       LYS  11   3.651 -14.547 -17.080
   85   1HZ   LYS  11          1HZ       LYS  11   3.282 -15.262 -19.401
   86   2HZ   LYS  11          3HZ       LYS  11   4.894 -14.871 -19.755
   87   3HZ   LYS  11          2HZ       LYS  11   4.547 -16.101 -18.636
   88    H    LEU  12           H        LEU  12   3.964  -7.812 -14.834
   89    HA   LEU  12           HA       LEU  12   6.946  -7.729 -14.880
   90   1HB   LEU  12          2HB       LEU  12   5.615  -5.929 -16.063
   91   2HB   LEU  12          1HB       LEU  12   5.029  -5.424 -14.481
   92    HG   LEU  12           HG       LEU  12   7.280  -4.954 -13.733
   93   1HD1  LEU  12          2HD1      LEU  12   7.948  -6.670 -15.992
   94   2HD1  LEU  12          1HD1      LEU  12   8.871  -5.168 -16.026
   95   3HD1  LEU  12          3HD1      LEU  12   8.941  -6.210 -14.604
   96   1HD2  LEU  12          2HD2      LEU  12   6.088  -3.730 -16.087
   97   2HD2  LEU  12          1HD2      LEU  12   6.873  -2.965 -14.703
   98   3HD2  LEU  12          3HD2      LEU  12   7.841  -3.528 -16.066
   99    H    GLY  13           H        GLY  13   7.919  -6.497 -12.982
  100   1HA   GLY  13          2HA       GLY  13   6.524  -7.340 -10.479
  101   2HA   GLY  13          1HA       GLY  13   8.275  -7.204 -10.644
  102    H    ARG  14           H        ARG  14   7.762  -5.829  -8.609
  103    HA   ARG  14           HA       ARG  14   6.652  -3.164  -9.133
  104   1HB   ARG  14          2HB       ARG  14   7.267  -2.738  -6.772
  105   2HB   ARG  14          1HB       ARG  14   6.329  -4.220  -6.944
  106   1HG   ARG  14          2HG       ARG  14   8.012  -5.161  -5.734
  107   2HG   ARG  14          1HG       ARG  14   8.883  -5.156  -7.268
  108   1HD   ARG  14          2HD       ARG  14  10.433  -3.915  -6.167
  109   2HD   ARG  14          1HD       ARG  14   9.290  -2.585  -6.359
  110    HE   ARG  14           HE       ARG  14   9.827  -4.056  -3.872
  111   1HH1  ARG  14          1HH2      ARG  14   7.305  -4.178  -3.117
  112   2HH1  ARG  14          2HH2      ARG  14   6.701  -2.576  -2.850
  113   1HH2  ARG  14          2HH1      ARG  14   9.246  -1.034  -4.629
  114   2HH2  ARG  14          1HH1      ARG  14   7.800  -0.797  -3.705
  115    H    LYS  15           H        LYS  15   9.759  -4.662  -9.231
  116    HA   LYS  15           HA       LYS  15  11.273  -2.236  -8.848
  117   1HB   LYS  15          2HB       LYS  15  12.316  -4.351  -8.281
  118   2HB   LYS  15          1HB       LYS  15  12.056  -4.956  -9.917
  119   1HG   LYS  15          2HG       LYS  15  13.917  -3.927 -10.679
  120   2HG   LYS  15          1HG       LYS  15  13.455  -2.400  -9.927
  121   1HD   LYS  15          2HD       LYS  15  14.289  -4.435  -7.984
  122   2HD   LYS  15          1HD       LYS  15  15.564  -4.000  -9.123
  123   1HE   LYS  15          2HE       LYS  15  15.838  -2.389  -7.444
  124   2HE   LYS  15          1HE       LYS  15  14.818  -1.539  -8.605
  125   1HZ   LYS  15          1HZ       LYS  15  13.304  -3.104  -6.750
  126   2HZ   LYS  15          3HZ       LYS  15  14.256  -1.937  -5.970
  127   3HZ   LYS  15          2HZ       LYS  15  13.146  -1.464  -7.166
  128    H    ASP  16           H        ASP  16  10.215  -4.174 -11.625
  129    HA   ASP  16           HA       ASP  16  11.564  -2.532 -13.538
  130   1HB   ASP  16          2HB       ASP  16  10.594  -4.970 -13.711
  131   2HB   ASP  16          1HB       ASP  16   9.130  -4.118 -14.173
  132    H    ALA  17           H        ALA  17   8.381  -2.657 -12.091
  133    HA   ALA  17           HA       ALA  17   7.069  -0.799 -13.794
  134   1HB   ALA  17          3HB       ALA  17   6.120  -2.321 -11.898
  135   2HB   ALA  17          2HB       ALA  17   6.481  -0.947 -10.852
  136   3HB   ALA  17          1HB       ALA  17   5.356  -0.760 -12.197
  137    H    GLU  18           H        GLU  18   8.809  -0.279 -10.733
  138    HA   GLU  18           HA       GLU  18   8.445   2.538 -10.621
  139   1HB   GLU  18          2HB       GLU  18  10.578   2.514  -9.256
  140   2HB   GLU  18          1HB       GLU  18   9.335   1.397  -8.691
  141   1HG   GLU  18          2HG       GLU  18  10.442  -0.458  -9.854
  142   2HG   GLU  18          1HG       GLU  18  11.657   0.647 -10.494
  143    H    ARG  19           H        ARG  19  10.951   0.572 -12.217
  144    HA   ARG  19           HA       ARG  19  12.289   2.968 -13.264
  145   1HB   ARG  19          2HB       ARG  19  13.295   0.588 -12.708
  146   2HB   ARG  19          1HB       ARG  19  12.773   0.212 -14.350
  147   1HG   ARG  19          2HG       ARG  19  14.208   2.787 -14.015
  148   2HG   ARG  19          1HG       ARG  19  15.177   1.334 -13.772
  149   1HD   ARG  19          2HD       ARG  19  13.567   0.855 -16.055
  150   2HD   ARG  19          1HD       ARG  19  14.237   2.476 -16.245
  151    HE   ARG  19           HE       ARG  19  16.502   1.411 -15.878
  152   1HH1  ARG  19          2HH1      ARG  19  14.154  -0.981 -15.766
  153   2HH1  ARG  19          1HH1      ARG  19  14.906  -2.022 -16.928
  154   1HH2  ARG  19          1HH2      ARG  19  17.323   0.294 -17.833
  155   2HH2  ARG  19          2HH2      ARG  19  16.701  -1.300 -18.098
  156    H    GLN  20           H        GLN  20   9.554   1.179 -14.121
  157    HA   GLN  20           HA       GLN  20   9.828   1.558 -17.025
  158   1HB   GLN  20          2HB       GLN  20   7.668   0.440 -15.234
  159   2HB   GLN  20          1HB       GLN  20   7.359   0.761 -16.941
  160   1HG   GLN  20          2HG       GLN  20   9.863  -0.713 -16.357
  161   2HG   GLN  20          1HG       GLN  20   8.370  -1.588 -16.016
  162   1HE2  GLN  20          2HE2      GLN  20   9.465  -0.888 -19.869
  163   2HE2  GLN  20          1HE2      GLN  20  10.399  -0.311 -18.574
  164    H    LEU  21           H        LEU  21   8.258   3.104 -14.287
  165    HA   LEU  21           HA       LEU  21   6.778   4.964 -16.015
  166   1HB   LEU  21          2HB       LEU  21   7.188   5.158 -13.022
  167   2HB   LEU  21          1HB       LEU  21   5.902   5.888 -13.984
  168    HG   LEU  21           HG       LEU  21   6.321   2.953 -13.377
  169   1HD1  LEU  21          2HD1      LEU  21   4.654   5.073 -12.341
  170   2HD1  LEU  21          1HD1      LEU  21   3.648   3.805 -13.042
  171   3HD1  LEU  21          3HD1      LEU  21   4.809   3.411 -11.773
  172   1HD2  LEU  21          1HD2      LEU  21   4.566   4.292 -15.448
  173   2HD2  LEU  21          3HD2      LEU  21   5.758   3.019 -15.705
  174   3HD2  LEU  21          2HD2      LEU  21   4.259   2.663 -14.846
  175    H    LEU  22           H        LEU  22   9.481   5.132 -13.700
  176    HA   LEU  22           HA       LEU  22  10.077   7.892 -14.118
  177   1HB   LEU  22          2HB       LEU  22  11.994   5.648 -13.408
  178   2HB   LEU  22          1HB       LEU  22  12.282   7.371 -13.167
  179    HG   LEU  22           HG       LEU  22  10.266   5.601 -11.776
  180   1HD1  LEU  22          2HD1      LEU  22  12.702   5.990 -10.981
  181   2HD1  LEU  22          1HD1      LEU  22  12.161   7.620 -10.582
  182   3HD1  LEU  22          3HD1      LEU  22  11.409   6.227  -9.806
  183   1HD2  LEU  22          1HD2      LEU  22  10.240   8.562 -12.231
  184   2HD2  LEU  22          3HD2      LEU  22   8.890   7.430 -12.148
  185   3HD2  LEU  22          2HD2      LEU  22   9.704   7.942 -10.670
  186    H    SER  23           H        SER  23  11.360   4.950 -15.702
  187    HA   SER  23           HA       SER  23  13.230   6.190 -17.410
  188   1HB   SER  23          2HB       SER  23  12.962   3.736 -17.219
  189   2HB   SER  23          1HB       SER  23  11.414   3.846 -18.058
  190    HG   SER  23           HG       SER  23  14.001   4.096 -19.030
  191    H    PHE  24           H        PHE  24  13.029   6.952 -19.610
  192    HA   PHE  24           HA       PHE  24  11.053   8.801 -20.168
  193   1HB   PHE  24          2HB       PHE  24  12.406   7.015 -22.216
  194   2HB   PHE  24          1HB       PHE  24  11.633   8.566 -22.549
  195    HD1  PHE  24           HD1      PHE  24  12.467  10.558 -20.964
  196    HD2  PHE  24           HD2      PHE  24  14.707   7.003 -21.856
  197    HE1  PHE  24           HE1      PHE  24  14.568  11.733 -20.369
  198    HE2  PHE  24           HE2      PHE  24  16.808   8.178 -21.262
  199    HZ   PHE  24           HZ       PHE  24  16.739  10.543 -20.518
  200    H    GLY  25           H        GLY  25   8.947   8.140 -19.635
  201   1HA   GLY  25          2HA       GLY  25   7.606   6.494 -21.663
  202   2HA   GLY  25          1HA       GLY  25   7.581   5.817 -20.037
  203    H    ASN  26           H        ASN  26   6.670   7.246 -18.321
  204    HA   ASN  26           HA       ASN  26   4.790   9.308 -19.364
  205   1HB   ASN  26          2HB       ASN  26   3.997   6.724 -18.588
  206   2HB   ASN  26          1HB       ASN  26   3.576   7.766 -17.228
  207   1HD2  ASN  26          2HD2      ASN  26   2.000   9.038 -20.803
  208   2HD2  ASN  26          1HD2      ASN  26   3.652   8.660 -20.704
  209    HA   PRO  27           HA       PRO  27   6.199  11.458 -15.791
  210   1HB   PRO  27          2HB       PRO  27   4.239  13.384 -15.735
  211   2HB   PRO  27          1HB       PRO  27   5.582  13.387 -16.887
  212   1HG   PRO  27          2HG       PRO  27   2.712  12.691 -17.335
  213   2HG   PRO  27          1HG       PRO  27   3.906  13.310 -18.486
  214   1HD   PRO  27          2HD       PRO  27   3.054  10.613 -18.249
  215   2HD   PRO  27          1HD       PRO  27   4.459  11.188 -19.170
  216    H    ARG  28           H        ARG  28   4.720  12.701 -13.850
  217    HA   ARG  28           HA       ARG  28   3.801  10.556 -12.206
  218   1HB   ARG  28          2HB       ARG  28   3.023  12.309 -10.678
  219   2HB   ARG  28          1HB       ARG  28   4.609  12.734 -11.320
  220   1HG   ARG  28          2HG       ARG  28   3.789  14.491 -12.541
  221   2HG   ARG  28          1HG       ARG  28   2.270  13.668 -12.897
  222   1HD   ARG  28          2HD       ARG  28   1.582  14.038 -10.512
  223   2HD   ARG  28          1HD       ARG  28   3.046  14.994 -10.282
  224    HE   ARG  28           HE       ARG  28   0.638  15.890 -11.615
  225   1HH1  ARG  28          2HH1      ARG  28   2.904  15.940 -13.678
  226   2HH1  ARG  28          1HH1      ARG  28   3.489  17.557 -13.481
  227   1HH2  ARG  28          1HH2      ARG  28   1.892  18.047 -10.442
  228   2HH2  ARG  28          2HH2      ARG  28   2.915  18.751 -11.649
  229    H    GLY  29           H        GLY  29   1.520  10.416 -11.306
  230   1HA   GLY  29          2HA       GLY  29  -0.839  10.458 -11.591
  231   2HA   GLY  29          1HA       GLY  29  -0.617  11.417 -13.055
  232    H    THR  30           H        THR  30   1.350   8.605 -12.818
  233    HA   THR  30           HA       THR  30  -0.303   7.326 -14.932
  234    HB   THR  30           HB       THR  30   2.510   6.647 -14.024
  235    HG1  THR  30           HG1      THR  30   1.466   8.540 -15.759
  236   1HG2  THR  30          2HG2      THR  30   1.148   4.881 -15.228
  237   2HG2  THR  30          1HG2      THR  30   1.092   5.975 -16.610
  238   3HG2  THR  30          3HG2      THR  30   2.641   5.352 -16.041
  239    H    PHE  31           H        PHE  31  -0.666   4.979 -14.779
  240    HA   PHE  31           HA       PHE  31  -0.279   3.711 -12.155
  241   1HB   PHE  31          2HB       PHE  31  -3.075   4.063 -13.264
  242   2HB   PHE  31          1HB       PHE  31  -2.631   3.310 -11.735
  243    HD1  PHE  31           HD1      PHE  31  -2.669   6.541 -13.591
  244    HD2  PHE  31           HD2      PHE  31  -2.260   4.608  -9.778
  245    HE1  PHE  31           HE1      PHE  31  -2.810   8.743 -12.457
  246    HE2  PHE  31           HE2      PHE  31  -2.401   6.809  -8.645
  247    HZ   PHE  31           HZ       PHE  31  -2.675   8.878  -9.986
  248    H    LEU  32           H        LEU  32   0.908   2.129 -13.437
  249    HA   LEU  32           HA       LEU  32  -0.698   0.701 -15.485
  250   1HB   LEU  32          2HB       LEU  32   1.256   0.214 -16.534
  251   2HB   LEU  32          1HB       LEU  32   1.928   1.485 -15.520
  252    HG   LEU  32           HG       LEU  32   1.934  -1.487 -14.913
  253   1HD1  LEU  32          2HD1      LEU  32   3.753   0.298 -16.289
  254   2HD1  LEU  32          1HD1      LEU  32   4.518  -0.361 -14.842
  255   3HD1  LEU  32          3HD1      LEU  32   3.867  -1.448 -16.070
  256   1HD2  LEU  32          2HD2      LEU  32   2.304   0.905 -13.235
  257   2HD2  LEU  32          1HD2      LEU  32   1.954  -0.757 -12.764
  258   3HD2  LEU  32          3HD2      LEU  32   3.612  -0.271 -13.114
  259    H    ILE  33           H        ILE  33  -0.373  -1.768 -15.459
  260    HA   ILE  33           HA       ILE  33  -0.602  -2.733 -12.638
  261    HB   ILE  33           HB       ILE  33  -2.185  -3.407 -15.104
  262   1HG1  ILE  33          2HG1      ILE  33  -2.946  -3.057 -12.199
  263   2HG1  ILE  33          1HG1      ILE  33  -3.005  -1.778 -13.413
  264   1HG2  ILE  33          2HG2      ILE  33  -1.275  -5.572 -14.292
  265   2HG2  ILE  33          1HG2      ILE  33  -1.961  -5.233 -12.706
  266   3HG2  ILE  33          3HG2      ILE  33  -3.020  -5.450 -14.096
  267   1HD1  ILE  33          2HD1      ILE  33  -4.374  -3.837 -14.645
  268   2HD1  ILE  33          1HD1      ILE  33  -4.857  -4.013 -12.959
  269   3HD1  ILE  33          3HD1      ILE  33  -5.125  -2.485 -13.797
  270    H    ARG  34           H        ARG  34  -0.106  -5.214 -12.570
  271    HA   ARG  34           HA       ARG  34   1.550  -6.443 -14.527
  272   1HB   ARG  34          2HB       ARG  34   3.768  -6.147 -13.308
  273   2HB   ARG  34          1HB       ARG  34   3.183  -4.729 -14.177
  274   1HG   ARG  34          2HG       ARG  34   2.181  -3.899 -12.035
  275   2HG   ARG  34          1HG       ARG  34   2.930  -5.263 -11.203
  276   1HD   ARG  34          2HD       ARG  34   5.140  -4.433 -12.275
  277   2HD   ARG  34          1HD       ARG  34   4.267  -2.929 -12.567
  278    HE   ARG  34           HE       ARG  34   4.675  -2.452 -10.308
  279   1HH1  ARG  34          2HH1      ARG  34   4.675  -5.849 -10.851
  280   2HH1  ARG  34          1HH1      ARG  34   4.701  -6.255  -9.168
  281   1HH2  ARG  34          1HH2      ARG  34   4.545  -2.962  -8.098
  282   2HH2  ARG  34          2HH2      ARG  34   4.627  -4.621  -7.610
  283    H    GLU  35           H        GLU  35   2.276  -8.498 -13.821
  284    HA   GLU  35           HA       GLU  35   0.779  -9.660 -11.679
  285   1HB   GLU  35          2HB       GLU  35   1.657 -11.669 -12.402
  286   2HB   GLU  35          1HB       GLU  35   1.949 -10.695 -13.832
  287   1HG   GLU  35          2HG       GLU  35   4.254 -10.320 -13.179
  288   2HG   GLU  35          1HG       GLU  35   3.985 -11.107 -11.624
  289    H    SER  36           H        SER  36   1.253  -9.866  -9.531
  290    HA   SER  36           HA       SER  36   3.552  -8.530  -8.401
  291   1HB   SER  36          2HB       SER  36   1.519 -10.417  -7.165
  292   2HB   SER  36          1HB       SER  36   2.717  -9.504  -6.260
  293    HG   SER  36           HG       SER  36   0.511  -8.579  -6.555
  294    H    GLU  37           H        GLU  37   5.053  -9.693  -6.905
  295    HA   GLU  37           HA       GLU  37   5.673 -12.459  -7.869
  296   1HB   GLU  37          2HB       GLU  37   7.537 -10.178  -7.197
  297   2HB   GLU  37          1HB       GLU  37   8.076 -11.847  -7.360
  298   1HG   GLU  37          2HG       GLU  37   6.528 -10.423  -9.534
  299   2HG   GLU  37          1HG       GLU  37   8.290 -10.400  -9.459
  300    H    THR  38           H        THR  38   4.292 -11.017  -5.465
  301    HA   THR  38           HA       THR  38   5.948 -11.945  -3.215
  302    HB   THR  38           HB       THR  38   4.432  -9.813  -3.333
  303    HG1  THR  38           HG1      THR  38   4.183 -11.519  -1.093
  304   1HG2  THR  38          1HG2      THR  38   2.404 -11.103  -4.037
  305   2HG2  THR  38          3HG2      THR  38   2.395 -11.870  -2.449
  306   3HG2  THR  38          2HG2      THR  38   2.149 -10.129  -2.590
  307    H    THR  39           H        THR  39   2.912 -12.729  -4.823
  308    HA   THR  39           HA       THR  39   2.779 -15.214  -3.152
  309    HB   THR  39           HB       THR  39   0.824 -13.499  -3.245
  310    HG1  THR  39           HG1      THR  39  -0.641 -15.445  -3.477
  311   1HG2  THR  39          3HG2      THR  39   1.060 -13.818  -5.934
  312   2HG2  THR  39          2HG2      THR  39  -0.191 -15.009  -5.578
  313   3HG2  THR  39          1HG2      THR  39  -0.432 -13.320  -5.137
  314    H    LYS  40           H        LYS  40   1.317 -16.898  -4.654
  315    HA   LYS  40           HA       LYS  40   3.034 -18.127  -6.423
  316   1HB   LYS  40          2HB       LYS  40   0.088 -17.985  -7.039
  317   2HB   LYS  40          1HB       LYS  40   1.183 -19.351  -7.248
  318   1HG   LYS  40          2HG       LYS  40   1.471 -19.240  -4.675
  319   2HG   LYS  40          1HG       LYS  40   0.017 -18.242  -4.700
  320   1HD   LYS  40          2HD       LYS  40  -0.526 -20.454  -6.373
  321   2HD   LYS  40          1HD       LYS  40   0.248 -21.114  -4.933
  322   1HE   LYS  40          2HE       LYS  40  -1.445 -19.310  -3.799
  323   2HE   LYS  40          1HE       LYS  40  -2.378 -19.772  -5.222
  324   1HZ   LYS  40          3HZ       LYS  40  -1.919 -22.131  -4.575
  325   2HZ   LYS  40          2HZ       LYS  40  -1.310 -21.545  -3.101
  326   3HZ   LYS  40          1HZ       LYS  40  -2.937 -21.282  -3.516
  327    H    GLY  41           H        GLY  41   0.837 -15.462  -7.064
  328   1HA   GLY  41          2HA       GLY  41   2.268 -14.108  -8.956
  329   2HA   GLY  41          1HA       GLY  41   1.473 -15.363  -9.906
  330    H    ALA  42           H        ALA  42   0.759 -12.849  -7.500
  331    HA   ALA  42           HA       ALA  42  -2.063 -12.700  -8.302
  332   1HB   ALA  42          1HB       ALA  42  -0.395 -11.745  -6.120
  333   2HB   ALA  42          3HB       ALA  42  -1.374 -10.436  -6.779
  334   3HB   ALA  42          2HB       ALA  42  -2.152 -11.902  -6.184
  335    H    TYR  43           H        TYR  43  -2.328  -9.860  -8.244
  336    HA   TYR  43           HA       TYR  43  -0.750  -9.158 -10.676
  337   1HB   TYR  43          2HB       TYR  43  -3.586  -9.257 -10.384
  338   2HB   TYR  43          1HB       TYR  43  -3.106  -7.572 -10.593
  339    HD1  TYR  43           HD1      TYR  43  -0.791  -7.579 -12.258
  340    HD2  TYR  43           HD2      TYR  43  -4.237 -10.159 -12.440
  341    HE1  TYR  43           HE1      TYR  43  -0.353  -8.020 -14.667
  342    HE2  TYR  43           HE2      TYR  43  -3.788 -10.595 -14.838
  343    HH   TYR  43           HH       TYR  43  -1.444 -10.476 -16.314
  344    H    SER  44           H        SER  44  -1.260  -6.476 -10.876
  345    HA   SER  44           HA       SER  44  -0.941  -5.202  -8.264
  346   1HB   SER  44          2HB       SER  44   1.387  -5.278 -10.159
  347   2HB   SER  44          1HB       SER  44   1.326  -4.535  -8.550
  348    HG   SER  44           HG       SER  44   1.750  -6.395  -7.726
  349    H    LEU  45           H        LEU  45  -0.491  -2.856  -8.462
  350    HA   LEU  45           HA       LEU  45  -1.076  -1.722 -11.147
  351   1HB   LEU  45          2HB       LEU  45  -3.276  -1.724 -10.231
  352   2HB   LEU  45          1HB       LEU  45  -2.697  -1.226  -8.642
  353    HG   LEU  45           HG       LEU  45  -2.298   0.990  -9.349
  354   1HD1  LEU  45          1HD1      LEU  45  -2.132  -0.259 -12.067
  355   2HD1  LEU  45          3HD1      LEU  45  -2.591   1.440 -11.951
  356   3HD1  LEU  45          2HD1      LEU  45  -1.044   0.898 -11.300
  357   1HD2  LEU  45          2HD2      LEU  45  -4.785  -0.256 -10.323
  358   2HD2  LEU  45          1HD2      LEU  45  -4.562   1.176  -9.317
  359   3HD2  LEU  45          3HD2      LEU  45  -4.409   1.297 -11.070
  360    H    SER  46           H        SER  46   1.131  -1.027 -11.094
  361    HA   SER  46           HA       SER  46   2.158   0.589  -8.914
  362   1HB   SER  46          2HB       SER  46   3.468   0.917 -11.519
  363   2HB   SER  46          1HB       SER  46   4.142   0.389  -9.982
  364    HG   SER  46           HG       SER  46   2.916  -1.626 -10.425
  365    H    ILE  47           H        ILE  47   2.610   2.876  -9.014
  366    HA   ILE  47           HA       ILE  47   1.163   4.357 -11.153
  367    HB   ILE  47           HB       ILE  47  -0.146   5.599  -9.687
  368   1HG1  ILE  47          2HG1      ILE  47   1.624   4.759  -7.367
  369   2HG1  ILE  47          1HG1      ILE  47   1.806   6.281  -8.242
  370   1HG2  ILE  47          3HG2      ILE  47  -0.663   3.107  -9.617
  371   2HG2  ILE  47          2HG2      ILE  47   0.176   3.064  -8.067
  372   3HG2  ILE  47          1HG2      ILE  47  -1.275   4.049  -8.257
  373   1HD1  ILE  47          3HD1      ILE  47  -0.888   5.545  -7.146
  374   2HD1  ILE  47          2HD1      ILE  47   0.338   6.191  -6.053
  375   3HD1  ILE  47          1HD1      ILE  47  -0.199   7.143  -7.438
  376    H    ARG  48           H        ARG  48   2.247   6.169 -11.839
  377    HA   ARG  48           HA       ARG  48   4.950   6.618 -10.834
  378   1HB   ARG  48          2HB       ARG  48   4.514   6.856 -13.219
  379   2HB   ARG  48          1HB       ARG  48   3.285   8.080 -12.905
  380   1HG   ARG  48          2HG       ARG  48   5.217   9.329 -13.477
  381   2HG   ARG  48          1HG       ARG  48   5.168   9.390 -11.714
  382   1HD   ARG  48          2HD       ARG  48   7.119   8.275 -11.541
  383   2HD   ARG  48          1HD       ARG  48   6.575   7.026 -12.660
  384    HE   ARG  48           HE       ARG  48   8.108   8.071 -14.119
  385   1HH1  ARG  48          2HH1      ARG  48   6.911  10.407 -11.941
  386   2HH1  ARG  48          1HH1      ARG  48   7.221  11.755 -12.982
  387   1HH2  ARG  48          1HH2      ARG  48   8.235   9.797 -15.658
  388   2HH2  ARG  48          2HH2      ARG  48   7.971  11.410 -15.087
  389    H    ASP  49           H        ASP  49   5.181   7.716  -8.926
  390    HA   ASP  49           HA       ASP  49   3.455  10.120  -8.524
  391   1HB   ASP  49          2HB       ASP  49   4.386   9.490  -6.008
  392   2HB   ASP  49          1HB       ASP  49   2.802   9.048  -6.640
  393    H    TRP  50           H        TRP  50   4.673  11.888  -8.913
  394    HA   TRP  50           HA       TRP  50   7.521  11.886  -7.985
  395   1HB   TRP  50          2HB       TRP  50   7.575  12.251 -10.329
  396   2HB   TRP  50          1HB       TRP  50   6.122  13.245 -10.294
  397    HD1  TRP  50           HD1      TRP  50   9.848  13.478 -10.078
  398    HE1  TRP  50           HE1      TRP  50  10.547  15.918  -9.615
  399    HE3  TRP  50           HE3      TRP  50   5.318  15.448  -9.009
  400    HZ2  TRP  50           HZ2      TRP  50   9.301  18.410  -8.931
  401    HZ3  TRP  50           HZ3      TRP  50   5.068  17.856  -8.462
  402    HH2  TRP  50           HH2      TRP  50   7.055  19.340  -8.425
  403    H    ASP  51           H        ASP  51   8.250  14.106  -7.227
  404    HA   ASP  51           HA       ASP  51   6.066  15.803  -6.165
  405   1HB   ASP  51          2HB       ASP  51   7.181  13.846  -4.561
  406   2HB   ASP  51          1HB       ASP  51   8.129  15.274  -4.146
  407    H    ASP  52           H        ASP  52   6.863  17.910  -5.437
  408    HA   ASP  52           HA       ASP  52   9.196  18.780  -6.996
  409   1HB   ASP  52          2HB       ASP  52   8.479  21.000  -6.522
  410   2HB   ASP  52          1HB       ASP  52   6.995  20.076  -6.743
  411    H    MET  53           H        MET  53   9.778  17.012  -4.734
  412    HA   MET  53           HA       MET  53  11.821  18.639  -3.506
  413   1HB   MET  53          2HB       MET  53  11.000  18.009  -1.140
  414   2HB   MET  53          1HB       MET  53  10.170  19.330  -1.963
  415   1HG   MET  53          2HG       MET  53   8.257  18.186  -1.596
  416   2HG   MET  53          1HG       MET  53   8.814  17.050  -2.825
  417   1HE   MET  53          1HE       MET  53   9.389  15.134  -2.743
  418   2HE   MET  53          3HE       MET  53   9.901  14.072  -1.424
  419   3HE   MET  53          2HE       MET  53   8.187  14.346  -1.725
  420    H    LYS  54           H        LYS  54  11.791  16.225  -5.097
  421    HA   LYS  54           HA       LYS  54  13.641  14.661  -3.654
  422   1HB   LYS  54          2HB       LYS  54  12.397  12.716  -3.014
  423   2HB   LYS  54          1HB       LYS  54  11.524  14.101  -2.361
  424   1HG   LYS  54          2HG       LYS  54   9.707  13.270  -3.426
  425   2HG   LYS  54          1HG       LYS  54  10.468  13.830  -4.915
  426   1HD   LYS  54          2HD       LYS  54  10.605  11.687  -5.594
  427   2HD   LYS  54          1HD       LYS  54  11.708  11.369  -4.256
  428   1HE   LYS  54          2HE       LYS  54   8.824  11.490  -3.562
  429   2HE   LYS  54          1HE       LYS  54   9.326  10.108  -4.537
  430   1HZ   LYS  54          2HZ       LYS  54  11.229   9.962  -2.823
  431   2HZ   LYS  54          1HZ       LYS  54  10.202  10.889  -1.837
  432   3HZ   LYS  54          3HZ       LYS  54   9.692   9.373  -2.402
  433    H    GLY  55           H        GLY  55  11.281  14.845  -6.258
  434   1HA   GLY  55          2HA       GLY  55  12.239  14.443  -8.525
  435   2HA   GLY  55          1HA       GLY  55  13.036  13.048  -7.813
  436    H    ASP  56           H        ASP  56  11.791  11.964  -9.652
  437    HA   ASP  56           HA       ASP  56   8.900  11.710  -9.202
  438   1HB   ASP  56          2HB       ASP  56   9.199   9.959 -11.092
  439   2HB   ASP  56          1HB       ASP  56   9.476  11.650 -11.494
  440    H    HIS  57           H        HIS  57   7.994   9.404  -9.066
  441    HA   HIS  57           HA       HIS  57   9.745   7.397  -7.858
  442   1HB   HIS  57          2HB       HIS  57   8.121   9.197  -6.223
  443   2HB   HIS  57          1HB       HIS  57   7.713   7.504  -5.960
  444    HD1  HIS  57           HD1      HIS  57   8.904   8.068  -3.542
  445    HD2  HIS  57           HD2      HIS  57  11.411   7.824  -6.863
  446    HE1  HIS  57           HE1      HIS  57  11.251   7.750  -2.645
  447    H    VAL  58           H        VAL  58   7.854   5.720  -6.823
  448    HA   VAL  58           HA       VAL  58   5.548   5.540  -8.579
  449    HB   VAL  58           HB       VAL  58   8.063   4.113  -9.163
  450   1HG1  VAL  58          1HG1      VAL  58   5.397   2.677  -9.043
  451   2HG1  VAL  58          3HG1      VAL  58   6.674   2.167 -10.151
  452   3HG1  VAL  58          2HG1      VAL  58   6.955   2.137  -8.410
  453   1HG2  VAL  58          2HG2      VAL  58   5.562   4.884 -10.662
  454   2HG2  VAL  58          1HG2      VAL  58   7.155   5.635 -10.758
  455   3HG2  VAL  58          3HG2      VAL  58   6.903   4.016 -11.412
  456    H    LYS  59           H        LYS  59   4.017   4.815  -7.232
  457    HA   LYS  59           HA       LYS  59   4.771   3.069  -4.946
  458   1HB   LYS  59          2HB       LYS  59   3.112   5.227  -5.018
  459   2HB   LYS  59          1HB       LYS  59   1.953   3.930  -5.307
  460   1HG   LYS  59          2HG       LYS  59   2.473   2.858  -3.259
  461   2HG   LYS  59          1HG       LYS  59   3.978   3.759  -3.074
  462   1HD   LYS  59          2HD       LYS  59   1.255   5.084  -3.075
  463   2HD   LYS  59          1HD       LYS  59   2.057   4.544  -1.601
  464   1HE   LYS  59          2HE       LYS  59   3.920   6.024  -1.983
  465   2HE   LYS  59          1HE       LYS  59   3.337   6.426  -3.599
  466   1HZ   LYS  59          1HZ       LYS  59   1.328   7.357  -2.541
  467   2HZ   LYS  59          3HZ       LYS  59   2.027   7.089  -1.020
  468   3HZ   LYS  59          2HZ       LYS  59   2.749   8.177  -2.106
  469    H    HIS  60           H        HIS  60   2.478   1.569  -4.612
  470    HA   HIS  60           HA       HIS  60   1.727   0.414  -7.192
  471   1HB   HIS  60          2HB       HIS  60   3.106  -1.432  -5.264
  472   2HB   HIS  60          1HB       HIS  60   2.711  -1.713  -6.955
  473    HD1  HIS  60           HD1      HIS  60   4.383  -0.962  -8.701
  474    HD2  HIS  60           HD2      HIS  60   5.331   0.435  -4.889
  475    HE1  HIS  60           HE1      HIS  60   6.688   0.071  -8.871
  476    H    TYR  61           H        TYR  61   0.026  -1.043  -7.072
  477    HA   TYR  61           HA       TYR  61  -1.280  -1.290  -4.394
  478   1HB   TYR  61          2HB       TYR  61  -2.369  -0.324  -7.005
  479   2HB   TYR  61          1HB       TYR  61  -3.429  -1.352  -6.039
  480    HD1  TYR  61           HD1      TYR  61  -3.602  -0.737  -3.488
  481    HD2  TYR  61           HD2      TYR  61  -2.242   1.964  -6.539
  482    HE1  TYR  61           HE1      TYR  61  -4.107   1.188  -2.009
  483    HE2  TYR  61           HE2      TYR  61  -2.747   3.889  -5.059
  484    HH   TYR  61           HH       TYR  61  -3.393   3.536  -1.741
  485    H    LYS  62           H        LYS  62  -0.485  -3.412  -4.132
  486    HA   LYS  62           HA       LYS  62  -0.345  -5.451  -6.023
  487   1HB   LYS  62          2HB       LYS  62   0.416  -5.586  -3.633
  488   2HB   LYS  62          1HB       LYS  62  -1.253  -5.835  -3.152
  489   1HG   LYS  62          2HG       LYS  62  -0.724  -7.642  -5.277
  490   2HG   LYS  62          1HG       LYS  62   0.643  -7.744  -4.166
  491   1HD   LYS  62          2HD       LYS  62  -2.289  -8.134  -3.522
  492   2HD   LYS  62          1HD       LYS  62  -0.988  -9.318  -3.382
  493   1HE   LYS  62          2HE       LYS  62  -0.694  -8.651  -1.251
  494   2HE   LYS  62          1HE       LYS  62  -0.165  -7.085  -1.864
  495   1HZ   LYS  62          2HZ       LYS  62  -2.629  -6.556  -2.023
  496   2HZ   LYS  62          1HZ       LYS  62  -2.876  -7.909  -1.027
  497   3HZ   LYS  62          3HZ       LYS  62  -1.949  -6.604  -0.467
  498    H    ILE  63           H        ILE  63  -1.888  -6.107  -7.385
  499    HA   ILE  63           HA       ILE  63  -4.713  -5.718  -6.754
  500    HB   ILE  63           HB       ILE  63  -3.138  -6.569  -9.135
  501   1HG1  ILE  63          2HG1      ILE  63  -5.490  -4.757  -9.211
  502   2HG1  ILE  63          1HG1      ILE  63  -4.083  -4.201  -8.305
  503   1HG2  ILE  63          1HG2      ILE  63  -6.039  -7.207  -8.609
  504   2HG2  ILE  63          3HG2      ILE  63  -5.472  -6.896 -10.249
  505   3HG2  ILE  63          2HG2      ILE  63  -4.800  -8.237  -9.323
  506   1HD1  ILE  63          3HD1      ILE  63  -3.004  -5.286 -10.627
  507   2HD1  ILE  63          2HD1      ILE  63  -4.446  -4.436 -11.183
  508   3HD1  ILE  63          1HD1      ILE  63  -3.206  -3.571 -10.278
  509    H    ARG  64           H        ARG  64  -6.153  -7.279  -6.204
  510    HA   ARG  64           HA       ARG  64  -5.222 -10.107  -6.085
  511   1HB   ARG  64          2HB       ARG  64  -6.920  -8.651  -4.030
  512   2HB   ARG  64          1HB       ARG  64  -6.481 -10.357  -3.971
  513   1HG   ARG  64          2HG       ARG  64  -4.635  -7.967  -3.765
  514   2HG   ARG  64          1HG       ARG  64  -4.940  -9.198  -2.539
  515   1HD   ARG  64          2HD       ARG  64  -4.143 -10.694  -4.723
  516   2HD   ARG  64          1HD       ARG  64  -3.121  -9.262  -4.839
  517    HE   ARG  64           HE       ARG  64  -2.687  -9.815  -2.286
  518   1HH1  ARG  64          2HH1      ARG  64  -4.049 -12.383  -3.925
  519   2HH1  ARG  64          1HH1      ARG  64  -2.751 -13.493  -3.643
  520   1HH2  ARG  64          1HH2      ARG  64  -0.629 -11.090  -2.322
  521   2HH2  ARG  64          2HH2      ARG  64  -0.816 -12.762  -2.733
  522    H    LYS  65           H        LYS  65  -6.560 -11.338  -7.331
  523    HA   LYS  65           HA       LYS  65  -9.300 -10.281  -7.837
  524   1HB   LYS  65          2HB       LYS  65  -9.258 -11.474  -9.945
  525   2HB   LYS  65          1HB       LYS  65  -7.782 -10.518  -9.826
  526   1HG   LYS  65          2HG       LYS  65  -7.653 -13.289  -8.747
  527   2HG   LYS  65          1HG       LYS  65  -7.767 -13.129 -10.497
  528   1HD   LYS  65          2HD       LYS  65  -5.648 -12.350 -10.659
  529   2HD   LYS  65          1HD       LYS  65  -5.873 -11.237  -9.311
  530   1HE   LYS  65          2HE       LYS  65  -4.470 -12.622  -8.184
  531   2HE   LYS  65          1HE       LYS  65  -5.872 -13.682  -8.044
  532   1HZ   LYS  65          1HZ       LYS  65  -4.628 -13.987 -10.573
  533   2HZ   LYS  65          3HZ       LYS  65  -3.496 -14.227  -9.332
  534   3HZ   LYS  65          2HZ       LYS  65  -4.919 -15.155  -9.374
  535    H    LEU  66           H        LEU  66 -11.049 -11.699  -7.626
  536    HA   LEU  66           HA       LEU  66 -10.680 -13.836  -5.708
  537   1HB   LEU  66          2HB       LEU  66 -13.057 -13.004  -7.373
  538   2HB   LEU  66          1HB       LEU  66 -13.110 -14.357  -6.246
  539    HG   LEU  66           HG       LEU  66 -13.926 -12.534  -4.991
  540   1HD1  LEU  66          2HD1      LEU  66 -11.697 -13.785  -4.148
  541   2HD1  LEU  66          1HD1      LEU  66 -11.080 -12.132  -4.215
  542   3HD1  LEU  66          3HD1      LEU  66 -12.476 -12.513  -3.207
  543   1HD2  LEU  66          2HD2      LEU  66 -12.562 -11.035  -6.869
  544   2HD2  LEU  66          1HD2      LEU  66 -13.479 -10.386  -5.512
  545   3HD2  LEU  66          3HD2      LEU  66 -11.738 -10.641  -5.365
  546    H    ASP  67           H        ASP  67 -11.449 -16.100  -6.164
  547    HA   ASP  67           HA       ASP  67 -10.063 -17.110  -8.502
  548   1HB   ASP  67          2HB       ASP  67 -11.302 -18.189  -6.118
  549   2HB   ASP  67          1HB       ASP  67 -11.823 -19.096  -7.536
  550    H    ASN  68           H        ASN  68 -13.113 -15.816  -7.832
  551    HA   ASN  68           HA       ASN  68 -14.371 -17.119 -10.198
  552   1HB   ASN  68          2HB       ASN  68 -15.658 -15.033  -8.431
  553   2HB   ASN  68          1HB       ASN  68 -16.439 -16.281  -9.402
  554   1HD2  ASN  68          2HD2      ASN  68 -15.900 -17.143  -5.621
  555   2HD2  ASN  68          1HD2      ASN  68 -16.161 -15.605  -6.289
  556    H    GLY  69           H        GLY  69 -12.468 -14.490  -9.417
  557   1HA   GLY  69          2HA       GLY  69 -11.818 -13.196 -11.517
  558   2HA   GLY  69          1HA       GLY  69 -13.541 -12.871 -11.644
  559    H    GLY  70           H        GLY  70 -14.543 -11.620  -9.956
  560   1HA   GLY  70          2HA       GLY  70 -14.429  -9.382  -9.034
  561   2HA   GLY  70          1HA       GLY  70 -13.970 -10.433  -7.712
  562    H    TYR  71           H        TYR  71 -12.446  -8.790 -10.520
  563    HA   TYR  71           HA       TYR  71  -9.822  -8.817  -9.285
  564   1HB   TYR  71          2HB       TYR  71 -11.070  -7.433 -11.633
  565   2HB   TYR  71          1HB       TYR  71  -9.546  -6.803 -11.008
  566    HD1  TYR  71           HD1      TYR  71  -7.548  -8.312 -10.842
  567    HD2  TYR  71           HD2      TYR  71 -11.165  -9.490 -12.831
  568    HE1  TYR  71           HE1      TYR  71  -6.320 -10.133 -12.001
  569    HE2  TYR  71           HE2      TYR  71  -9.942 -11.306 -13.993
  570    HH   TYR  71           HH       TYR  71  -7.229 -12.561 -13.086
  571    H    TYR  72           H        TYR  72  -9.144  -7.534  -7.618
  572    HA   TYR  72           HA       TYR  72 -10.311  -4.814  -7.339
  573   1HB   TYR  72          2HB       TYR  72 -11.009  -5.140  -5.049
  574   2HB   TYR  72          1HB       TYR  72 -11.775  -6.374  -6.037
  575    HD1  TYR  72           HD1      TYR  72  -9.129  -5.721  -3.540
  576    HD2  TYR  72           HD2      TYR  72 -11.170  -8.730  -5.824
  577    HE1  TYR  72           HE1      TYR  72  -8.106  -7.469  -2.143
  578    HE2  TYR  72           HE2      TYR  72 -10.135 -10.486  -4.433
  579    HH   TYR  72           HH       TYR  72  -8.413 -10.876  -2.938
  580    H    ILE  73           H        ILE  73  -8.715  -3.387  -6.684
  581    HA   ILE  73           HA       ILE  73  -6.107  -4.462  -5.830
  582    HB   ILE  73           HB       ILE  73  -7.186  -1.721  -6.462
  583   1HG1  ILE  73          2HG1      ILE  73  -4.469  -2.805  -7.117
  584   2HG1  ILE  73          1HG1      ILE  73  -5.880  -3.389  -7.999
  585   1HG2  ILE  73          2HG2      ILE  73  -6.120  -1.469  -4.237
  586   2HG2  ILE  73          1HG2      ILE  73  -4.646  -2.187  -4.886
  587   3HG2  ILE  73          3HG2      ILE  73  -5.219  -0.637  -5.505
  588   1HD1  ILE  73          2HD1      ILE  73  -6.218  -0.618  -7.934
  589   2HD1  ILE  73          1HD1      ILE  73  -4.490  -0.835  -8.222
  590   3HD1  ILE  73          3HD1      ILE  73  -5.666  -1.566  -9.315
  591    H    THR  74           H        THR  74  -8.999  -3.058  -4.562
  592    HA   THR  74           HA       THR  74  -8.028  -3.564  -1.795
  593    HB   THR  74           HB       THR  74  -8.309  -1.353  -1.400
  594    HG1  THR  74           HG1      THR  74 -10.128  -1.557  -0.398
  595   1HG2  THR  74          2HG2      THR  74  -9.967  -1.194  -3.932
  596   2HG2  THR  74          1HG2      THR  74  -9.416   0.190  -2.986
  597   3HG2  THR  74          3HG2      THR  74  -8.243  -0.841  -3.806
  598    H    THR  75           H        THR  75  -9.525  -4.656  -0.523
  599    HA   THR  75           HA       THR  75 -11.440  -6.262  -1.925
  600    HB   THR  75           HB       THR  75 -11.988  -7.173   0.264
  601    HG1  THR  75           HG1      THR  75 -11.181  -6.167   2.110
  602   1HG2  THR  75          2HG2      THR  75  -9.375  -6.887  -0.861
  603   2HG2  THR  75          1HG2      THR  75  -9.222  -6.897   0.900
  604   3HG2  THR  75          3HG2      THR  75 -10.019  -8.240   0.077
  605    H    ARG  76           H        ARG  76 -11.755  -3.071  -1.147
  606    HA   ARG  76           HA       ARG  76 -14.561  -3.161  -0.311
  607   1HB   ARG  76          2HB       ARG  76 -12.455  -1.130  -0.543
  608   2HB   ARG  76          1HB       ARG  76 -14.030  -0.557  -1.090
  609   1HG   ARG  76          2HG       ARG  76 -15.054  -1.170   1.018
  610   2HG   ARG  76          1HG       ARG  76 -13.573  -1.963   1.557
  611   1HD   ARG  76          2HD       ARG  76 -13.358   0.099   2.609
  612   2HD   ARG  76          1HD       ARG  76 -12.513   0.421   1.095
  613    HE   ARG  76           HE       ARG  76 -14.162   2.043   0.704
  614   1HH1  ARG  76          2HH1      ARG  76 -16.296   0.139   0.024
  615   2HH1  ARG  76          1HH1      ARG  76 -17.511   0.466   1.214
  616   1HH2  ARG  76          1HH2      ARG  76 -15.355   2.163   3.334
  617   2HH2  ARG  76          2HH2      ARG  76 -16.978   1.612   3.089
  618    H    ALA  77           H        ALA  77 -12.846  -3.357  -3.264
  619    HA   ALA  77           HA       ALA  77 -15.381  -3.157  -4.742
  620   1HB   ALA  77          2HB       ALA  77 -13.133  -1.181  -5.153
  621   2HB   ALA  77          1HB       ALA  77 -14.359  -1.491  -6.384
  622   3HB   ALA  77          3HB       ALA  77 -14.829  -0.838  -4.812
  623    H    GLN  78           H        GLN  78 -15.319  -4.886  -6.057
  624    HA   GLN  78           HA       GLN  78 -12.750  -5.612  -7.368
  625   1HB   GLN  78          2HB       GLN  78 -14.180  -7.917  -7.525
  626   2HB   GLN  78          1HB       GLN  78 -13.058  -7.580  -6.213
  627   1HG   GLN  78          2HG       GLN  78 -15.905  -6.656  -6.014
  628   2HG   GLN  78          1HG       GLN  78 -15.494  -8.326  -5.632
  629   1HE2  GLN  78          2HE2      GLN  78 -13.212  -7.150  -2.938
  630   2HE2  GLN  78          1HE2      GLN  78 -13.062  -8.111  -4.328
  631    H    PHE  79           H        PHE  79 -13.286  -6.943  -9.464
  632    HA   PHE  79           HA       PHE  79 -15.785  -5.999 -10.754
  633   1HB   PHE  79          2HB       PHE  79 -12.980  -5.433 -11.736
  634   2HB   PHE  79          1HB       PHE  79 -14.396  -5.349 -12.787
  635    HD1  PHE  79           HD1      PHE  79 -13.106  -4.107  -9.502
  636    HD2  PHE  79           HD2      PHE  79 -15.675  -3.381 -12.863
  637    HE1  PHE  79           HE1      PHE  79 -13.630  -1.861  -8.609
  638    HE2  PHE  79           HE2      PHE  79 -16.202  -1.123 -11.970
  639    HZ   PHE  79           HZ       PHE  79 -15.176  -0.364  -9.838
  640    H    GLU  80           H        GLU  80 -15.249  -6.931 -13.318
  641    HA   GLU  80           HA       GLU  80 -15.120  -9.827 -12.728
  642   1HB   GLU  80          2HB       GLU  80 -16.061 -10.039 -15.062
  643   2HB   GLU  80          1HB       GLU  80 -17.078  -9.138 -13.940
  644   1HG   GLU  80          2HG       GLU  80 -16.872  -7.221 -15.117
  645   2HG   GLU  80          1HG       GLU  80 -15.138  -7.444 -15.336
  646    H    THR  81           H        THR  81 -13.411  -7.357 -14.601
  647    HA   THR  81           HA       THR  81 -11.271  -9.376 -15.038
  648    HB   THR  81           HB       THR  81 -11.996  -9.580 -17.205
  649    HG1  THR  81           HG1      THR  81 -11.218  -7.040 -17.895
  650   1HG2  THR  81          3HG2      THR  81 -14.032  -8.187 -16.604
  651   2HG2  THR  81          2HG2      THR  81 -13.110  -6.790 -17.159
  652   3HG2  THR  81          1HG2      THR  81 -13.509  -8.088 -18.284
  653    H    LEU  82           H        LEU  82  -9.354  -8.045 -16.201
  654    HA   LEU  82           HA       LEU  82  -8.757  -5.884 -14.329
  655   1HB   LEU  82          2HB       LEU  82  -7.195  -7.194 -16.561
  656   2HB   LEU  82          1HB       LEU  82  -6.580  -5.790 -15.687
  657    HG   LEU  82           HG       LEU  82  -7.287  -8.507 -14.543
  658   1HD1  LEU  82          3HD1      LEU  82  -4.776  -6.944 -15.034
  659   2HD1  LEU  82          2HD1      LEU  82  -4.851  -8.013 -13.629
  660   3HD1  LEU  82          1HD1      LEU  82  -5.085  -8.669 -15.251
  661   1HD2  LEU  82          3HD2      LEU  82  -6.713  -5.873 -13.169
  662   2HD2  LEU  82          2HD2      LEU  82  -8.105  -6.933 -12.938
  663   3HD2  LEU  82          1HD2      LEU  82  -6.513  -7.427 -12.361
  664    H    GLN  83           H        GLN  83  -9.578  -6.255 -17.723
  665    HA   GLN  83           HA       GLN  83  -9.080  -3.503 -18.427
  666   1HB   GLN  83          2HB       GLN  83  -9.573  -5.727 -19.889
  667   2HB   GLN  83          1HB       GLN  83 -11.183  -5.006 -19.893
  668   1HG   GLN  83          2HG       GLN  83  -8.975  -3.106 -20.393
  669   2HG   GLN  83          1HG       GLN  83  -9.196  -4.327 -21.647
  670   1HE2  GLN  83          2HE2      GLN  83 -12.634  -3.214 -22.296
  671   2HE2  GLN  83          1HE2      GLN  83 -11.791  -4.666 -22.051
  672    H    GLN  84           H        GLN  84 -11.832  -5.301 -17.163
  673    HA   GLN  84           HA       GLN  84 -13.730  -3.144 -17.464
  674   1HB   GLN  84          2HB       GLN  84 -13.697  -5.694 -15.869
  675   2HB   GLN  84          1HB       GLN  84 -15.000  -4.528 -15.694
  676   1HG   GLN  84          2HG       GLN  84 -15.149  -6.492 -17.494
  677   2HG   GLN  84          1HG       GLN  84 -15.821  -4.902 -17.821
  678   1HE2  GLN  84          2HE2      GLN  84 -13.321  -4.056 -20.245
  679   2HE2  GLN  84          1HE2      GLN  84 -14.446  -3.401 -19.158
  680    H    LEU  85           H        LEU  85 -11.478  -4.126 -14.944
  681    HA   LEU  85           HA       LEU  85 -12.544  -2.189 -13.016
  682   1HB   LEU  85          2HB       LEU  85 -11.080  -3.118 -11.519
  683   2HB   LEU  85          1HB       LEU  85 -10.992  -4.408 -12.714
  684    HG   LEU  85           HG       LEU  85  -9.145  -2.666 -13.708
  685   1HD1  LEU  85          3HD1      LEU  85  -9.676  -1.506 -11.318
  686   2HD1  LEU  85          2HD1      LEU  85  -8.383  -2.612 -10.850
  687   3HD1  LEU  85          1HD1      LEU  85  -8.106  -1.414 -12.114
  688   1HD2  LEU  85          3HD2      LEU  85  -9.216  -5.201 -12.559
  689   2HD2  LEU  85          2HD2      LEU  85  -7.891  -4.480 -13.471
  690   3HD2  LEU  85          1HD2      LEU  85  -7.923  -4.349 -11.712
  691    H    VAL  86           H        VAL  86 -10.058  -2.193 -15.503
  692    HA   VAL  86           HA       VAL  86  -9.003   0.322 -14.575
  693    HB   VAL  86           HB       VAL  86  -7.692   0.383 -16.567
  694   1HG1  VAL  86          3HG1      VAL  86  -8.062  -2.130 -15.152
  695   2HG1  VAL  86          2HG1      VAL  86  -7.475  -2.394 -16.795
  696   3HG1  VAL  86          1HG1      VAL  86  -6.572  -1.358 -15.689
  697   1HG2  VAL  86          3HG2      VAL  86 -10.068  -0.769 -17.726
  698   2HG2  VAL  86          2HG2      VAL  86  -8.703  -0.004 -18.536
  699   3HG2  VAL  86          1HG2      VAL  86  -8.659  -1.729 -18.175
  700    H    GLN  87           H        GLN  87 -11.712  -0.788 -16.260
  701    HA   GLN  87           HA       GLN  87 -12.382   1.581 -17.742
  702   1HB   GLN  87          2HB       GLN  87 -13.308  -0.718 -18.154
  703   2HB   GLN  87          1HB       GLN  87 -14.231  -0.553 -16.668
  704   1HG   GLN  87          2HG       GLN  87 -15.518   1.227 -17.515
  705   2HG   GLN  87          1HG       GLN  87 -14.400   1.520 -18.847
  706   1HE2  GLN  87          2HE2      GLN  87 -17.421  -0.501 -19.994
  707   2HE2  GLN  87          1HE2      GLN  87 -17.300   0.933 -19.094
  708    H    HIS  88           H        HIS  88 -13.317   0.265 -14.600
  709    HA   HIS  88           HA       HIS  88 -15.047   2.502 -13.965
  710   1HB   HIS  88          2HB       HIS  88 -15.102   0.033 -13.095
  711   2HB   HIS  88          1HB       HIS  88 -13.923   0.617 -11.926
  712    HD1  HIS  88           HD1      HIS  88 -17.520   0.543 -12.620
  713    HD2  HIS  88           HD2      HIS  88 -14.952   2.904 -10.339
  714    HE1  HIS  88           HE1      HIS  88 -18.981   1.836 -11.007
  715    H    TYR  89           H        TYR  89 -11.821   1.442 -13.158
  716    HA   TYR  89           HA       TYR  89 -11.248   3.470 -11.219
  717   1HB   TYR  89          2HB       TYR  89  -9.522   1.680 -12.929
  718   2HB   TYR  89          1HB       TYR  89  -8.823   2.861 -11.829
  719    HD1  TYR  89           HD1      TYR  89 -11.771   0.549 -11.595
  720    HD2  TYR  89           HD2      TYR  89  -8.030   1.803  -9.904
  721    HE1  TYR  89           HE1      TYR  89 -12.085  -1.038  -9.746
  722    HE2  TYR  89           HE2      TYR  89  -8.351   0.208  -8.030
  723    HH   TYR  89           HH       TYR  89 -10.977  -2.126  -8.037
  724    H    SER  90           H        SER  90 -11.345   3.475 -14.674
  725    HA   SER  90           HA       SER  90  -9.577   5.697 -15.089
  726   1HB   SER  90          2HB       SER  90 -10.968   3.886 -16.720
  727   2HB   SER  90          1HB       SER  90 -11.630   5.470 -17.118
  728    HG   SER  90           HG       SER  90  -9.686   6.157 -17.746
  729    H    GLU  91           H        GLU  91 -13.076   5.341 -14.726
  730    HA   GLU  91           HA       GLU  91 -13.472   8.248 -14.959
  731   1HB   GLU  91          2HB       GLU  91 -15.511   6.169 -14.131
  732   2HB   GLU  91          1HB       GLU  91 -15.816   7.769 -14.806
  733   1HG   GLU  91          2HG       GLU  91 -14.132   6.506 -16.665
  734   2HG   GLU  91          1HG       GLU  91 -15.295   5.269 -16.188
  735    H    ARG  92           H        ARG  92 -12.588   6.073 -12.518
  736    HA   ARG  92           HA       ARG  92 -13.050   8.174 -10.489
  737   1HB   ARG  92          2HB       ARG  92 -14.001   5.410  -9.802
  738   2HB   ARG  92          1HB       ARG  92 -14.445   6.953  -9.071
  739   1HG   ARG  92          2HG       ARG  92 -15.649   7.577 -11.141
  740   2HG   ARG  92          1HG       ARG  92 -15.219   6.023 -11.854
  741   1HD   ARG  92          2HD       ARG  92 -16.742   4.872 -10.590
  742   2HD   ARG  92          1HD       ARG  92 -16.515   5.914  -9.185
  743    HE   ARG  92           HE       ARG  92 -18.071   6.852 -11.560
  744   1HH1  ARG  92          1HH2      ARG  92 -18.252   8.987  -9.903
  745   2HH1  ARG  92          2HH2      ARG  92 -19.433   8.621  -8.689
  746   1HH2  ARG  92          1HH1      ARG  92 -20.047   6.478  -8.320
  747   2HH2  ARG  92          2HH1      ARG  92 -19.338   5.201  -9.252
  748    H    ALA  93           H        ALA  93 -11.772   7.825  -8.555
  749    HA   ALA  93           HA       ALA  93  -9.223   6.632  -9.028
  750   1HB   ALA  93          2HB       ALA  93 -10.567   7.371  -6.412
  751   2HB   ALA  93          1HB       ALA  93  -8.863   6.941  -6.574
  752   3HB   ALA  93          3HB       ALA  93  -9.486   8.393  -7.358
  753    H    ALA  94           H        ALA  94 -12.220   5.351  -7.836
  754    HA   ALA  94           HA       ALA  94 -12.818   3.084  -7.586
  755   1HB   ALA  94          3HB       ALA  94 -10.358   2.877  -8.896
  756   2HB   ALA  94          2HB       ALA  94 -10.157   1.910  -7.434
  757   3HB   ALA  94          1HB       ALA  94 -11.473   1.555  -8.553
  758    H    GLY  95           H        GLY  95 -10.763   4.950  -5.678
  759   1HA   GLY  95          2HA       GLY  95 -11.257   4.878  -3.244
  760   2HA   GLY  95          1HA       GLY  95 -11.270   3.124  -3.376
  761    H    LEU  96           H        LEU  96  -8.796   3.567  -5.291
  762    HA   LEU  96           HA       LEU  96  -6.850   3.216  -3.140
  763   1HB   LEU  96          2HB       LEU  96  -5.251   2.922  -5.048
  764   2HB   LEU  96          1HB       LEU  96  -6.650   1.858  -5.144
  765    HG   LEU  96           HG       LEU  96  -7.161   4.430  -6.427
  766   1HD1  LEU  96          1HD1      LEU  96  -4.814   2.750  -7.312
  767   2HD1  LEU  96          3HD1      LEU  96  -5.669   3.838  -8.404
  768   3HD1  LEU  96          2HD1      LEU  96  -4.845   4.482  -6.985
  769   1HD2  LEU  96          1HD2      LEU  96  -7.133   1.555  -7.395
  770   2HD2  LEU  96          3HD2      LEU  96  -8.523   2.400  -6.716
  771   3HD2  LEU  96          2HD2      LEU  96  -7.845   2.917  -8.259
  772    H    SER  97           H        SER  97  -4.607   4.483  -4.376
  773    HA   SER  97           HA       SER  97  -4.756   7.078  -3.239
  774   1HB   SER  97          2HB       SER  97  -2.870   5.813  -5.230
  775   2HB   SER  97          1HB       SER  97  -2.672   7.486  -4.705
  776    HG   SER  97           HG       SER  97  -1.516   5.865  -3.451
  777    H    SER  98           H        SER  98  -5.866   5.886  -6.292
  778    HA   SER  98           HA       SER  98  -7.295   8.191  -6.979
  779   1HB   SER  98          2HB       SER  98  -5.845   9.682  -7.841
  780   2HB   SER  98          1HB       SER  98  -4.527   8.662  -7.269
  781    HG   SER  98           HG       SER  98  -5.015   9.216  -9.715
  782    H    ARG  99           H        ARG  99  -7.176   8.298  -9.693
  783    HA   ARG  99           HA       ARG  99  -8.441   5.844 -10.488
  784   1HB   ARG  99          2HB       ARG  99  -7.339   8.015 -12.292
  785   2HB   ARG  99          1HB       ARG  99  -8.623   6.869 -12.670
  786   1HG   ARG  99          2HG       ARG  99  -9.889   7.856 -10.673
  787   2HG   ARG  99          1HG       ARG  99  -8.693   9.152 -10.688
  788   1HD   ARG  99          2HD       ARG  99  -9.768   8.588 -13.351
  789   2HD   ARG  99          1HD       ARG  99 -11.020   9.076 -12.208
  790    HE   ARG  99           HE       ARG  99  -8.954  10.911 -11.827
  791   1HH1  ARG  99          2HH1      ARG  99 -11.719  10.503 -13.638
  792   2HH1  ARG  99          1HH1      ARG  99 -11.327  11.679 -14.848
  793   1HH2  ARG  99          1HH2      ARG  99  -8.074  12.128 -13.734
  794   2HH2  ARG  99          2HH2      ARG  99  -9.263  12.599 -14.903
  795    H    LEU 100           H        LEU 100  -7.217   5.745 -13.166
  796    HA   LEU 100           HA       LEU 100  -4.701   4.305 -12.448
  797   1HB   LEU 100          2HB       LEU 100  -5.423   3.142 -14.785
  798   2HB   LEU 100          1HB       LEU 100  -5.963   2.547 -13.217
  799    HG   LEU 100           HG       LEU 100  -7.968   4.104 -13.456
  800   1HD1  LEU 100          3HD1      LEU 100  -6.494   4.656 -15.942
  801   2HD1  LEU 100          2HD1      LEU 100  -8.209   4.324 -16.185
  802   3HD1  LEU 100          1HD1      LEU 100  -7.707   5.633 -15.114
  803   1HD2  LEU 100          3HD2      LEU 100  -7.750   1.564 -14.087
  804   2HD2  LEU 100          2HD2      LEU 100  -9.196   2.470 -14.528
  805   3HD2  LEU 100          1HD2      LEU 100  -7.945   2.167 -15.733
  806    H    VAL 101           H        VAL 101  -3.807   3.903 -15.155
  807    HA   VAL 101           HA       VAL 101  -2.326   6.195 -15.668
  808    HB   VAL 101           HB       VAL 101  -2.665   5.361 -18.208
  809   1HG1  VAL 101          2HG1      VAL 101  -0.642   5.273 -16.622
  810   2HG1  VAL 101          1HG1      VAL 101  -1.178   3.641 -16.223
  811   3HG1  VAL 101          3HG1      VAL 101  -0.721   4.038 -17.879
  812   1HG2  VAL 101          2HG2      VAL 101  -4.527   3.802 -17.188
  813   2HG2  VAL 101          1HG2      VAL 101  -3.431   3.175 -18.420
  814   3HG2  VAL 101          3HG2      VAL 101  -3.149   2.805 -16.719
  815    H    VAL 102           H        VAL 102  -3.271   8.173 -15.603
  816    HA   VAL 102           HA       VAL 102  -5.831   8.689 -16.917
  817    HB   VAL 102           HB       VAL 102  -4.092  10.932 -16.018
  818   1HG1  VAL 102          2HG1      VAL 102  -6.792  10.518 -16.649
  819   2HG1  VAL 102          1HG1      VAL 102  -6.759  10.701 -14.895
  820   3HG1  VAL 102          3HG1      VAL 102  -6.092  11.967 -15.927
  821   1HG2  VAL 102          1HG2      VAL 102  -5.196   8.781 -14.208
  822   2HG2  VAL 102          3HG2      VAL 102  -3.558   9.435 -14.248
  823   3HG2  VAL 102          2HG2      VAL 102  -4.886  10.418 -13.630
  824    HA   PRO 103           HA       PRO 103  -2.991  11.149 -19.864
  825   1HB   PRO 103          2HB       PRO 103  -0.279  10.781 -19.619
  826   2HB   PRO 103          1HB       PRO 103  -1.178  12.040 -18.760
  827   1HG   PRO 103          2HG       PRO 103  -0.033   9.494 -17.713
  828   2HG   PRO 103          1HG       PRO 103  -0.385  11.000 -16.852
  829   1HD   PRO 103          2HD       PRO 103  -1.960   8.631 -16.836
  830   2HD   PRO 103          1HD       PRO 103  -2.431  10.213 -16.186
  831    H    SER 104           H        SER 104  -1.421   8.055 -18.976
  832    HA   SER 104           HA       SER 104  -0.992   6.148 -20.275
  833   1HB   SER 104          2HB       SER 104  -3.282   7.467 -21.638
  834   2HB   SER 104          1HB       SER 104  -2.383   6.286 -22.588
  835    HG   SER 104           HG       SER 104  -3.513   5.879 -20.020
  836    H    HIS 105           H        HIS 105   0.412   5.545 -22.008
  837    HA   HIS 105           HA       HIS 105   1.959   7.798 -23.101
  838   1HB   HIS 105          2HB       HIS 105   3.525   6.084 -23.856
  839   2HB   HIS 105          1HB       HIS 105   3.082   5.766 -22.179
  840    HD1  HIS 105           HD1      HIS 105   3.976   3.282 -23.288
  841    HD2  HIS 105           HD2      HIS 105   0.123   4.615 -24.159
  842    HE1  HIS 105           HE1      HIS 105   2.665   1.248 -24.035
  843    H    LYS 106           HN       LYS 106  -0.533   7.922 -24.201
  844    HA   LYS 106           HA       LYS 106  -0.056   7.898 -26.975
  845   1HB   LYS 106          2HB       LYS 106  -0.156   5.385 -26.555
  846   2HB   LYS 106          1HB       LYS 106  -1.858   5.610 -26.155
  847   1HG   LYS 106          2HG       LYS 106  -1.245   6.981 -28.620
  848   2HG   LYS 106          1HG       LYS 106  -0.728   5.297 -28.730
  849   1HD   LYS 106          2HD       LYS 106  -3.188   5.104 -27.474
  850   2HD   LYS 106          1HD       LYS 106  -3.439   6.415 -28.628
  851   1HE   LYS 106          2HE       LYS 106  -3.928   4.137 -29.575
  852   2HE   LYS 106          1HE       LYS 106  -2.684   5.017 -30.463
  853   1HZ   LYS 106          1HZ       LYS 106  -1.890   3.249 -28.257
  854   2HZ   LYS 106          3HZ       LYS 106  -2.295   2.562 -29.754
  855   3HZ   LYS 106          2HZ       LYS 106  -1.026   3.687 -29.653
  856   1H    GLU 201          2HT       GLU 201   7.281  -0.865   7.598
  857   2H    GLU 201          1HT       GLU 201   8.914  -0.965   8.052
  858   3H    GLU 201          3HT       GLU 201   8.278   0.506   7.498
  859    HA   GLU 201           HA       GLU 201   8.954  -0.018   5.469
  860   1HB   GLU 201          2HB       GLU 201   9.950  -2.250   5.007
  861   2HB   GLU 201          1HB       GLU 201  10.601  -1.530   6.479
  862   1HG   GLU 201          2HG       GLU 201   9.883  -3.280   7.694
  863   2HG   GLU 201          1HG       GLU 201   8.230  -3.019   7.134
  864    HA   PRO 202           HA       PRO 202   4.791  -1.758   4.612
  865   1HB   PRO 202          2HB       PRO 202   3.930   0.440   3.202
  866   2HB   PRO 202          1HB       PRO 202   3.761   0.275   4.959
  867   1HG   PRO 202          2HG       PRO 202   5.669   1.963   3.408
  868   2HG   PRO 202          1HG       PRO 202   5.032   2.203   5.043
  869   1HD   PRO 202          2HD       PRO 202   7.599   1.199   4.393
  870   2HD   PRO 202          1HD       PRO 202   6.827   1.139   5.993
  871    H    GLN 203           H        GLN 203   3.698  -1.494   2.186
  872    HA   GLN 203           HA       GLN 203   5.708  -1.431   0.057
  873   1HB   GLN 203          2HB       GLN 203   4.860  -3.941   1.299
  874   2HB   GLN 203          1HB       GLN 203   4.567  -3.911  -0.440
  875   1HG   GLN 203          2HG       GLN 203   6.824  -3.653  -0.956
  876   2HG   GLN 203          1HG       GLN 203   7.206  -2.947   0.615
  877   1HE2  GLN 203          2HE2      GLN 203   8.387  -6.533   0.508
  878   2HE2  GLN 203          1HE2      GLN 203   8.668  -5.191  -0.492
  879   1HN   PTR 204          1HN       PTR 204   2.557  -3.038   0.512
  880    HA   PTR 204           HA       PTR 204   1.542  -1.434  -1.794
  881   1HB   PTR 204          1HB       PTR 204  -0.259  -3.225  -1.858
  882    HD1  PTR 204           HD1      PTR 204   1.262  -2.305  -3.898
  883    HD2  PTR 204           HD2      PTR 204   2.150  -5.714  -1.439
  884    HE1  PTR 204           HE1      PTR 204   2.728  -3.219  -5.683
  885    HE2  PTR 204           HE2      PTR 204   3.618  -6.620  -3.219
  886    H    GLU 205           H        GLU 205   0.575   0.374  -0.944
  887    HA   GLU 205           HA       GLU 205  -0.535   0.707   1.604
  888   1HB   GLU 205          2HB       GLU 205  -1.047   1.996  -1.054
  889   2HB   GLU 205          1HB       GLU 205  -2.117   2.378   0.294
  890   1HG   GLU 205          2HG       GLU 205   0.566   2.447   1.266
  891   2HG   GLU 205          1HG       GLU 205   0.505   3.396  -0.220
  892    H    GLU 206           H        GLU 206  -2.917   0.909   2.148
  893    HA   GLU 206           HA       GLU 206  -4.606  -1.017   0.627
  894   1HB   GLU 206          2HB       GLU 206  -3.860  -1.134   3.541
  895   2HB   GLU 206          1HB       GLU 206  -5.412  -1.772   2.998
  896   1HG   GLU 206          2HG       GLU 206  -4.451  -3.585   2.044
  897   2HG   GLU 206          1HG       GLU 206  -3.182  -2.615   1.296
  898    H    ILE 207           H        ILE 207  -6.568  -0.113   0.236
  899    HA   ILE 207           HA       ILE 207  -7.291   2.479   1.058
  900    HB   ILE 207           HB       ILE 207  -8.810   0.154  -0.075
  901   1HG1  ILE 207          2HG1      ILE 207  -9.316   2.118  -1.728
  902   2HG1  ILE 207          1HG1      ILE 207  -7.996   2.931  -0.888
  903   1HG2  ILE 207          2HG2      ILE 207 -10.007   2.642   1.150
  904   2HG2  ILE 207          1HG2      ILE 207 -10.806   1.798  -0.178
  905   3HG2  ILE 207          3HG2      ILE 207 -10.521   0.967   1.351
  906   1HD1  ILE 207          2HD1      ILE 207  -7.271   0.195  -1.514
  907   2HD1  ILE 207          1HD1      ILE 207  -7.758   1.060  -2.972
  908   3HD1  ILE 207          3HD1      ILE 207  -6.455   1.692  -1.965
  909    HA   PRO 208           HA       PRO 208  -9.828   0.534   4.611
  910   1HB   PRO 208          2HB       PRO 208  -9.387  -2.118   5.182
  911   2HB   PRO 208          1HB       PRO 208 -10.637  -1.554   4.059
  912   1HG   PRO 208          2HG       PRO 208  -8.025  -2.857   3.458
  913   2HG   PRO 208          1HG       PRO 208  -9.515  -2.837   2.501
  914   1HD   PRO 208          2HD       PRO 208  -7.216  -1.252   2.035
  915   2HD   PRO 208          1HD       PRO 208  -8.812  -1.029   1.290
  916    H    ILE 209           H        ILE 209  -8.832   1.396   6.398
  917    HA   ILE 209           HA       ILE 209  -6.455   0.002   7.504
  918    HB   ILE 209           HB       ILE 209  -6.582   2.967   6.876
  919   1HG1  ILE 209          2HG1      ILE 209  -5.973   1.408   5.003
  920   2HG1  ILE 209          1HG1      ILE 209  -4.665   2.503   5.451
  921   1HG2  ILE 209          2HG2      ILE 209  -4.908   1.355   8.742
  922   2HG2  ILE 209          1HG2      ILE 209  -4.079   2.583   7.783
  923   3HG2  ILE 209          3HG2      ILE 209  -5.406   3.044   8.851
  924   1HD1  ILE 209          3HD1      ILE 209  -3.779   0.669   6.958
  925   2HD1  ILE 209          2HD1      ILE 209  -4.966  -0.410   6.224
  926   3HD1  ILE 209          1HD1      ILE 209  -3.697   0.311   5.234
  927    H    TYR 210           H        TYR 210  -9.464   0.841   8.066
  928    HA   TYR 210           HA       TYR 210  -8.935   1.773  10.858
  929   1HB   TYR 210          2HB       TYR 210 -11.580   2.306  10.491
  930   2HB   TYR 210          1HB       TYR 210 -10.301   3.482  10.199
  931    HD1  TYR 210           HD1      TYR 210 -12.291   0.795   8.522
  932    HD2  TYR 210           HD2      TYR 210  -9.978   4.383   8.046
  933    HE1  TYR 210           HE1      TYR 210 -12.927   0.887   6.127
  934    HE2  TYR 210           HE2      TYR 210 -10.614   4.475   5.652
  935    HH   TYR 210           HH       TYR 210 -11.366   2.637   3.879
  936    H    LEU 211           HN       LEU 211 -11.141   1.131  12.178
  937    HA   LEU 211           HA       LEU 211 -11.579  -1.777  11.622
  938   1HB   LEU 211          2HB       LEU 211 -11.378  -0.394  14.316
  939   2HB   LEU 211          1HB       LEU 211 -11.718  -2.107  14.069
  940    HG   LEU 211           HG       LEU 211  -9.192  -0.643  13.248
  941   1HD1  LEU 211          2HD1      LEU 211  -9.971  -1.814  15.693
  942   2HD1  LEU 211          1HD1      LEU 211  -8.879  -2.973  14.935
  943   3HD1  LEU 211          3HD1      LEU 211  -8.346  -1.317  15.224
  944   1HD2  LEU 211          2HD2      LEU 211 -10.410  -3.110  12.308
  945   2HD2  LEU 211          1HD2      LEU 211  -8.979  -2.275  11.705
  946   3HD2  LEU 211          3HD2      LEU 211  -8.837  -3.416  13.043
   
  No H/Q in entry =         946
  Start of MODEL   13
    1   1H    SER   1          3HT       SER   1  -3.581 -10.079 -25.537
    2   2H    SER   1          2HT       SER   1  -2.353 -11.023 -24.839
    3   3H    SER   1          1HT       SER   1  -3.892 -10.962 -24.122
    4    HA   SER   1           HA       SER   1  -2.400  -9.598 -22.855
    5   1HB   SER   1          2HB       SER   1  -1.675  -8.695 -25.595
    6   2HB   SER   1          1HB       SER   1  -1.695  -7.454 -24.342
    7    HG   SER   1           HG       SER   1   0.163  -9.265 -24.801
    8    H    ILE   2           H        ILE   2  -3.972  -8.633 -21.667
    9    HA   ILE   2           HA       ILE   2  -6.449  -7.711 -22.487
   10    HB   ILE   2           HB       ILE   2  -6.062  -5.948 -20.520
   11   1HG1  ILE   2          2HG1      ILE   2  -3.955  -8.008 -19.863
   12   2HG1  ILE   2          1HG1      ILE   2  -3.528  -6.514 -20.698
   13   1HG2  ILE   2          3HG2      ILE   2  -6.228  -8.962 -20.297
   14   2HG2  ILE   2          2HG2      ILE   2  -6.435  -7.890 -18.913
   15   3HG2  ILE   2          1HG2      ILE   2  -7.557  -7.804 -20.271
   16   1HD1  ILE   2          2HD1      ILE   2  -5.270  -6.169 -18.332
   17   2HD1  ILE   2          1HD1      ILE   2  -3.647  -6.761 -17.980
   18   3HD1  ILE   2          3HD1      ILE   2  -3.862  -5.235 -18.839
   19    H    GLN   3           H        GLN   3  -4.459  -5.045 -21.386
   20    HA   GLN   3           HA       GLN   3  -5.365  -3.462 -23.689
   21   1HB   GLN   3          2HB       GLN   3  -5.382  -2.400 -21.501
   22   2HB   GLN   3          1HB       GLN   3  -3.667  -2.745 -21.281
   23   1HG   GLN   3          2HG       GLN   3  -3.417  -0.625 -22.101
   24   2HG   GLN   3          1HG       GLN   3  -3.596  -1.429 -23.660
   25   1HE2  GLN   3          2HE2      GLN   3  -7.317  -0.542 -23.290
   26   2HE2  GLN   3          1HE2      GLN   3  -6.519  -2.020 -23.051
   27    H    ALA   4           H        ALA   4  -2.184  -2.778 -22.457
   28    HA   ALA   4           HA       ALA   4  -0.673  -4.273 -24.384
   29   1HB   ALA   4          2HB       ALA   4  -1.811  -1.668 -25.195
   30   2HB   ALA   4          1HB       ALA   4  -0.101  -1.897 -25.564
   31   3HB   ALA   4          3HB       ALA   4  -1.300  -3.030 -26.191
   32    H    GLU   5           H        GLU   5  -0.923  -1.457 -22.272
   33    HA   GLU   5           HA       GLU   5   1.343  -1.911 -20.751
   34   1HB   GLU   5          2HB       GLU   5   2.965  -0.238 -21.892
   35   2HB   GLU   5          1HB       GLU   5   2.852  -1.865 -22.562
   36   1HG   GLU   5          2HG       GLU   5   0.805  -0.295 -23.775
   37   2HG   GLU   5          1HG       GLU   5   2.301   0.632 -23.857
   38    H    GLU   6           H        GLU   6  -0.756   0.387 -22.304
   39    HA   GLU   6           HA       GLU   6  -0.118   2.808 -21.114
   40   1HB   GLU   6          2HB       GLU   6  -2.710   1.505 -21.836
   41   2HB   GLU   6          1HB       GLU   6  -2.761   2.991 -20.889
   42   1HG   GLU   6          2HG       GLU   6  -0.957   3.727 -22.753
   43   2HG   GLU   6          1HG       GLU   6  -1.883   2.562 -23.700
   44    H    TRP   7           H        TRP   7  -2.432   0.511 -19.667
   45    HA   TRP   7           HA       TRP   7  -1.579   1.522 -16.983
   46   1HB   TRP   7          2HB       TRP   7  -3.885   0.814 -16.244
   47   2HB   TRP   7          1HB       TRP   7  -3.883   2.140 -17.408
   48    HD1  TRP   7           HD1      TRP   7  -4.901   1.713 -19.766
   49    HE1  TRP   7           HE1      TRP   7  -6.207  -0.249 -20.810
   50    HE3  TRP   7           HE3      TRP   7  -4.087  -1.877 -16.224
   51    HZ2  TRP   7           HZ2      TRP   7  -6.819  -2.980 -20.224
   52    HZ3  TRP   7           HZ3      TRP   7  -5.034  -4.150 -16.496
   53    HH2  TRP   7           HH2      TRP   7  -6.402  -4.704 -18.490
   54    H    TYR   8           H        TYR   8  -0.938  -0.912 -18.895
   55    HA   TYR   8           HA       TYR   8  -0.579  -2.815 -16.692
   56   1HB   TYR   8          2HB       TYR   8  -2.675  -3.627 -17.222
   57   2HB   TYR   8          1HB       TYR   8  -2.538  -3.209 -18.926
   58    HD1  TYR   8           HD1      TYR   8  -1.264  -4.658 -20.477
   59    HD2  TYR   8           HD2      TYR   8  -1.822  -5.713 -16.352
   60    HE1  TYR   8           HE1      TYR   8  -0.580  -6.988 -20.979
   61    HE2  TYR   8           HE2      TYR   8  -1.125  -8.034 -16.853
   62    HH   TYR   8           HH       TYR   8  -0.563  -9.112 -20.164
   63    H    PHE   9           H        PHE   9   1.597  -2.744 -17.013
   64    HA   PHE   9           HA       PHE   9   2.884  -2.743 -19.569
   65   1HB   PHE   9          2HB       PHE   9   3.768  -3.257 -16.744
   66   2HB   PHE   9          1HB       PHE   9   4.883  -3.539 -18.080
   67    HD1  PHE   9           HD1      PHE   9   2.217  -0.966 -18.196
   68    HD2  PHE   9           HD2      PHE   9   6.400  -1.713 -17.501
   69    HE1  PHE   9           HE1      PHE   9   2.679   1.465 -18.323
   70    HE2  PHE   9           HE2      PHE   9   6.851   0.721 -17.629
   71    HZ   PHE   9           HZ       PHE   9   4.993   2.309 -18.040
   72    H    GLY  10           H        GLY  10   2.025  -5.352 -17.325
   73   1HA   GLY  10          2HA       GLY  10   1.464  -7.421 -18.881
   74   2HA   GLY  10          1HA       GLY  10   3.185  -7.320 -19.221
   75    H    LYS  11           H        LYS  11   4.106  -8.977 -18.147
   76    HA   LYS  11           HA       LYS  11   3.304  -9.446 -15.316
   77   1HB   LYS  11          2HB       LYS  11   4.825 -11.407 -17.039
   78   2HB   LYS  11          1HB       LYS  11   3.902 -11.730 -15.572
   79   1HG   LYS  11          2HG       LYS  11   2.063 -12.125 -16.808
   80   2HG   LYS  11          1HG       LYS  11   2.155 -10.495 -17.474
   81   1HD   LYS  11          2HD       LYS  11   4.113 -11.660 -18.917
   82   2HD   LYS  11          1HD       LYS  11   3.100 -13.073 -18.625
   83   1HE   LYS  11          2HE       LYS  11   1.318 -12.216 -19.829
   84   2HE   LYS  11          1HE       LYS  11   1.763 -10.542 -19.493
   85   1HZ   LYS  11          2HZ       LYS  11   3.877 -11.445 -20.901
   86   2HZ   LYS  11          1HZ       LYS  11   2.590 -12.266 -21.645
   87   3HZ   LYS  11          3HZ       LYS  11   2.576 -10.573 -21.557
   88    H    LEU  12           H        LEU  12   4.773  -7.538 -14.994
   89    HA   LEU  12           HA       LEU  12   7.625  -8.426 -14.933
   90   1HB   LEU  12          2HB       LEU  12   8.185  -6.523 -15.999
   91   2HB   LEU  12          1HB       LEU  12   6.472  -6.210 -16.227
   92    HG   LEU  12           HG       LEU  12   8.215  -5.214 -13.966
   93   1HD1  LEU  12          3HD1      LEU  12   6.873  -3.992 -16.368
   94   2HD1  LEU  12          2HD1      LEU  12   7.225  -3.004 -14.947
   95   3HD1  LEU  12          1HD1      LEU  12   8.539  -3.802 -15.817
   96   1HD2  LEU  12          2HD2      LEU  12   5.323  -5.586 -14.123
   97   2HD2  LEU  12          1HD2      LEU  12   6.347  -5.211 -12.734
   98   3HD2  LEU  12          3HD2      LEU  12   5.791  -3.915 -13.790
   99    H    GLY  13           H        GLY  13   8.748  -6.716 -13.151
  100   1HA   GLY  13          2HA       GLY  13   7.278  -7.395 -10.662
  101   2HA   GLY  13          1HA       GLY  13   8.981  -6.949 -10.756
  102    H    ARG  14           H        ARG  14   6.886  -5.765  -9.038
  103    HA   ARG  14           HA       ARG  14   6.015  -3.241 -10.050
  104   1HB   ARG  14          2HB       ARG  14   5.542  -2.666  -7.788
  105   2HB   ARG  14          1HB       ARG  14   5.323  -4.412  -7.864
  106   1HG   ARG  14          2HG       ARG  14   6.646  -4.200  -5.955
  107   2HG   ARG  14          1HG       ARG  14   7.869  -4.473  -7.196
  108   1HD   ARG  14          2HD       ARG  14   8.718  -2.382  -6.968
  109   2HD   ARG  14          1HD       ARG  14   7.116  -1.648  -6.905
  110    HE   ARG  14           HE       ARG  14   7.181  -1.804  -4.535
  111   1HH1  ARG  14          2HH1      ARG  14   8.642  -4.633  -5.222
  112   2HH1  ARG  14          1HH1      ARG  14   9.972  -4.472  -4.124
  113   1HH2  ARG  14          1HH2      ARG  14   9.366  -1.122  -3.463
  114   2HH2  ARG  14          2HH2      ARG  14  10.381  -2.485  -3.129
  115    H    LYS  15           H        LYS  15   9.080  -4.397  -8.988
  116    HA   LYS  15           HA       LYS  15  10.282  -1.840  -8.449
  117   1HB   LYS  15          2HB       LYS  15  11.136  -4.059  -7.586
  118   2HB   LYS  15          1HB       LYS  15  11.662  -4.415  -9.232
  119   1HG   LYS  15          2HG       LYS  15  13.346  -2.832  -9.182
  120   2HG   LYS  15          1HG       LYS  15  12.486  -1.801  -8.039
  121   1HD   LYS  15          2HD       LYS  15  13.655  -2.710  -6.344
  122   2HD   LYS  15          1HD       LYS  15  13.002  -4.298  -6.750
  123   1HE   LYS  15          2HE       LYS  15  14.944  -4.953  -7.708
  124   2HE   LYS  15          1HE       LYS  15  15.095  -3.444  -8.606
  125   1HZ   LYS  15          3HZ       LYS  15  15.596  -3.476  -5.708
  126   2HZ   LYS  15          2HZ       LYS  15  16.805  -4.015  -6.774
  127   3HZ   LYS  15          1HZ       LYS  15  16.210  -2.427  -6.890
  128    H    ASP  16           H        ASP  16   9.780  -3.869 -11.251
  129    HA   ASP  16           HA       ASP  16  11.639  -2.513 -12.948
  130   1HB   ASP  16          2HB       ASP  16  10.281  -4.840 -13.107
  131   2HB   ASP  16          1HB       ASP  16   9.232  -3.803 -14.042
  132    H    ALA  17           H        ALA  17   8.244  -2.218 -12.113
  133    HA   ALA  17           HA       ALA  17   7.522  -0.324 -14.119
  134   1HB   ALA  17          3HB       ALA  17   6.376  -0.816 -11.361
  135   2HB   ALA  17          2HB       ALA  17   5.623   0.215 -12.577
  136   3HB   ALA  17          1HB       ALA  17   5.808  -1.514 -12.878
  137    H    GLU  18           H        GLU  18   8.898   0.019 -10.880
  138    HA   GLU  18           HA       GLU  18   8.684   2.879 -10.738
  139   1HB   GLU  18          2HB       GLU  18  11.032   1.451  -9.532
  140   2HB   GLU  18          1HB       GLU  18  10.044   2.743  -8.851
  141   1HG   GLU  18          2HG       GLU  18   8.128   0.957  -8.934
  142   2HG   GLU  18          1HG       GLU  18   9.457  -0.200  -9.019
  143    H    ARG  19           H        ARG  19  11.303   0.733 -11.851
  144    HA   ARG  19           HA       ARG  19  13.056   2.872 -12.653
  145   1HB   ARG  19          2HB       ARG  19  13.273   0.125 -12.443
  146   2HB   ARG  19          1HB       ARG  19  13.305   0.381 -14.188
  147   1HG   ARG  19          2HG       ARG  19  14.927   2.342 -12.748
  148   2HG   ARG  19          1HG       ARG  19  15.464   0.687 -12.459
  149   1HD   ARG  19          2HD       ARG  19  15.536   0.287 -14.897
  150   2HD   ARG  19          1HD       ARG  19  15.007   1.945 -15.182
  151    HE   ARG  19           HE       ARG  19  17.622   1.246 -13.905
  152   1HH1  ARG  19          1HH2      ARG  19  17.968   3.750 -13.338
  153   2HH1  ARG  19          2HH2      ARG  19  18.131   4.687 -14.786
  154   1HH2  ARG  19          2HH1      ARG  19  16.784   2.237 -16.838
  155   2HH2  ARG  19          1HH1      ARG  19  17.461   3.830 -16.767
  156    H    GLN  20           H        GLN  20  10.281   1.391 -14.143
  157    HA   GLN  20           HA       GLN  20  10.958   2.282 -16.845
  158   1HB   GLN  20          2HB       GLN  20   9.007   0.565 -15.660
  159   2HB   GLN  20          1HB       GLN  20   8.146   1.818 -16.554
  160   1HG   GLN  20          2HG       GLN  20   8.556   0.503 -18.366
  161   2HG   GLN  20          1HG       GLN  20  10.175   1.199 -18.294
  162   1HE2  GLN  20          2HE2      GLN  20   9.623  -2.585 -16.750
  163   2HE2  GLN  20          1HE2      GLN  20   8.322  -1.494 -16.742
  164    H    LEU  21           H        LEU  21   8.099   3.115 -14.863
  165    HA   LEU  21           HA       LEU  21   7.342   5.447 -16.126
  166   1HB   LEU  21          2HB       LEU  21   7.447   5.139 -13.114
  167   2HB   LEU  21          1HB       LEU  21   6.354   6.176 -14.032
  168    HG   LEU  21           HG       LEU  21   6.430   3.146 -14.013
  169   1HD1  LEU  21          1HD1      LEU  21   5.194   4.673 -12.243
  170   2HD1  LEU  21          3HD1      LEU  21   4.018   4.864 -13.542
  171   3HD1  LEU  21          2HD1      LEU  21   4.383   3.258 -12.913
  172   1HD2  LEU  21          2HD2      LEU  21   5.437   5.065 -16.025
  173   2HD2  LEU  21          1HD2      LEU  21   5.808   3.349 -16.193
  174   3HD2  LEU  21          3HD2      LEU  21   4.256   3.854 -15.525
  175    H    LEU  22           H        LEU  22   9.600   5.376 -13.353
  176    HA   LEU  22           HA       LEU  22  10.367   8.091 -13.476
  177   1HB   LEU  22          2HB       LEU  22  12.117   5.728 -12.718
  178   2HB   LEU  22          1HB       LEU  22  12.400   7.411 -12.275
  179    HG   LEU  22           HG       LEU  22  10.149   5.604 -11.372
  180   1HD1  LEU  22          3HD1      LEU  22  12.410   7.106 -10.059
  181   2HD1  LEU  22          2HD1      LEU  22  10.997   6.599  -9.133
  182   3HD1  LEU  22          1HD1      LEU  22  12.008   5.394  -9.931
  183   1HD2  LEU  22          3HD2      LEU  22  10.221   8.539 -11.684
  184   2HD2  LEU  22          2HD2      LEU  22   8.840   7.454 -11.543
  185   3HD2  LEU  22          1HD2      LEU  22   9.703   7.976 -10.097
  186    H    SER  23           H        SER  23  11.744   5.273 -15.168
  187    HA   SER  23           HA       SER  23  13.580   7.038 -16.666
  188   1HB   SER  23          2HB       SER  23  13.132   4.067 -17.050
  189   2HB   SER  23          1HB       SER  23  14.532   5.017 -17.548
  190    HG   SER  23           HG       SER  23  15.185   5.181 -15.494
  191    H    PHE  24           H        PHE  24  10.743   7.455 -17.046
  192    HA   PHE  24           HA       PHE  24  10.467   6.578 -19.894
  193   1HB   PHE  24          2HB       PHE  24   8.714   6.120 -17.762
  194   2HB   PHE  24          1HB       PHE  24   7.987   7.461 -18.647
  195    HD1  PHE  24           HD1      PHE  24  10.064   4.582 -19.842
  196    HD2  PHE  24           HD2      PHE  24   6.251   6.558 -19.945
  197    HE1  PHE  24           HE1      PHE  24   9.295   3.006 -21.596
  198    HE2  PHE  24           HE2      PHE  24   5.483   4.983 -21.699
  199    HZ   PHE  24           HZ       PHE  24   7.003   3.206 -22.524
  200    H    GLY  25           H        GLY  25   8.178   8.380 -20.265
  201   1HA   GLY  25          2HA       GLY  25   9.566  11.022 -20.078
  202   2HA   GLY  25          1HA       GLY  25   8.772  10.511 -21.566
  203    H    ASN  26           H        ASN  26   7.180   9.466 -18.726
  204    HA   ASN  26           HA       ASN  26   5.214  11.698 -19.030
  205   1HB   ASN  26          2HB       ASN  26   4.892   8.763 -18.843
  206   2HB   ASN  26          1HB       ASN  26   3.771   9.702 -17.858
  207   1HD2  ASN  26          2HD2      ASN  26   3.698  10.391 -21.924
  208   2HD2  ASN  26          1HD2      ASN  26   5.182  10.049 -21.175
  209    HA   PRO  27           HA       PRO  27   6.102  12.496 -14.774
  210   1HB   PRO  27          2HB       PRO  27   4.057  14.284 -14.354
  211   2HB   PRO  27          1HB       PRO  27   5.548  14.688 -15.218
  212   1HG   PRO  27          2HG       PRO  27   2.810  14.197 -16.306
  213   2HG   PRO  27          1HG       PRO  27   4.124  15.174 -16.980
  214   1HD   PRO  27          2HD       PRO  27   3.381  12.561 -17.811
  215   2HD   PRO  27          1HD       PRO  27   4.866  13.421 -18.263
  216    H    ARG  28           H        ARG  28   4.439  12.887 -12.720
  217    HA   ARG  28           HA       ARG  28   3.450  10.426 -11.920
  218   1HB   ARG  28          2HB       ARG  28   2.158  11.591 -10.241
  219   2HB   ARG  28          1HB       ARG  28   3.649  12.499 -10.493
  220   1HG   ARG  28          2HG       ARG  28   2.388  13.949 -12.131
  221   2HG   ARG  28          1HG       ARG  28   0.911  13.127 -11.630
  222   1HD   ARG  28          2HD       ARG  28   0.775  14.366  -9.750
  223   2HD   ARG  28          1HD       ARG  28   2.450  14.005  -9.327
  224    HE   ARG  28           HE       ARG  28   3.108  16.048 -10.349
  225   1HH1  ARG  28          2HH1      ARG  28   1.338  15.578 -12.819
  226   2HH1  ARG  28          1HH1      ARG  28   0.283  16.949 -12.722
  227   1HH2  ARG  28          1HH2      ARG  28   1.098  17.677  -9.431
  228   2HH2  ARG  28          2HH2      ARG  28   0.147  18.137 -10.805
  229    H    GLY  29           H        GLY  29   1.017   9.906 -11.525
  230   1HA   GLY  29          2HA       GLY  29  -1.237   9.873 -12.349
  231   2HA   GLY  29          1HA       GLY  29  -0.736  10.892 -13.696
  232    H    THR  30           H        THR  30   1.587   8.570 -13.476
  233    HA   THR  30           HA       THR  30   0.297   6.996 -15.633
  234    HB   THR  30           HB       THR  30   3.086   6.365 -14.964
  235    HG1  THR  30           HG1      THR  30   2.365   8.967 -15.833
  236   1HG2  THR  30          1HG2      THR  30   1.418   7.020 -17.369
  237   2HG2  THR  30          3HG2      THR  30   3.176   7.090 -17.495
  238   3HG2  THR  30          2HG2      THR  30   2.384   5.582 -17.040
  239    H    PHE  31           H        PHE  31  -1.068   5.930 -13.897
  240    HA   PHE  31           HA       PHE  31   0.386   4.002 -12.204
  241   1HB   PHE  31          2HB       PHE  31  -2.597   4.029 -12.456
  242   2HB   PHE  31          1HB       PHE  31  -1.604   3.707 -11.037
  243    HD1  PHE  31           HD1      PHE  31   0.282   6.089 -11.330
  244    HD2  PHE  31           HD2      PHE  31  -3.990   5.776 -11.576
  245    HE1  PHE  31           HE1      PHE  31   0.072   8.457 -10.635
  246    HE2  PHE  31           HE2      PHE  31  -4.201   8.150 -10.886
  247    HZ   PHE  31           HZ       PHE  31  -2.172   9.487 -10.413
  248    H    LEU  32           H        LEU  32   1.119   2.243 -13.259
  249    HA   LEU  32           HA       LEU  32  -0.545   1.104 -15.454
  250   1HB   LEU  32          2HB       LEU  32   1.489  -0.079 -16.135
  251   2HB   LEU  32          1HB       LEU  32   1.819   1.645 -15.972
  252    HG   LEU  32           HG       LEU  32   2.489   1.015 -13.516
  253   1HD1  LEU  32          3HD1      LEU  32   2.326  -1.619 -14.932
  254   2HD1  LEU  32          2HD1      LEU  32   3.625  -1.371 -13.765
  255   3HD1  LEU  32          1HD1      LEU  32   1.943  -1.226 -13.256
  256   1HD2  LEU  32          2HD2      LEU  32   3.895   1.468 -15.834
  257   2HD2  LEU  32          1HD2      LEU  32   4.628   1.282 -14.241
  258   3HD2  LEU  32          3HD2      LEU  32   4.527  -0.101 -15.332
  259    H    ILE  33           H        ILE  33  -0.162  -1.401 -15.609
  260    HA   ILE  33           HA       ILE  33  -0.676  -2.557 -12.900
  261    HB   ILE  33           HB       ILE  33  -1.986  -3.087 -15.570
  262   1HG1  ILE  33          2HG1      ILE  33  -2.944  -2.442 -12.772
  263   2HG1  ILE  33          1HG1      ILE  33  -3.080  -1.430 -14.210
  264   1HG2  ILE  33          2HG2      ILE  33  -2.078  -4.867 -13.119
  265   2HG2  ILE  33          1HG2      ILE  33  -3.067  -5.060 -14.565
  266   3HG2  ILE  33          3HG2      ILE  33  -1.321  -5.278 -14.654
  267   1HD1  ILE  33          1HD1      ILE  33  -4.248  -3.969 -14.808
  268   2HD1  ILE  33          3HD1      ILE  33  -4.911  -3.415 -13.270
  269   3HD1  ILE  33          2HD1      ILE  33  -5.048  -2.400 -14.706
  270    H    ARG  34           H        ARG  34  -0.203  -5.016 -12.928
  271    HA   ARG  34           HA       ARG  34   1.529  -6.208 -14.834
  272   1HB   ARG  34          2HB       ARG  34   3.666  -5.995 -13.353
  273   2HB   ARG  34          1HB       ARG  34   3.242  -4.651 -14.412
  274   1HG   ARG  34          2HG       ARG  34   2.919  -3.269 -12.657
  275   2HG   ARG  34          1HG       ARG  34   1.891  -4.447 -11.842
  276   1HD   ARG  34          2HD       ARG  34   4.924  -4.386 -11.819
  277   2HD   ARG  34          1HD       ARG  34   3.860  -4.006 -10.466
  278    HE   ARG  34           HE       ARG  34   3.616  -6.716 -11.631
  279   1HH1  ARG  34          2HH1      ARG  34   3.231  -5.044  -8.839
  280   2HH1  ARG  34          1HH1      ARG  34   4.157  -6.100  -7.827
  281   1HH2  ARG  34          1HH2      ARG  34   5.486  -7.907 -10.467
  282   2HH2  ARG  34          2HH2      ARG  34   5.433  -7.718  -8.747
  283    H    GLU  35           H        GLU  35   2.407  -8.258 -14.033
  284    HA   GLU  35           HA       GLU  35   0.707  -9.457 -12.020
  285   1HB   GLU  35          2HB       GLU  35   2.905 -10.360 -13.818
  286   2HB   GLU  35          1HB       GLU  35   2.518 -11.361 -12.428
  287   1HG   GLU  35          2HG       GLU  35   0.097 -11.238 -13.136
  288   2HG   GLU  35          1HG       GLU  35   0.645 -10.453 -14.620
  289    H    SER  36           H        SER  36   1.125  -9.786  -9.882
  290    HA   SER  36           HA       SER  36   3.556  -8.630  -8.726
  291   1HB   SER  36          2HB       SER  36   1.249 -10.120  -7.437
  292   2HB   SER  36          1HB       SER  36   2.527  -9.277  -6.577
  293    HG   SER  36           HG       SER  36   1.149  -7.867  -8.535
  294    H    GLU  37           H        GLU  37   5.386  -9.804  -8.408
  295    HA   GLU  37           HA       GLU  37   5.278 -12.745  -8.665
  296   1HB   GLU  37          2HB       GLU  37   7.565 -10.799  -8.289
  297   2HB   GLU  37          1HB       GLU  37   7.771 -12.545  -8.418
  298   1HG   GLU  37          2HG       GLU  37   6.139 -11.243 -10.538
  299   2HG   GLU  37          1HG       GLU  37   7.869 -10.906 -10.564
  300    H    THR  38           H        THR  38   4.400 -10.855  -6.292
  301    HA   THR  38           HA       THR  38   6.050 -11.744  -4.073
  302    HB   THR  38           HB       THR  38   4.540  -9.624  -4.259
  303    HG1  THR  38           HG1      THR  38   5.593 -10.073  -2.373
  304   1HG2  THR  38          1HG2      THR  38   2.530 -11.686  -3.318
  305   2HG2  THR  38          3HG2      THR  38   2.280  -9.939  -3.311
  306   3HG2  THR  38          2HG2      THR  38   2.465 -10.798  -4.840
  307    H    THR  39           H        THR  39   2.890 -12.603  -5.401
  308    HA   THR  39           HA       THR  39   2.904 -15.007  -3.609
  309    HB   THR  39           HB       THR  39   0.931 -13.298  -3.648
  310    HG1  THR  39           HG1      THR  39  -0.049 -14.900  -2.740
  311   1HG2  THR  39          3HG2      THR  39   0.947 -13.711  -6.308
  312   2HG2  THR  39          2HG2      THR  39  -0.191 -14.972  -5.832
  313   3HG2  THR  39          1HG2      THR  39  -0.517 -13.289  -5.421
  314    H    LYS  40           H        LYS  40   1.317 -16.751  -4.946
  315    HA   LYS  40           HA       LYS  40   2.917 -18.075  -6.755
  316   1HB   LYS  40          2HB       LYS  40  -0.057 -17.908  -7.214
  317   2HB   LYS  40          1HB       LYS  40   1.006 -19.297  -7.435
  318   1HG   LYS  40          2HG       LYS  40   1.441 -19.097  -4.888
  319   2HG   LYS  40          1HG       LYS  40   0.002 -18.079  -4.868
  320   1HD   LYS  40          2HD       LYS  40  -1.365 -19.868  -5.071
  321   2HD   LYS  40          1HD       LYS  40  -0.423 -20.513  -6.415
  322   1HE   LYS  40          2HE       LYS  40   0.932 -21.787  -5.032
  323   2HE   LYS  40          1HE       LYS  40   0.729 -20.701  -3.658
  324   1HZ   LYS  40          2HZ       LYS  40  -1.740 -21.498  -3.869
  325   2HZ   LYS  40          1HZ       LYS  40  -1.021 -22.848  -4.608
  326   3HZ   LYS  40          3HZ       LYS  40  -0.594 -22.424  -3.022
  327    H    GLY  41           H        GLY  41   0.729 -15.403  -7.385
  328   1HA   GLY  41          2HA       GLY  41   2.071 -14.138  -9.400
  329   2HA   GLY  41          1HA       GLY  41   1.212 -15.419 -10.260
  330    H    ALA  42           H        ALA  42   0.660 -12.805  -7.919
  331    HA   ALA  42           HA       ALA  42  -2.199 -12.653  -8.624
  332   1HB   ALA  42          3HB       ALA  42  -0.490 -11.756  -6.456
  333   2HB   ALA  42          2HB       ALA  42  -1.460 -10.422  -7.074
  334   3HB   ALA  42          1HB       ALA  42  -2.249 -11.891  -6.495
  335    H    TYR  43           H        TYR  43  -2.463  -9.832  -8.494
  336    HA   TYR  43           HA       TYR  43  -0.973  -9.059 -10.958
  337   1HB   TYR  43          2HB       TYR  43  -3.802  -9.121 -10.479
  338   2HB   TYR  43          1HB       TYR  43  -3.288  -7.451 -10.733
  339    HD1  TYR  43           HD1      TYR  43  -1.119  -7.515 -12.566
  340    HD2  TYR  43           HD2      TYR  43  -4.599 -10.048 -12.463
  341    HE1  TYR  43           HE1      TYR  43  -0.864  -7.991 -14.997
  342    HE2  TYR  43           HE2      TYR  43  -4.338 -10.517 -14.881
  343    HH   TYR  43           HH       TYR  43  -1.856 -10.305 -16.533
  344    H    SER  44           H        SER  44  -1.345  -6.408 -11.087
  345    HA   SER  44           HA       SER  44  -1.022  -5.179  -8.446
  346   1HB   SER  44          2HB       SER  44   1.185  -5.999  -8.604
  347   2HB   SER  44          1HB       SER  44   1.268  -5.623 -10.326
  348    HG   SER  44           HG       SER  44   2.058  -3.784  -9.742
  349    H    LEU  45           H        LEU  45  -0.399  -2.858  -8.696
  350    HA   LEU  45           HA       LEU  45  -1.016  -1.651 -11.319
  351   1HB   LEU  45          2HB       LEU  45  -3.243  -1.828 -10.345
  352   2HB   LEU  45          1HB       LEU  45  -2.675  -1.106  -8.839
  353    HG   LEU  45           HG       LEU  45  -2.122   0.978 -10.037
  354   1HD1  LEU  45          2HD1      LEU  45  -2.313  -0.742 -12.306
  355   2HD1  LEU  45          1HD1      LEU  45  -3.526   0.526 -12.489
  356   3HD1  LEU  45          3HD1      LEU  45  -1.830   0.953 -12.266
  357   1HD2  LEU  45          1HD2      LEU  45  -4.851  -0.184 -10.027
  358   2HD2  LEU  45          3HD2      LEU  45  -4.255   1.297  -9.279
  359   3HD2  LEU  45          2HD2      LEU  45  -4.632   1.270 -11.002
  360    H    SER  46           H        SER  46   1.125  -0.840 -11.235
  361    HA   SER  46           HA       SER  46   2.143   0.590  -8.940
  362   1HB   SER  46          2HB       SER  46   3.746  -0.364 -10.445
  363   2HB   SER  46          1HB       SER  46   3.058   0.507 -11.811
  364    HG   SER  46           HG       SER  46   4.970   1.304 -10.216
  365    H    ILE  47           H        ILE  47   2.825   2.866  -9.087
  366    HA   ILE  47           HA       ILE  47   1.084   4.553 -10.774
  367    HB   ILE  47           HB       ILE  47  -0.053   5.614  -9.088
  368   1HG1  ILE  47          2HG1      ILE  47   2.043   4.830  -7.041
  369   2HG1  ILE  47          1HG1      ILE  47   2.106   6.339  -7.952
  370   1HG2  ILE  47          3HG2      ILE  47  -0.463   3.114  -8.981
  371   2HG2  ILE  47          2HG2      ILE  47   0.627   3.074  -7.595
  372   3HG2  ILE  47          1HG2      ILE  47  -0.869   4.006  -7.513
  373   1HD1  ILE  47          3HD1      ILE  47  -0.364   5.548  -6.417
  374   2HD1  ILE  47          2HD1      ILE  47   0.967   6.405  -5.638
  375   3HD1  ILE  47          1HD1      ILE  47   0.111   7.148  -6.990
  376    H    ARG  48           H        ARG  48   2.247   6.163 -11.663
  377    HA   ARG  48           HA       ARG  48   4.962   6.698 -10.627
  378   1HB   ARG  48          2HB       ARG  48   4.758   6.570 -13.037
  379   2HB   ARG  48          1HB       ARG  48   3.416   7.714 -13.037
  380   1HG   ARG  48          2HG       ARG  48   5.360   8.956 -13.687
  381   2HG   ARG  48          1HG       ARG  48   5.020   9.408 -12.017
  382   1HD   ARG  48          2HD       ARG  48   6.869   8.312 -11.199
  383   2HD   ARG  48          1HD       ARG  48   6.814   7.070 -12.449
  384    HE   ARG  48           HE       ARG  48   8.488   8.378 -13.466
  385   1HH1  ARG  48          2HH1      ARG  48   6.696  10.411 -11.421
  386   2HH1  ARG  48          1HH1      ARG  48   7.039  11.862 -12.301
  387   1HH2  ARG  48          1HH2      ARG  48   8.655  10.223 -14.894
  388   2HH2  ARG  48          2HH2      ARG  48   8.148  11.756 -14.268
  389    H    ASP  49           H        ASP  49   5.364   8.389  -9.243
  390    HA   ASP  49           HA       ASP  49   3.554  10.731  -9.333
  391   1HB   ASP  49          2HB       ASP  49   2.485   9.326  -7.675
  392   2HB   ASP  49          1HB       ASP  49   4.022   9.055  -6.854
  393    H    TRP  50           H        TRP  50   5.376  11.950 -10.039
  394    HA   TRP  50           HA       TRP  50   7.801  12.008  -8.356
  395   1HB   TRP  50          2HB       TRP  50   8.347  12.287 -10.640
  396   2HB   TRP  50          1HB       TRP  50   6.953  13.320 -10.940
  397    HD1  TRP  50           HD1      TRP  50  10.569  13.478  -9.994
  398    HE1  TRP  50           HE1      TRP  50  11.234  15.917  -9.476
  399    HE3  TRP  50           HE3      TRP  50   5.981  15.578  -9.929
  400    HZ2  TRP  50           HZ2      TRP  50   9.938  18.467  -9.136
  401    HZ3  TRP  50           HZ3      TRP  50   5.685  18.003  -9.517
  402    HH2  TRP  50           HH2      TRP  50   7.655  19.453  -9.124
  403    H    ASP  51           H        ASP  51   8.560  14.237  -7.620
  404    HA   ASP  51           HA       ASP  51   6.427  16.181  -7.045
  405   1HB   ASP  51          2HB       ASP  51   7.196  14.194  -5.133
  406   2HB   ASP  51          1HB       ASP  51   7.786  15.757  -4.567
  407    H    ASP  52           H        ASP  52   7.335  18.246  -6.376
  408    HA   ASP  52           HA       ASP  52  10.124  18.582  -7.286
  409   1HB   ASP  52          2HB       ASP  52   9.516  21.072  -6.638
  410   2HB   ASP  52          1HB       ASP  52   8.873  20.359  -8.112
  411    H    MET  53           H        MET  53   9.757  17.135  -4.820
  412    HA   MET  53           HA       MET  53  11.347  18.872  -3.070
  413   1HB   MET  53          2HB       MET  53   8.934  17.308  -2.114
  414   2HB   MET  53          1HB       MET  53  10.044  18.205  -1.082
  415   1HG   MET  53          2HG       MET  53   9.000  20.155  -1.516
  416   2HG   MET  53          1HG       MET  53   9.041  19.865  -3.252
  417   1HE   MET  53          3HE       MET  53   8.086  17.499  -3.758
  418   2HE   MET  53          2HE       MET  53   6.651  16.798  -3.016
  419   3HE   MET  53          1HE       MET  53   6.476  17.951  -4.335
  420    H    LYS  54           H        LYS  54  11.404  16.228  -4.785
  421    HA   LYS  54           HA       LYS  54  13.375  14.937  -3.164
  422   1HB   LYS  54          2HB       LYS  54  12.077  12.759  -2.913
  423   2HB   LYS  54          1HB       LYS  54  11.568  14.081  -1.862
  424   1HG   LYS  54          2HG       LYS  54  10.083  14.477  -4.185
  425   2HG   LYS  54          1HG       LYS  54  10.085  12.726  -3.986
  426   1HD   LYS  54          2HD       LYS  54   9.657  13.599  -1.408
  427   2HD   LYS  54          1HD       LYS  54   8.775  14.797  -2.357
  428   1HE   LYS  54          2HE       LYS  54   7.313  12.895  -1.812
  429   2HE   LYS  54          1HE       LYS  54   7.602  12.966  -3.550
  430   1HZ   LYS  54          3HZ       LYS  54   9.646  11.450  -2.433
  431   2HZ   LYS  54          2HZ       LYS  54   8.196  10.884  -1.752
  432   3HZ   LYS  54          1HZ       LYS  54   8.389  10.917  -3.440
  433    H    GLY  55           H        GLY  55  11.276  14.855  -5.996
  434   1HA   GLY  55          2HA       GLY  55  12.561  14.433  -8.115
  435   2HA   GLY  55          1HA       GLY  55  13.254  13.063  -7.259
  436    H    ASP  56           H        ASP  56  12.265  11.921  -9.218
  437    HA   ASP  56           HA       ASP  56   9.363  11.705  -9.270
  438   1HB   ASP  56          2HB       ASP  56  11.172   9.685 -10.558
  439   2HB   ASP  56          1HB       ASP  56   9.671  10.383 -11.159
  440    H    HIS  57           H        HIS  57   8.365   9.426  -9.084
  441    HA   HIS  57           HA       HIS  57   9.738   7.533  -7.343
  442   1HB   HIS  57          2HB       HIS  57   7.575   9.349  -6.288
  443   2HB   HIS  57          1HB       HIS  57   7.822   7.744  -5.603
  444    HD1  HIS  57           HD1      HIS  57   9.443  11.115  -5.917
  445    HD2  HIS  57           HD2      HIS  57  10.258   7.426  -4.155
  446    HE1  HIS  57           HE1      HIS  57  11.422  11.477  -4.378
  447    H    VAL  58           H        VAL  58   7.930   5.851  -6.605
  448    HA   VAL  58           HA       VAL  58   5.680   5.619  -8.435
  449    HB   VAL  58           HB       VAL  58   8.259   4.242  -8.921
  450   1HG1  VAL  58          1HG1      VAL  58   5.592   2.804  -9.106
  451   2HG1  VAL  58          3HG1      VAL  58   7.036   2.286  -9.977
  452   3HG1  VAL  58          2HG1      VAL  58   7.022   2.286  -8.213
  453   1HG2  VAL  58          2HG2      VAL  58   5.843   5.066 -10.526
  454   2HG2  VAL  58          1HG2      VAL  58   7.447   5.799 -10.531
  455   3HG2  VAL  58          3HG2      VAL  58   7.209   4.198 -11.234
  456    H    LYS  59           H        LYS  59   4.137   4.839  -7.132
  457    HA   LYS  59           HA       LYS  59   4.880   3.054  -4.868
  458   1HB   LYS  59          2HB       LYS  59   3.025   5.184  -5.151
  459   2HB   LYS  59          1HB       LYS  59   2.072   3.710  -4.978
  460   1HG   LYS  59          2HG       LYS  59   2.477   3.791  -2.762
  461   2HG   LYS  59          1HG       LYS  59   4.177   3.478  -3.116
  462   1HD   LYS  59          2HD       LYS  59   4.071   6.127  -3.673
  463   2HD   LYS  59          1HD       LYS  59   2.822   6.032  -2.432
  464   1HE   LYS  59          2HE       LYS  59   4.470   4.786  -0.983
  465   2HE   LYS  59          1HE       LYS  59   5.706   5.131  -2.193
  466   1HZ   LYS  59          3HZ       LYS  59   4.084   7.183  -0.788
  467   2HZ   LYS  59          2HZ       LYS  59   5.680   6.761  -0.385
  468   3HZ   LYS  59          1HZ       LYS  59   5.341   7.476  -1.889
  469    H    HIS  60           H        HIS  60   2.596   1.545  -4.572
  470    HA   HIS  60           HA       HIS  60   1.847   0.463  -7.188
  471   1HB   HIS  60          2HB       HIS  60   3.273  -1.370  -5.270
  472   2HB   HIS  60          1HB       HIS  60   2.758  -1.726  -6.915
  473    HD1  HIS  60           HD1      HIS  60   4.289  -1.049  -8.809
  474    HD2  HIS  60           HD2      HIS  60   5.534   0.485  -5.139
  475    HE1  HIS  60           HE1      HIS  60   6.570  -0.027  -9.201
  476    H    TYR  61           H        TYR  61   0.178  -1.040  -7.115
  477    HA   TYR  61           HA       TYR  61  -1.168  -1.368  -4.466
  478   1HB   TYR  61          2HB       TYR  61  -2.343  -0.490  -7.110
  479   2HB   TYR  61          1HB       TYR  61  -3.348  -1.232  -5.863
  480    HD1  TYR  61           HD1      TYR  61  -3.578  -0.149  -3.630
  481    HD2  TYR  61           HD2      TYR  61  -1.492   1.746  -6.871
  482    HE1  TYR  61           HE1      TYR  61  -3.710   2.025  -2.443
  483    HE2  TYR  61           HE2      TYR  61  -1.623   3.920  -5.684
  484    HH   TYR  61           HH       TYR  61  -1.976   4.397  -2.760
  485    H    LYS  62           H        LYS  62  -0.629  -3.513  -4.197
  486    HA   LYS  62           HA       LYS  62  -0.488  -5.448  -6.284
  487   1HB   LYS  62          2HB       LYS  62   0.668  -6.045  -4.344
  488   2HB   LYS  62          1HB       LYS  62  -0.656  -5.566  -3.284
  489   1HG   LYS  62          2HG       LYS  62  -1.372  -7.720  -5.152
  490   2HG   LYS  62          1HG       LYS  62  -0.080  -8.157  -4.032
  491   1HD   LYS  62          2HD       LYS  62  -2.564  -6.772  -3.036
  492   2HD   LYS  62          1HD       LYS  62  -2.549  -8.518  -3.275
  493   1HE   LYS  62          2HE       LYS  62  -1.608  -8.688  -1.231
  494   2HE   LYS  62          1HE       LYS  62  -0.155  -7.969  -1.928
  495   1HZ   LYS  62          1HZ       LYS  62  -1.843  -5.860  -1.482
  496   2HZ   LYS  62          3HZ       LYS  62  -2.037  -6.839  -0.111
  497   3HZ   LYS  62          2HZ       LYS  62  -0.491  -6.286  -0.546
  498    H    ILE  63           H        ILE  63  -2.163  -6.119  -7.484
  499    HA   ILE  63           HA       ILE  63  -4.912  -6.043  -6.397
  500    HB   ILE  63           HB       ILE  63  -3.757  -6.587  -9.142
  501   1HG1  ILE  63          2HG1      ILE  63  -5.784  -4.628  -9.163
  502   2HG1  ILE  63          1HG1      ILE  63  -4.826  -4.294  -7.720
  503   1HG2  ILE  63          3HG2      ILE  63  -6.596  -6.905  -8.137
  504   2HG2  ILE  63          2HG2      ILE  63  -6.209  -6.681  -9.843
  505   3HG2  ILE  63          1HG2      ILE  63  -5.610  -8.098  -8.981
  506   1HD1  ILE  63          3HD1      ILE  63  -3.238  -4.961 -10.116
  507   2HD1  ILE  63          2HD1      ILE  63  -4.159  -3.463 -10.244
  508   3HD1  ILE  63          1HD1      ILE  63  -3.001  -3.677  -8.930
  509    H    ARG  64           H        ARG  64  -6.259  -7.962  -6.421
  510    HA   ARG  64           HA       ARG  64  -4.859 -10.556  -6.712
  511   1HB   ARG  64          2HB       ARG  64  -6.547  -9.863  -4.288
  512   2HB   ARG  64          1HB       ARG  64  -5.650 -11.355  -4.562
  513   1HG   ARG  64          2HG       ARG  64  -4.463  -8.588  -4.202
  514   2HG   ARG  64          1HG       ARG  64  -4.397  -9.910  -3.037
  515   1HD   ARG  64          2HD       ARG  64  -3.455 -10.719  -5.673
  516   2HD   ARG  64          1HD       ARG  64  -2.517  -9.381  -5.020
  517    HE   ARG  64           HE       ARG  64  -2.379 -12.091  -4.104
  518   1HH1  ARG  64          2HH1      ARG  64  -3.664 -10.991  -1.700
  519   2HH1  ARG  64          1HH1      ARG  64  -2.329 -10.360  -0.793
  520   1HH2  ARG  64          1HH2      ARG  64  -0.156 -10.351  -3.496
  521   2HH2  ARG  64          2HH2      ARG  64  -0.343  -9.999  -1.809
  522    H    LYS  65           H        LYS  65  -6.481 -12.366  -6.800
  523    HA   LYS  65           HA       LYS  65  -9.023 -11.297  -7.916
  524   1HB   LYS  65          2HB       LYS  65  -7.939 -12.473  -9.665
  525   2HB   LYS  65          1HB       LYS  65  -7.456 -13.785  -8.594
  526   1HG   LYS  65          2HG       LYS  65  -9.856 -14.403  -8.296
  527   2HG   LYS  65          1HG       LYS  65 -10.315 -13.124  -9.414
  528   1HD   LYS  65          2HD       LYS  65  -8.473 -14.397 -10.930
  529   2HD   LYS  65          1HD       LYS  65  -9.048 -15.756  -9.966
  530   1HE   LYS  65          2HE       LYS  65 -11.414 -15.005 -10.565
  531   2HE   LYS  65          1HE       LYS  65 -10.672 -13.926 -11.746
  532   1HZ   LYS  65          1HZ       LYS  65  -9.442 -16.299 -12.196
  533   2HZ   LYS  65          3HZ       LYS  65 -11.033 -16.770 -11.842
  534   3HZ   LYS  65          2HZ       LYS  65 -10.734 -15.672 -13.103
  535    H    LEU  66           H        LEU  66 -10.768 -11.638  -6.713
  536    HA   LEU  66           HA       LEU  66 -10.663 -13.649  -4.561
  537   1HB   LEU  66          2HB       LEU  66 -13.126 -12.078  -5.213
  538   2HB   LEU  66          1HB       LEU  66 -12.478 -12.535  -3.635
  539    HG   LEU  66           HG       LEU  66 -10.470 -11.011  -4.640
  540   1HD1  LEU  66          2HD1      LEU  66 -12.909 -10.331  -6.081
  541   2HD1  LEU  66          1HD1      LEU  66 -12.210  -8.945  -5.244
  542   3HD1  LEU  66          3HD1      LEU  66 -11.243  -9.852  -6.408
  543   1HD2  LEU  66          2HD2      LEU  66 -12.822 -10.394  -2.893
  544   2HD2  LEU  66          1HD2      LEU  66 -11.136 -10.635  -2.438
  545   3HD2  LEU  66          3HD2      LEU  66 -11.626  -9.144  -3.239
  546    H    ASP  67           H        ASP  67 -11.745 -15.601  -4.682
  547    HA   ASP  67           HA       ASP  67 -12.797 -16.450  -7.253
  548   1HB   ASP  67          2HB       ASP  67 -12.216 -17.622  -4.655
  549   2HB   ASP  67          1HB       ASP  67 -13.746 -18.208  -5.297
  550    H    ASN  68           H        ASN  68 -13.956 -14.708  -4.602
  551    HA   ASN  68           HA       ASN  68 -16.776 -15.430  -4.888
  552   1HB   ASN  68          2HB       ASN  68 -15.487 -13.117  -3.414
  553   2HB   ASN  68          1HB       ASN  68 -17.128 -13.726  -3.184
  554   1HD2  ASN  68          2HD2      ASN  68 -14.224 -15.353  -1.012
  555   2HD2  ASN  68          1HD2      ASN  68 -14.127 -13.838  -1.773
  556    H    GLY  69           H        GLY  69 -14.559 -13.424  -6.537
  557   1HA   GLY  69          2HA       GLY  69 -16.837 -12.150  -7.884
  558   2HA   GLY  69          1HA       GLY  69 -15.724 -11.048  -7.088
  559    H    GLY  70           H        GLY  70 -13.589 -10.852  -7.935
  560   1HA   GLY  70          2HA       GLY  70 -12.647 -12.391 -10.163
  561   2HA   GLY  70          1HA       GLY  70 -13.382 -10.893 -10.723
  562    H    TYR  71           H        TYR  71 -12.297  -8.942 -10.398
  563    HA   TYR  71           HA       TYR  71  -9.591  -9.236  -9.156
  564   1HB   TYR  71          2HB       TYR  71 -10.498  -7.534 -11.492
  565   2HB   TYR  71          1HB       TYR  71  -8.932  -7.336 -10.707
  566    HD1  TYR  71           HD1      TYR  71  -8.908 -10.501 -10.088
  567    HD2  TYR  71           HD2      TYR  71  -9.286  -8.088 -13.633
  568    HE1  TYR  71           HE1      TYR  71  -7.990 -12.354 -11.473
  569    HE2  TYR  71           HE2      TYR  71  -8.373  -9.931 -14.994
  570    HH   TYR  71           HH       TYR  71  -6.859 -12.662 -13.616
  571    H    TYR  72           H        TYR  72  -9.009  -7.850  -7.608
  572    HA   TYR  72           HA       TYR  72 -10.405  -5.284  -7.243
  573   1HB   TYR  72          2HB       TYR  72 -11.363  -5.733  -5.130
  574   2HB   TYR  72          1HB       TYR  72 -11.802  -7.126  -6.106
  575    HD1  TYR  72           HD1      TYR  72  -9.552  -8.854  -6.178
  576    HD2  TYR  72           HD2      TYR  72 -10.872  -6.362  -2.945
  577    HE1  TYR  72           HE1      TYR  72  -8.322 -10.279  -4.585
  578    HE2  TYR  72           HE2      TYR  72  -9.643  -7.796  -1.341
  579    HH   TYR  72           HH       TYR  72  -7.391 -10.194  -2.373
  580    H    ILE  73           H        ILE  73  -8.877  -3.847  -6.426
  581    HA   ILE  73           HA       ILE  73  -6.345  -4.990  -5.412
  582    HB   ILE  73           HB       ILE  73  -6.816  -2.044  -5.296
  583   1HG1  ILE  73          2HG1      ILE  73  -6.685  -3.606  -7.893
  584   2HG1  ILE  73          1HG1      ILE  73  -7.967  -2.514  -7.375
  585   1HG2  ILE  73          2HG2      ILE  73  -4.631  -3.965  -5.629
  586   2HG2  ILE  73          1HG2      ILE  73  -4.514  -2.600  -6.739
  587   3HG2  ILE  73          3HG2      ILE  73  -4.593  -2.319  -5.000
  588   1HD1  ILE  73          3HD1      ILE  73  -5.091  -1.704  -7.905
  589   2HD1  ILE  73          2HD1      ILE  73  -6.445  -1.424  -9.001
  590   3HD1  ILE  73          1HD1      ILE  73  -6.401  -0.621  -7.431
  591    H    THR  74           H        THR  74  -9.310  -3.638  -4.353
  592    HA   THR  74           HA       THR  74  -8.514  -4.067  -1.542
  593    HB   THR  74           HB       THR  74  -8.415  -1.825  -1.222
  594    HG1  THR  74           HG1      THR  74 -10.347  -2.191  -0.240
  595   1HG2  THR  74          3HG2      THR  74  -8.341  -1.408  -3.667
  596   2HG2  THR  74          2HG2      THR  74 -10.104  -1.424  -3.705
  597   3HG2  THR  74          1HG2      THR  74  -9.253  -0.159  -2.818
  598    H    THR  75           H        THR  75 -10.227  -4.864  -0.316
  599    HA   THR  75           HA       THR  75 -12.256  -6.292  -1.681
  600    HB   THR  75           HB       THR  75 -13.393  -6.095   0.732
  601    HG1  THR  75           HG1      THR  75 -12.163  -4.625   1.707
  602   1HG2  THR  75          1HG2      THR  75 -11.442  -7.756  -0.554
  603   2HG2  THR  75          3HG2      THR  75 -11.056  -7.649   1.165
  604   3HG2  THR  75          2HG2      THR  75 -12.648  -8.211   0.653
  605    H    ARG  76           H        ARG  76 -12.089  -2.975  -0.874
  606    HA   ARG  76           HA       ARG  76 -14.724  -2.174  -0.534
  607   1HB   ARG  76          2HB       ARG  76 -12.471  -0.801  -0.845
  608   2HB   ARG  76          1HB       ARG  76 -13.058  -0.654  -2.501
  609   1HG   ARG  76          2HG       ARG  76 -13.987   1.225  -1.408
  610   2HG   ARG  76          1HG       ARG  76 -15.306   0.055  -1.422
  611   1HD   ARG  76          2HD       ARG  76 -14.295  -0.687   0.889
  612   2HD   ARG  76          1HD       ARG  76 -13.562   0.916   0.869
  613    HE   ARG  76           HE       ARG  76 -16.217   0.463   1.607
  614   1HH1  ARG  76          1HH2      ARG  76 -17.608   1.198  -0.582
  615   2HH1  ARG  76          2HH2      ARG  76 -17.435   2.910  -0.784
  616   1HH2  ARG  76          2HH1      ARG  76 -14.648   3.137   1.268
  617   2HH2  ARG  76          1HH1      ARG  76 -15.759   4.007   0.263
  618    H    ALA  77           H        ALA  77 -13.191  -3.369  -3.492
  619    HA   ALA  77           HA       ALA  77 -15.764  -3.952  -4.658
  620   1HB   ALA  77          3HB       ALA  77 -14.525  -1.333  -5.214
  621   2HB   ALA  77          2HB       ALA  77 -15.101  -2.210  -6.632
  622   3HB   ALA  77          1HB       ALA  77 -16.215  -1.825  -5.319
  623    H    GLN  78           H        GLN  78 -15.419  -5.614  -6.014
  624    HA   GLN  78           HA       GLN  78 -12.750  -5.967  -7.264
  625   1HB   GLN  78          2HB       GLN  78 -14.510  -8.233  -7.622
  626   2HB   GLN  78          1HB       GLN  78 -12.966  -8.168  -6.803
  627   1HG   GLN  78          2HG       GLN  78 -15.564  -7.329  -5.506
  628   2HG   GLN  78          1HG       GLN  78 -14.854  -8.926  -5.328
  629   1HE2  GLN  78          2HE2      GLN  78 -12.976  -7.762  -2.590
  630   2HE2  GLN  78          1HE2      GLN  78 -13.972  -8.970  -3.243
  631    H    PHE  79           H        PHE  79 -13.331  -7.528  -9.394
  632    HA   PHE  79           HA       PHE  79 -15.581  -6.384 -10.913
  633   1HB   PHE  79          2HB       PHE  79 -12.672  -5.963 -11.655
  634   2HB   PHE  79          1HB       PHE  79 -13.989  -5.815 -12.820
  635    HD1  PHE  79           HD1      PHE  79 -12.783  -4.564  -9.529
  636    HD2  PHE  79           HD2      PHE  79 -15.267  -3.831 -12.949
  637    HE1  PHE  79           HE1      PHE  79 -13.242  -2.287  -8.699
  638    HE2  PHE  79           HE2      PHE  79 -15.728  -1.537 -12.122
  639    HZ   PHE  79           HZ       PHE  79 -14.713  -0.760  -9.995
  640    H    GLU  80           H        GLU  80 -14.860  -7.358 -13.404
  641    HA   GLU  80           HA       GLU  80 -14.659 -10.257 -12.792
  642   1HB   GLU  80          2HB       GLU  80 -15.752 -10.503 -15.062
  643   2HB   GLU  80          1HB       GLU  80 -16.737  -9.684 -13.850
  644   1HG   GLU  80          2HG       GLU  80 -16.740  -7.741 -14.997
  645   2HG   GLU  80          1HG       GLU  80 -15.018  -7.851 -15.348
  646    H    THR  81           H        THR  81 -13.237  -7.639 -14.665
  647    HA   THR  81           HA       THR  81 -11.000  -9.475 -15.338
  648    HB   THR  81           HB       THR  81 -11.872  -9.700 -17.449
  649    HG1  THR  81           HG1      THR  81 -11.393  -7.106 -18.167
  650   1HG2  THR  81          1HG2      THR  81 -13.971  -8.528 -16.674
  651   2HG2  THR  81          3HG2      THR  81 -13.233  -7.022 -17.221
  652   3HG2  THR  81          2HG2      THR  81 -13.578  -8.314 -18.375
  653    H    LEU  82           H        LEU  82  -9.311  -7.979 -16.643
  654    HA   LEU  82           HA       LEU  82  -8.713  -5.810 -14.772
  655   1HB   LEU  82          2HB       LEU  82  -7.212  -6.955 -17.135
  656   2HB   LEU  82          1HB       LEU  82  -6.611  -5.614 -16.155
  657    HG   LEU  82           HG       LEU  82  -7.561  -8.062 -14.734
  658   1HD1  LEU  82          2HD1      LEU  82  -5.944  -8.553 -16.793
  659   2HD1  LEU  82          1HD1      LEU  82  -4.719  -8.014 -15.641
  660   3HD1  LEU  82          3HD1      LEU  82  -5.761  -9.385 -15.250
  661   1HD2  LEU  82          1HD2      LEU  82  -6.407  -5.703 -13.965
  662   2HD2  LEU  82          3HD2      LEU  82  -6.352  -7.192 -13.022
  663   3HD2  LEU  82          2HD2      LEU  82  -5.000  -6.761 -14.070
  664    H    GLN  83           H        GLN  83  -9.815  -6.197 -18.073
  665    HA   GLN  83           HA       GLN  83  -9.467  -3.407 -18.781
  666   1HB   GLN  83          2HB       GLN  83 -10.268  -5.792 -20.107
  667   2HB   GLN  83          1HB       GLN  83 -11.602  -4.647 -20.261
  668   1HG   GLN  83          2HG       GLN  83  -9.915  -2.919 -21.006
  669   2HG   GLN  83          1HG       GLN  83  -8.709  -4.204 -21.048
  670   1HE2  GLN  83          2HE2      GLN  83 -10.972  -5.896 -23.611
  671   2HE2  GLN  83          1HE2      GLN  83 -10.643  -6.264 -21.987
  672    H    GLN  84           H        GLN  84 -11.916  -5.352 -17.218
  673    HA   GLN  84           HA       GLN  84 -14.032  -3.380 -17.372
  674   1HB   GLN  84          2HB       GLN  84 -13.582  -5.927 -15.874
  675   2HB   GLN  84          1HB       GLN  84 -14.868  -4.848 -15.353
  676   1HG   GLN  84          2HG       GLN  84 -15.450  -6.681 -17.102
  677   2HG   GLN  84          1HG       GLN  84 -16.041  -5.052 -17.371
  678   1HE2  GLN  84          2HE2      GLN  84 -14.054  -6.655 -20.330
  679   2HE2  GLN  84          1HE2      GLN  84 -15.002  -7.464 -19.176
  680    H    LEU  85           H        LEU  85 -11.654  -4.298 -14.911
  681    HA   LEU  85           HA       LEU  85 -12.611  -2.246 -13.048
  682   1HB   LEU  85          2HB       LEU  85 -11.123  -3.128 -11.529
  683   2HB   LEU  85          1HB       LEU  85 -11.257  -4.516 -12.606
  684    HG   LEU  85           HG       LEU  85  -9.299  -3.029 -13.832
  685   1HD1  LEU  85          1HD1      LEU  85  -9.527  -1.774 -11.430
  686   2HD1  LEU  85          3HD1      LEU  85  -8.327  -3.008 -11.038
  687   3HD1  LEU  85          2HD1      LEU  85  -8.022  -1.865 -12.348
  688   1HD2  LEU  85          3HD2      LEU  85  -9.520  -5.508 -13.113
  689   2HD2  LEU  85          2HD2      LEU  85  -7.911  -4.810 -13.288
  690   3HD2  LEU  85          1HD2      LEU  85  -8.619  -5.002 -11.682
  691    H    VAL  86           H        VAL  86 -10.224  -2.381 -15.604
  692    HA   VAL  86           HA       VAL  86  -8.957   0.049 -14.690
  693    HB   VAL  86           HB       VAL  86  -7.916   0.155 -16.920
  694   1HG1  VAL  86          1HG1      VAL  86  -7.877  -2.210 -15.195
  695   2HG1  VAL  86          3HG1      VAL  86  -7.362  -2.559 -16.845
  696   3HG1  VAL  86          2HG1      VAL  86  -6.531  -1.318 -15.907
  697   1HG2  VAL  86          1HG2      VAL  86  -9.847  -2.086 -17.527
  698   2HG2  VAL  86          3HG2      VAL  86  -9.808  -0.497 -18.283
  699   3HG2  VAL  86          2HG2      VAL  86  -8.499  -1.644 -18.571
  700    H    GLN  87           H        GLN  87 -11.756  -0.919 -16.365
  701    HA   GLN  87           HA       GLN  87 -12.402   1.514 -17.730
  702   1HB   GLN  87          2HB       GLN  87 -13.447  -0.738 -18.134
  703   2HB   GLN  87          1HB       GLN  87 -14.298  -0.552 -16.609
  704   1HG   GLN  87          2HG       GLN  87 -15.771   0.186 -18.385
  705   2HG   GLN  87          1HG       GLN  87 -15.252   1.594 -17.460
  706   1HE2  GLN  87          2HE2      GLN  87 -14.417   1.417 -21.389
  707   2HE2  GLN  87          1HE2      GLN  87 -15.463   0.323 -20.619
  708    H    HIS  88           H        HIS  88 -13.273   0.173 -14.576
  709    HA   HIS  88           HA       HIS  88 -14.861   2.476 -13.819
  710   1HB   HIS  88          2HB       HIS  88 -14.979   0.010 -12.959
  711   2HB   HIS  88          1HB       HIS  88 -13.694   0.515 -11.870
  712    HD1  HIS  88           HD1      HIS  88 -16.807  -0.147 -11.149
  713    HD2  HIS  88           HD2      HIS  88 -15.008   3.607 -11.343
  714    HE1  HIS  88           HE1      HIS  88 -18.219   1.397  -9.723
  715    H    TYR  89           H        TYR  89 -11.653   1.279 -13.236
  716    HA   TYR  89           HA       TYR  89 -10.841   3.287 -11.345
  717   1HB   TYR  89          2HB       TYR  89  -9.358   1.347 -13.111
  718   2HB   TYR  89          1HB       TYR  89  -8.509   2.491 -12.078
  719    HD1  TYR  89           HD1      TYR  89 -11.593   0.393 -11.642
  720    HD2  TYR  89           HD2      TYR  89  -7.690   1.406 -10.171
  721    HE1  TYR  89           HE1      TYR  89 -11.907  -1.158  -9.768
  722    HE2  TYR  89           HE2      TYR  89  -8.014  -0.151  -8.268
  723    HH   TYR  89           HH       TYR  89  -9.786  -1.223  -7.049
  724    H    SER  90           H        SER  90 -11.380   3.336 -14.705
  725    HA   SER  90           HA       SER  90  -9.433   5.376 -15.348
  726   1HB   SER  90          2HB       SER  90 -11.124   3.623 -16.794
  727   2HB   SER  90          1HB       SER  90 -11.568   5.265 -17.257
  728    HG   SER  90           HG       SER  90  -9.449   3.868 -18.006
  729    H    GLU  91           H        GLU  91 -12.904   5.276 -14.672
  730    HA   GLU  91           HA       GLU  91 -13.112   8.195 -15.036
  731   1HB   GLU  91          2HB       GLU  91 -15.191   6.211 -14.064
  732   2HB   GLU  91          1HB       GLU  91 -15.489   7.874 -14.573
  733   1HG   GLU  91          2HG       GLU  91 -14.086   6.764 -16.710
  734   2HG   GLU  91          1HG       GLU  91 -15.169   5.469 -16.199
  735    H    ARG  92           H        ARG  92 -12.394   5.969 -12.543
  736    HA   ARG  92           HA       ARG  92 -12.342   8.175 -10.586
  737   1HB   ARG  92          2HB       ARG  92 -13.794   5.683  -9.747
  738   2HB   ARG  92          1HB       ARG  92 -13.883   7.305  -9.060
  739   1HG   ARG  92          2HG       ARG  92 -15.037   8.090 -11.112
  740   2HG   ARG  92          1HG       ARG  92 -14.981   6.450 -11.757
  741   1HD   ARG  92          2HD       ARG  92 -16.133   5.841  -9.458
  742   2HD   ARG  92          1HD       ARG  92 -16.602   7.541  -9.479
  743    HE   ARG  92           HE       ARG  92 -17.241   6.473 -12.020
  744   1HH1  ARG  92          2HH1      ARG  92 -17.812   4.627  -9.370
  745   2HH1  ARG  92          1HH1      ARG  92 -19.540   4.753  -9.391
  746   1HH2  ARG  92          1HH2      ARG  92 -19.594   7.274 -11.771
  747   2HH2  ARG  92          2HH2      ARG  92 -20.549   6.251 -10.750
  748    H    ALA  93           H        ALA  93 -11.069   7.610  -8.687
  749    HA   ALA  93           HA       ALA  93  -8.784   6.044  -9.177
  750   1HB   ALA  93          3HB       ALA  93  -9.702   7.624  -7.076
  751   2HB   ALA  93          2HB       ALA  93  -9.565   6.019  -6.356
  752   3HB   ALA  93          1HB       ALA  93  -8.162   6.766  -7.122
  753    H    ALA  94           H        ALA  94 -11.911   5.136  -7.852
  754    HA   ALA  94           HA       ALA  94 -12.899   2.993  -7.842
  755   1HB   ALA  94          1HB       ALA  94 -10.711   2.572  -9.490
  756   2HB   ALA  94          3HB       ALA  94 -10.459   1.414  -8.183
  757   3HB   ALA  94          2HB       ALA  94 -11.957   1.384  -9.113
  758    H    GLY  95           H        GLY  95 -11.058   4.431  -5.741
  759   1HA   GLY  95          2HA       GLY  95 -11.503   3.621  -3.377
  760   2HA   GLY  95          1HA       GLY  95 -10.880   2.070  -3.923
  761    H    LEU  96           H        LEU  96  -8.641   2.819  -5.357
  762    HA   LEU  96           HA       LEU  96  -6.867   3.682  -3.178
  763   1HB   LEU  96          2HB       LEU  96  -5.068   2.999  -4.695
  764   2HB   LEU  96          1HB       LEU  96  -6.296   1.734  -4.616
  765    HG   LEU  96           HG       LEU  96  -6.618   3.835  -6.714
  766   1HD1  LEU  96          3HD1      LEU  96  -4.170   3.040  -6.624
  767   2HD1  LEU  96          2HD1      LEU  96  -4.801   1.479  -7.145
  768   3HD1  LEU  96          1HD1      LEU  96  -5.014   2.901  -8.165
  769   1HD2  LEU  96          1HD2      LEU  96  -7.481   1.088  -6.138
  770   2HD2  LEU  96          3HD2      LEU  96  -8.256   2.327  -7.124
  771   3HD2  LEU  96          2HD2      LEU  96  -6.975   1.330  -7.810
  772    H    SER  97           H        SER  97  -4.914   5.125  -4.166
  773    HA   SER  97           HA       SER  97  -6.272   7.553  -5.224
  774   1HB   SER  97          2HB       SER  97  -3.490   7.921  -4.488
  775   2HB   SER  97          1HB       SER  97  -4.926   8.709  -3.834
  776    HG   SER  97           HG       SER  97  -4.033   7.542  -2.190
  777    H    SER  98           H        SER  98  -5.724   5.424  -7.061
  778    HA   SER  98           HA       SER  98  -3.922   6.890  -8.887
  779   1HB   SER  98          2HB       SER  98  -2.193   5.509  -8.404
  780   2HB   SER  98          1HB       SER  98  -3.233   4.363  -7.561
  781    HG   SER  98           HG       SER  98  -2.762   3.227  -9.291
  782    H    ARG  99           H        ARG  99  -5.677   7.245 -10.273
  783    HA   ARG  99           HA       ARG  99  -7.457   5.095 -11.101
  784   1HB   ARG  99          2HB       ARG  99  -7.105   7.587 -12.728
  785   2HB   ARG  99          1HB       ARG  99  -8.585   6.726 -12.313
  786   1HG   ARG  99          2HG       ARG  99  -7.766   7.471  -9.837
  787   2HG   ARG  99          1HG       ARG  99  -7.115   8.805 -10.790
  788   1HD   ARG  99          2HD       ARG  99  -9.825   8.105 -11.611
  789   2HD   ARG  99          1HD       ARG  99  -9.750   8.547  -9.905
  790    HE   ARG  99           HE       ARG  99  -8.714  10.321 -12.083
  791   1HH1  ARG  99          1HH2      ARG  99  -7.843  11.881 -10.173
  792   2HH1  ARG  99          2HH2      ARG  99  -9.178  12.599  -9.336
  793   1HH2  ARG  99          2HH1      ARG  99 -11.497  10.311 -10.526
  794   2HH2  ARG  99          1HH1      ARG  99 -11.248  11.710  -9.536
  795    H    LEU 100           H        LEU 100  -5.761   3.566 -11.761
  796    HA   LEU 100           HA       LEU 100  -4.127   2.684 -13.232
  797   1HB   LEU 100          2HB       LEU 100  -5.328   2.995 -15.690
  798   2HB   LEU 100          1HB       LEU 100  -5.692   1.720 -14.537
  799    HG   LEU 100           HG       LEU 100  -7.300   3.705 -13.589
  800   1HD1  LEU 100          2HD1      LEU 100  -6.453   4.533 -16.201
  801   2HD1  LEU 100          1HD1      LEU 100  -8.171   4.139 -16.250
  802   3HD1  LEU 100          3HD1      LEU 100  -7.574   5.340 -15.106
  803   1HD2  LEU 100          1HD2      LEU 100  -7.815   1.330 -14.202
  804   2HD2  LEU 100          3HD2      LEU 100  -9.098   2.482 -14.569
  805   3HD2  LEU 100          2HD2      LEU 100  -8.059   1.878 -15.861
  806    H    VAL 101           H        VAL 101  -3.570   3.292 -15.934
  807    HA   VAL 101           HA       VAL 101  -1.893   5.682 -15.554
  808    HB   VAL 101           HB       VAL 101  -2.077   3.501 -17.630
  809   1HG1  VAL 101          2HG1      VAL 101  -1.848   5.694 -18.829
  810   2HG1  VAL 101          1HG1      VAL 101  -0.383   6.001 -17.890
  811   3HG1  VAL 101          3HG1      VAL 101  -0.446   4.638 -19.014
  812   1HG2  VAL 101          2HG2      VAL 101  -0.217   4.398 -15.519
  813   2HG2  VAL 101          1HG2      VAL 101  -0.510   2.782 -16.141
  814   3HG2  VAL 101          3HG2      VAL 101   0.546   3.882 -17.016
  815    H    VAL 102           H        VAL 102  -2.405   7.673 -16.382
  816    HA   VAL 102           HA       VAL 102  -4.912   8.414 -17.288
  817    HB   VAL 102           HB       VAL 102  -3.333  10.138 -16.773
  818   1HG1  VAL 102          3HG1      VAL 102  -1.633   8.572 -18.619
  819   2HG1  VAL 102          2HG1      VAL 102  -1.449  10.322 -18.739
  820   3HG1  VAL 102          1HG1      VAL 102  -1.182   9.510 -17.195
  821   1HG2  VAL 102          1HG2      VAL 102  -3.942  10.092 -19.742
  822   2HG2  VAL 102          3HG2      VAL 102  -4.918  10.830 -18.472
  823   3HG2  VAL 102          2HG2      VAL 102  -3.343  11.511 -18.883
  824    HA   PRO 103           HA       PRO 103  -5.167   6.526 -21.282
  825   1HB   PRO 103          2HB       PRO 103  -7.492   7.767 -22.064
  826   2HB   PRO 103          1HB       PRO 103  -7.439   6.407 -20.933
  827   1HG   PRO 103          2HG       PRO 103  -7.908   9.305 -20.381
  828   2HG   PRO 103          1HG       PRO 103  -8.453   7.890 -19.467
  829   1HD   PRO 103          2HD       PRO 103  -6.266   9.571 -18.800
  830   2HD   PRO 103          1HD       PRO 103  -6.622   7.987 -18.083
  831    H    SER 104           H        SER 104  -5.463  10.043 -20.889
  832    HA   SER 104           HA       SER 104  -4.654  10.428 -23.725
  833   1HB   SER 104          2HB       SER 104  -5.075  12.823 -22.070
  834   2HB   SER 104          1HB       SER 104  -5.763  12.406 -23.641
  835    HG   SER 104           HG       SER 104  -7.303  12.477 -21.901
  836    H    HIS 105           H        HIS 105  -2.493   9.449 -22.841
  837    HA   HIS 105           HA       HIS 105  -0.719  10.600 -21.102
  838   1HB   HIS 105          2HB       HIS 105  -0.455   9.179 -23.661
  839   2HB   HIS 105          1HB       HIS 105   0.924  10.214 -23.280
  840    HD1  HIS 105           HD1      HIS 105   1.848   7.504 -23.061
  841    HD2  HIS 105           HD2      HIS 105  -0.404   9.153 -19.968
  842    HE1  HIS 105           HE1      HIS 105   2.319   6.095 -21.008
  843    H    LYS 106           HN       LYS 106   0.361  12.500 -20.899
  844    HA   LYS 106           HA       LYS 106  -0.403  14.875 -22.062
  845   1HB   LYS 106          2HB       LYS 106   1.300  14.518 -20.186
  846   2HB   LYS 106          1HB       LYS 106   2.504  14.300 -21.457
  847   1HG   LYS 106          2HG       LYS 106   2.697  16.535 -21.625
  848   2HG   LYS 106          1HG       LYS 106   1.005  16.628 -22.114
  849   1HD   LYS 106          2HD       LYS 106   0.829  17.885 -20.206
  850   2HD   LYS 106          1HD       LYS 106   0.693  16.299 -19.445
  851   1HE   LYS 106          2HE       LYS 106   3.016  16.284 -18.855
  852   2HE   LYS 106          1HE       LYS 106   3.351  17.682 -19.878
  853   1HZ   LYS 106          2HZ       LYS 106   1.813  18.963 -18.433
  854   2HZ   LYS 106          1HZ       LYS 106   1.737  17.625 -17.389
  855   3HZ   LYS 106          3HZ       LYS 106   3.214  18.421 -17.637
  856   1H    GLU 201          1HT       GLU 201   9.796  -4.162  -1.705
  857   2H    GLU 201          3HT       GLU 201   9.674  -2.670  -0.907
  858   3H    GLU 201          2HT       GLU 201  11.087  -3.599  -0.754
  859    HA   GLU 201           HA       GLU 201  10.161  -5.077   0.695
  860   1HB   GLU 201          2HB       GLU 201   8.524  -2.557   1.119
  861   2HB   GLU 201          1HB       GLU 201   8.850  -3.795   2.333
  862   1HG   GLU 201          2HG       GLU 201  10.811  -2.820   2.838
  863   2HG   GLU 201          1HG       GLU 201  11.339  -2.977   1.163
  864    HA   PRO 202           HA       PRO 202   6.409  -6.947  -0.611
  865   1HB   PRO 202          2HB       PRO 202   5.873  -8.417   1.650
  866   2HB   PRO 202          1HB       PRO 202   7.136  -8.843   0.482
  867   1HG   PRO 202          2HG       PRO 202   7.420  -7.654   3.201
  868   2HG   PRO 202          1HG       PRO 202   8.566  -8.647   2.285
  869   1HD   PRO 202          2HD       PRO 202   8.684  -5.835   2.592
  870   2HD   PRO 202          1HD       PRO 202   9.613  -6.799   1.423
  871    H    GLN 203           H        GLN 203   4.123  -7.518   0.645
  872    HA   GLN 203           HA       GLN 203   2.161  -6.616   1.565
  873   1HB   GLN 203          2HB       GLN 203   4.244  -5.921   3.343
  874   2HB   GLN 203          1HB       GLN 203   3.295  -4.452   3.111
  875   1HG   GLN 203          2HG       GLN 203   2.051  -7.140   3.740
  876   2HG   GLN 203          1HG       GLN 203   2.481  -5.962   4.981
  877   1HE2  GLN 203          2HE2      GLN 203  -1.099  -5.490   3.705
  878   2HE2  GLN 203          1HE2      GLN 203  -0.263  -6.898   4.153
  879   1HN   PTR 204          1HN       PTR 204   0.847  -5.337   0.364
  880    HA   PTR 204           HA       PTR 204   2.018  -2.880  -0.857
  881   1HB   PTR 204          1HB       PTR 204  -0.109  -3.050  -2.309
  882    HD1  PTR 204           HD1      PTR 204   1.917  -6.142  -1.643
  883    HD2  PTR 204           HD2      PTR 204   1.150  -2.818  -4.258
  884    HE1  PTR 204           HE1      PTR 204   3.590  -7.020  -3.247
  885    HE2  PTR 204           HE2      PTR 204   2.824  -3.702  -5.866
  886    H    GLU 205           H        GLU 205   0.105  -1.180  -1.245
  887    HA   GLU 205           HA       GLU 205  -0.871  -0.516   1.450
  888   1HB   GLU 205          2HB       GLU 205  -1.086   0.961  -1.192
  889   2HB   GLU 205          1HB       GLU 205  -1.614   1.602   0.364
  890   1HG   GLU 205          2HG       GLU 205   0.764   1.171   1.194
  891   2HG   GLU 205          1HG       GLU 205   1.201   0.906  -0.495
  892    H    GLU 206           H        GLU 206  -2.803  -1.307   2.114
  893    HA   GLU 206           HA       GLU 206  -4.839  -2.007   0.060
  894   1HB   GLU 206          2HB       GLU 206  -5.158  -2.597   2.986
  895   2HB   GLU 206          1HB       GLU 206  -5.728  -3.519   1.594
  896   1HG   GLU 206          2HG       GLU 206  -3.437  -4.199   1.068
  897   2HG   GLU 206          1HG       GLU 206  -2.819  -3.222   2.400
  898    H    ILE 207           H        ILE 207  -6.397  -0.515  -0.315
  899    HA   ILE 207           HA       ILE 207  -6.764   1.915   0.973
  900    HB   ILE 207           HB       ILE 207  -8.783   0.126  -0.397
  901   1HG1  ILE 207          2HG1      ILE 207  -8.526   2.177  -2.034
  902   2HG1  ILE 207          1HG1      ILE 207  -7.011   2.427  -1.165
  903   1HG2  ILE 207          2HG2      ILE 207  -9.854   1.704   1.274
  904   2HG2  ILE 207          1HG2      ILE 207  -9.168   3.037   0.347
  905   3HG2  ILE 207          3HG2      ILE 207 -10.346   1.959  -0.399
  906   1HD1  ILE 207          3HD1      ILE 207  -7.419  -0.376  -1.877
  907   2HD1  ILE 207          2HD1      ILE 207  -7.398   0.675  -3.294
  908   3HD1  ILE 207          1HD1      ILE 207  -6.029   0.665  -2.181
  909    HA   PRO 208           HA       PRO 208  -8.389   0.759   4.920
  910   1HB   PRO 208          2HB       PRO 208  -9.114   3.288   5.719
  911   2HB   PRO 208          1HB       PRO 208  -7.441   2.703   5.720
  912   1HG   PRO 208          2HG       PRO 208  -8.764   4.601   3.839
  913   2HG   PRO 208          1HG       PRO 208  -7.054   4.465   4.278
  914   1HD   PRO 208          2HD       PRO 208  -8.237   3.497   1.896
  915   2HD   PRO 208          1HD       PRO 208  -6.617   3.090   2.497
  916    H    ILE 209           H        ILE 209 -10.484   0.715   6.041
  917    HA   ILE 209           HA       ILE 209 -12.812   1.760   4.533
  918    HB   ILE 209           HB       ILE 209 -12.852  -1.107   5.449
  919   1HG1  ILE 209          2HG1      ILE 209 -12.075  -0.255   2.651
  920   2HG1  ILE 209          1HG1      ILE 209 -10.872  -0.653   3.879
  921   1HG2  ILE 209          3HG2      ILE 209 -14.716   0.652   4.343
  922   2HG2  ILE 209          2HG2      ILE 209 -14.221  -0.358   2.985
  923   3HG2  ILE 209          1HG2      ILE 209 -14.875  -1.101   4.444
  924   1HD1  ILE 209          1HD1      ILE 209 -13.134  -2.528   3.170
  925   2HD1  ILE 209          3HD1      ILE 209 -11.578  -2.570   2.341
  926   3HD1  ILE 209          2HD1      ILE 209 -11.663  -2.893   4.073
  927    H    TYR 210           H        TYR 210 -11.287   1.868   7.273
  928    HA   TYR 210           HA       TYR 210 -13.255   0.992   9.212
  929   1HB   TYR 210          2HB       TYR 210 -11.259   3.127   9.853
  930   2HB   TYR 210          1HB       TYR 210 -11.757   1.736  10.807
  931    HD1  TYR 210           HD1      TYR 210 -11.349  -0.592   9.307
  932    HD2  TYR 210           HD2      TYR 210  -9.025   3.020   9.213
  933    HE1  TYR 210           HE1      TYR 210  -9.393  -1.871   8.475
  934    HE2  TYR 210           HE2      TYR 210  -7.071   1.741   8.381
  935    HH   TYR 210           HH       TYR 210  -6.277  -0.682   8.496
  936    H    LEU 211           HN       LEU 211 -14.545   2.438  10.557
  937    HA   LEU 211           HA       LEU 211 -14.978   5.163   9.443
  938   1HB   LEU 211          2HB       LEU 211 -17.434   4.809   9.493
  939   2HB   LEU 211          1HB       LEU 211 -16.642   3.726   8.347
  940    HG   LEU 211           HG       LEU 211 -16.666   2.470  10.926
  941   1HD1  LEU 211          2HD1      LEU 211 -19.088   4.000  10.220
  942   2HD1  LEU 211          1HD1      LEU 211 -19.384   2.301  10.589
  943   3HD1  LEU 211          3HD1      LEU 211 -18.590   3.336  11.776
  944   1HD2  LEU 211          2HD2      LEU 211 -17.429   1.962   8.140
  945   2HD2  LEU 211          1HD2      LEU 211 -16.727   0.865   9.328
  946   3HD2  LEU 211          3HD2      LEU 211 -18.469   1.136   9.300
   
  No H/Q in entry =         946
  Start of MODEL   14
    1   1H    SER   1          3HT       SER   1  -4.592 -10.638 -25.305
    2   2H    SER   1          2HT       SER   1  -3.020 -11.273 -25.405
    3   3H    SER   1          1HT       SER   1  -3.864 -11.316 -23.931
    4    HA   SER   1           HA       SER   1  -2.495  -9.534 -23.571
    5   1HB   SER   1          2HB       SER   1  -2.332  -9.604 -26.421
    6   2HB   SER   1          1HB       SER   1  -2.745  -7.956 -25.945
    7    HG   SER   1           HG       SER   1  -0.700  -7.813 -25.518
    8    H    ILE   2           H        ILE   2  -3.980  -8.641 -22.163
    9    HA   ILE   2           HA       ILE   2  -6.564  -7.693 -22.816
   10    HB   ILE   2           HB       ILE   2  -6.364  -6.345 -20.703
   11   1HG1  ILE   2          2HG1      ILE   2  -3.525  -7.405 -20.840
   12   2HG1  ILE   2          1HG1      ILE   2  -4.022  -5.713 -20.836
   13   1HG2  ILE   2          3HG2      ILE   2  -6.292  -9.154 -21.076
   14   2HG2  ILE   2          2HG2      ILE   2  -5.230  -8.800 -19.713
   15   3HG2  ILE   2          1HG2      ILE   2  -6.912  -8.272 -19.681
   16   1HD1  ILE   2          1HD1      ILE   2  -5.182  -7.094 -18.575
   17   2HD1  ILE   2          3HD1      ILE   2  -3.433  -7.320 -18.590
   18   3HD1  ILE   2          2HD1      ILE   2  -4.112  -5.694 -18.585
   19    H    GLN   3           H        GLN   3  -6.664  -5.013 -21.943
   20    HA   GLN   3           HA       GLN   3  -6.453  -3.516 -24.236
   21   1HB   GLN   3          2HB       GLN   3  -7.293  -2.813 -21.885
   22   2HB   GLN   3          1HB       GLN   3  -5.631  -2.284 -21.611
   23   1HG   GLN   3          2HG       GLN   3  -7.124  -0.463 -22.488
   24   2HG   GLN   3          1HG       GLN   3  -5.742  -0.793 -23.531
   25   1HE2  GLN   3          2HE2      GLN   3  -7.798  -1.539 -26.281
   26   2HE2  GLN   3          1HE2      GLN   3  -6.280  -1.046 -25.701
   27    H    ALA   4           H        ALA   4  -3.812  -4.250 -22.005
   28    HA   ALA   4           HA       ALA   4  -1.510  -3.732 -22.162
   29   1HB   ALA   4          3HB       ALA   4  -2.208  -5.365 -24.158
   30   2HB   ALA   4          2HB       ALA   4  -1.734  -3.970 -25.128
   31   3HB   ALA   4          1HB       ALA   4  -0.574  -4.716 -24.027
   32    H    GLU   5           H        GLU   5  -3.476  -1.501 -22.485
   33    HA   GLU   5           HA       GLU   5  -2.341   0.298 -24.481
   34   1HB   GLU   5          2HB       GLU   5  -4.555   0.347 -22.534
   35   2HB   GLU   5          1HB       GLU   5  -3.775   1.908 -22.786
   36   1HG   GLU   5          2HG       GLU   5  -4.862   0.102 -24.969
   37   2HG   GLU   5          1HG       GLU   5  -5.623   1.584 -24.390
   38    H    GLU   6           H        GLU   6  -2.853   1.463 -21.213
   39    HA   GLU   6           HA       GLU   6   0.082   1.762 -20.837
   40   1HB   GLU   6          2HB       GLU   6  -1.942   4.014 -20.801
   41   2HB   GLU   6          1HB       GLU   6  -0.300   4.161 -20.173
   42   1HG   GLU   6          2HG       GLU   6   0.477   3.333 -22.480
   43   2HG   GLU   6          1HG       GLU   6  -1.171   3.652 -23.022
   44    H    TRP   7           H        TRP   7  -2.613   0.548 -19.570
   45    HA   TRP   7           HA       TRP   7  -1.979   1.459 -16.799
   46   1HB   TRP   7          2HB       TRP   7  -4.243   0.587 -16.212
   47   2HB   TRP   7          1HB       TRP   7  -4.301   1.896 -17.391
   48    HD1  TRP   7           HD1      TRP   7  -5.211   1.376 -19.762
   49    HE1  TRP   7           HE1      TRP   7  -6.286  -0.702 -20.842
   50    HE3  TRP   7           HE3      TRP   7  -4.172  -2.119 -16.185
   51    HZ2  TRP   7           HZ2      TRP   7  -6.658  -3.480 -20.266
   52    HZ3  TRP   7           HZ3      TRP   7  -4.896  -4.472 -16.479
   53    HH2  TRP   7           HH2      TRP   7  -6.138  -5.155 -18.514
   54    H    TYR   8           H        TYR   8  -1.510  -1.058 -18.950
   55    HA   TYR   8           HA       TYR   8  -0.784  -2.861 -16.741
   56   1HB   TYR   8          2HB       TYR   8  -2.803  -3.859 -17.030
   57   2HB   TYR   8          1HB       TYR   8  -2.991  -3.277 -18.675
   58    HD1  TYR   8           HD1      TYR   8  -1.606  -5.937 -16.545
   59    HD2  TYR   8           HD2      TYR   8  -2.055  -4.497 -20.563
   60    HE1  TYR   8           HE1      TYR   8  -0.890  -8.140 -17.417
   61    HE2  TYR   8           HE2      TYR   8  -1.352  -6.706 -21.439
   62    HH   TYR   8           HH       TYR   8  -0.373  -8.676 -20.870
   63    H    PHE   9           H        PHE   9   1.130  -3.788 -17.128
   64    HA   PHE   9           HA       PHE   9   2.306  -3.508 -19.837
   65   1HB   PHE   9          2HB       PHE   9   3.429  -3.894 -17.070
   66   2HB   PHE   9          1HB       PHE   9   4.416  -4.251 -18.485
   67    HD1  PHE   9           HD1      PHE   9   1.848  -1.676 -18.797
   68    HD2  PHE   9           HD2      PHE   9   5.968  -2.389 -17.791
   69    HE1  PHE   9           HE1      PHE   9   2.333   0.740 -19.058
   70    HE2  PHE   9           HE2      PHE   9   6.447   0.026 -18.053
   71    HZ   PHE   9           HZ       PHE   9   4.632   1.591 -18.686
   72    H    GLY  10           H        GLY  10   1.790  -5.953 -17.299
   73   1HA   GLY  10          2HA       GLY  10   0.988  -8.119 -18.678
   74   2HA   GLY  10          1HA       GLY  10   2.689  -8.086 -19.132
   75    H    LYS  11           H        LYS  11   3.961  -9.304 -17.857
   76    HA   LYS  11           HA       LYS  11   3.041  -9.880 -15.077
   77   1HB   LYS  11          2HB       LYS  11   5.210 -11.439 -16.449
   78   2HB   LYS  11          1HB       LYS  11   4.046 -11.980 -15.239
   79   1HG   LYS  11          2HG       LYS  11   2.256 -11.978 -16.851
   80   2HG   LYS  11          1HG       LYS  11   3.262 -11.168 -18.051
   81   1HD   LYS  11          2HD       LYS  11   4.035 -13.850 -16.893
   82   2HD   LYS  11          1HD       LYS  11   2.967 -13.724 -18.291
   83   1HE   LYS  11          2HE       LYS  11   4.705 -12.368 -19.454
   84   2HE   LYS  11          1HE       LYS  11   5.778 -12.604 -18.075
   85   1HZ   LYS  11          3HZ       LYS  11   4.761 -15.095 -18.858
   86   2HZ   LYS  11          2HZ       LYS  11   5.356 -14.311 -20.243
   87   3HZ   LYS  11          1HZ       LYS  11   6.368 -14.554 -18.900
   88    H    LEU  12           H        LEU  12   3.956  -7.629 -14.771
   89    HA   LEU  12           HA       LEU  12   6.904  -7.541 -14.767
   90   1HB   LEU  12          2HB       LEU  12   4.830  -5.636 -15.152
   91   2HB   LEU  12          1HB       LEU  12   5.703  -5.163 -13.702
   92    HG   LEU  12           HG       LEU  12   6.650  -5.325 -16.513
   93   1HD1  LEU  12          3HD1      LEU  12   6.770  -3.436 -14.203
   94   2HD1  LEU  12          2HD1      LEU  12   7.982  -3.304 -15.479
   95   3HD1  LEU  12          1HD1      LEU  12   6.270  -3.135 -15.869
   96   1HD2  LEU  12          1HD2      LEU  12   8.359  -5.934 -14.121
   97   2HD2  LEU  12          3HD2      LEU  12   8.286  -6.778 -15.666
   98   3HD2  LEU  12          2HD2      LEU  12   9.035  -5.191 -15.564
   99    H    GLY  13           H        GLY  13   7.210  -5.652 -12.777
  100   1HA   GLY  13          2HA       GLY  13   6.264  -6.910 -10.260
  101   2HA   GLY  13          1HA       GLY  13   8.008  -6.848 -10.523
  102    H    ARG  14           H        ARG  14   7.665  -5.479  -8.435
  103    HA   ARG  14           HA       ARG  14   6.663  -2.757  -8.896
  104   1HB   ARG  14          2HB       ARG  14   7.487  -2.393  -6.545
  105   2HB   ARG  14          1HB       ARG  14   6.329  -3.712  -6.698
  106   1HG   ARG  14          2HG       ARG  14   7.848  -5.088  -5.762
  107   2HG   ARG  14          1HG       ARG  14   8.882  -4.838  -7.169
  108   1HD   ARG  14          2HD       ARG  14  10.216  -3.321  -6.086
  109   2HD   ARG  14          1HD       ARG  14   8.879  -2.666  -5.141
  110    HE   ARG  14           HE       ARG  14   9.337  -5.288  -4.196
  111   1HH1  ARG  14          2HH1      ARG  14  11.578  -2.832  -4.873
  112   2HH1  ARG  14          1HH1      ARG  14  12.280  -2.817  -3.290
  113   1HH2  ARG  14          1HH2      ARG  14   9.972  -5.034  -1.956
  114   2HH2  ARG  14          2HH2      ARG  14  11.371  -4.063  -1.638
  115    H    LYS  15           H        LYS  15   9.701  -4.427  -9.027
  116    HA   LYS  15           HA       LYS  15  11.370  -2.110  -8.723
  117   1HB   LYS  15          2HB       LYS  15  11.835  -4.804  -8.695
  118   2HB   LYS  15          1HB       LYS  15  12.434  -4.367 -10.295
  119   1HG   LYS  15          2HG       LYS  15  13.869  -2.640  -9.312
  120   2HG   LYS  15          1HG       LYS  15  13.234  -3.001  -7.707
  121   1HD   LYS  15          2HD       LYS  15  14.420  -5.228  -9.327
  122   2HD   LYS  15          1HD       LYS  15  15.504  -4.093  -8.523
  123   1HE   LYS  15          2HE       LYS  15  13.366  -4.902  -6.739
  124   2HE   LYS  15          1HE       LYS  15  14.224  -6.311  -7.359
  125   1HZ   LYS  15          2HZ       LYS  15  16.179  -4.477  -6.786
  126   2HZ   LYS  15          1HZ       LYS  15  15.094  -4.355  -5.485
  127   3HZ   LYS  15          3HZ       LYS  15  15.786  -5.854  -5.872
  128    H    ASP  16           H        ASP  16   9.972  -3.868 -11.450
  129    HA   ASP  16           HA       ASP  16  11.285  -2.150 -13.360
  130   1HB   ASP  16          2HB       ASP  16  10.526  -4.611 -13.689
  131   2HB   ASP  16          1HB       ASP  16   8.941  -3.908 -13.986
  132    H    ALA  17           H        ALA  17   8.009  -2.625 -12.122
  133    HA   ALA  17           HA       ALA  17   6.612  -0.735 -13.603
  134   1HB   ALA  17          1HB       ALA  17   5.673  -2.184 -11.762
  135   2HB   ALA  17          3HB       ALA  17   6.343  -1.035 -10.603
  136   3HB   ALA  17          2HB       ALA  17   5.095  -0.517 -11.739
  137    H    GLU  18           H        GLU  18   8.742  -0.179 -10.826
  138    HA   GLU  18           HA       GLU  18   8.350   2.697 -10.832
  139   1HB   GLU  18          2HB       GLU  18  10.348   2.725  -9.353
  140   2HB   GLU  18          1HB       GLU  18   9.155   1.541  -8.817
  141   1HG   GLU  18          2HG       GLU  18  10.410  -0.271  -9.802
  142   2HG   GLU  18          1HG       GLU  18  11.514   0.855 -10.592
  143    H    ARG  19           H        ARG  19  10.662   0.460 -12.317
  144    HA   ARG  19           HA       ARG  19  12.493   2.413 -13.304
  145   1HB   ARG  19          2HB       ARG  19  11.924  -0.417 -13.761
  146   2HB   ARG  19          1HB       ARG  19  12.463   0.407 -15.224
  147   1HG   ARG  19          2HG       ARG  19  14.155   1.410 -13.261
  148   2HG   ARG  19          1HG       ARG  19  13.977  -0.287 -12.817
  149   1HD   ARG  19          2HD       ARG  19  14.323   0.094 -15.700
  150   2HD   ARG  19          1HD       ARG  19  15.691   0.698 -14.765
  151    HE   ARG  19           HE       ARG  19  15.248  -1.776 -13.654
  152   1HH1  ARG  19          2HH1      ARG  19  14.030  -2.589 -16.265
  153   2HH1  ARG  19          1HH1      ARG  19  15.405  -3.168 -17.145
  154   1HH2  ARG  19          1HH2      ARG  19  17.717  -1.663 -15.044
  155   2HH2  ARG  19          2HH2      ARG  19  17.492  -2.644 -16.453
  156    H    GLN  20           H        GLN  20  10.144   0.650 -15.331
  157    HA   GLN  20           HA       GLN  20  10.194   2.300 -17.558
  158   1HB   GLN  20          2HB       GLN  20   8.597   0.189 -16.704
  159   2HB   GLN  20          1HB       GLN  20   7.452   1.516 -16.905
  160   1HG   GLN  20          2HG       GLN  20   7.515   1.161 -19.128
  161   2HG   GLN  20          1HG       GLN  20   9.207   1.657 -19.116
  162   1HE2  GLN  20          2HE2      GLN  20   9.755  -1.633 -20.400
  163   2HE2  GLN  20          1HE2      GLN  20   9.633   0.007 -20.820
  164    H    LEU  21           H        LEU  21   7.797   2.639 -14.901
  165    HA   LEU  21           HA       LEU  21   6.636   5.045 -15.755
  166   1HB   LEU  21          2HB       LEU  21   7.012   3.716 -13.120
  167   2HB   LEU  21          1HB       LEU  21   6.581   5.425 -13.086
  168    HG   LEU  21           HG       LEU  21   4.623   4.995 -14.484
  169   1HD1  LEU  21          2HD1      LEU  21   5.899   2.290 -14.680
  170   2HD1  LEU  21          1HD1      LEU  21   4.142   2.404 -14.766
  171   3HD1  LEU  21          3HD1      LEU  21   5.139   3.261 -15.941
  172   1HD2  LEU  21          3HD2      LEU  21   4.877   3.051 -12.168
  173   2HD2  LEU  21          2HD2      LEU  21   4.326   4.723 -12.071
  174   3HD2  LEU  21          1HD2      LEU  21   3.353   3.523 -12.921
  175    H    LEU  22           H        LEU  22   9.009   5.007 -13.098
  176    HA   LEU  22           HA       LEU  22   9.707   7.679 -13.091
  177   1HB   LEU  22          2HB       LEU  22  11.583   5.314 -12.787
  178   2HB   LEU  22          1HB       LEU  22  11.985   6.969 -12.332
  179    HG   LEU  22           HG       LEU  22   9.902   5.147 -11.119
  180   1HD1  LEU  22          2HD1      LEU  22  12.509   5.743 -10.437
  181   2HD1  LEU  22          1HD1      LEU  22  11.587   6.867  -9.438
  182   3HD1  LEU  22          3HD1      LEU  22  11.285   5.133  -9.324
  183   1HD2  LEU  22          3HD2      LEU  22   9.949   8.121 -11.292
  184   2HD2  LEU  22          2HD2      LEU  22   8.575   7.024 -11.153
  185   3HD2  LEU  22          1HD2      LEU  22   9.541   7.413  -9.730
  186    H    SER  23           H        SER  23  11.960   5.426 -14.703
  187    HA   SER  23           HA       SER  23  13.134   7.359 -16.385
  188   1HB   SER  23          2HB       SER  23  14.044   5.553 -17.628
  189   2HB   SER  23          1HB       SER  23  13.822   4.892 -16.008
  190    HG   SER  23           HG       SER  23  12.645   3.449 -16.947
  191    H    PHE  24           H        PHE  24  11.529   8.736 -17.260
  192    HA   PHE  24           HA       PHE  24   9.987   9.429 -18.882
  193   1HB   PHE  24          2HB       PHE  24  11.083   6.890 -20.021
  194   2HB   PHE  24          1HB       PHE  24   9.619   7.553 -20.747
  195    HD1  PHE  24           HD1      PHE  24   9.732  10.249 -21.035
  196    HD2  PHE  24           HD2      PHE  24  13.103   7.589 -20.936
  197    HE1  PHE  24           HE1      PHE  24  11.094  11.930 -22.247
  198    HE2  PHE  24           HE2      PHE  24  14.466   9.269 -22.148
  199    HZ   PHE  24           HZ       PHE  24  13.461  11.440 -22.804
  200    H    GLY  25           H        GLY  25   8.885   6.236 -19.648
  201   1HA   GLY  25          2HA       GLY  25   6.700   5.375 -19.353
  202   2HA   GLY  25          1HA       GLY  25   7.187   5.438 -17.660
  203    H    ASN  26           H        ASN  26   6.839   8.349 -19.576
  204    HA   ASN  26           HA       ASN  26   5.183  10.032 -19.538
  205   1HB   ASN  26          2HB       ASN  26   3.509   8.300 -17.727
  206   2HB   ASN  26          1HB       ASN  26   2.978   9.503 -18.902
  207   1HD2  ASN  26          2HD2      ASN  26   3.903   7.189 -21.674
  208   2HD2  ASN  26          1HD2      ASN  26   4.342   8.762 -21.211
  209    HA   PRO  27           HA       PRO  27   6.101  12.010 -15.733
  210   1HB   PRO  27          2HB       PRO  27   4.128  13.925 -15.690
  211   2HB   PRO  27          1HB       PRO  27   5.544  13.997 -16.750
  212   1HG   PRO  27          2HG       PRO  27   2.713  13.316 -17.422
  213   2HG   PRO  27          1HG       PRO  27   3.971  14.013 -18.454
  214   1HD   PRO  27          2HD       PRO  27   3.134  11.305 -18.445
  215   2HD   PRO  27          1HD       PRO  27   4.599  11.940 -19.222
  216    H    ARG  28           H        ARG  28   4.814  12.916 -13.664
  217    HA   ARG  28           HA       ARG  28   3.783  10.832 -12.180
  218   1HB   ARG  28          2HB       ARG  28   2.545  12.575 -10.841
  219   2HB   ARG  28          1HB       ARG  28   4.241  12.961 -11.129
  220   1HG   ARG  28          2HG       ARG  28   3.722  14.580 -12.758
  221   2HG   ARG  28          1HG       ARG  28   2.104  13.929 -13.021
  222   1HD   ARG  28          2HD       ARG  28   2.050  14.561 -10.339
  223   2HD   ARG  28          1HD       ARG  28   3.044  15.855 -11.006
  224    HE   ARG  28           HE       ARG  28   0.264  15.243 -11.922
  225   1HH1  ARG  28          1HH2      ARG  28   0.935  16.765 -14.032
  226   2HH1  ARG  28          2HH2      ARG  28   1.026  18.414 -13.510
  227   1HH2  ARG  28          2HH1      ARG  28   1.263  17.613 -10.145
  228   2HH2  ARG  28          1HH1      ARG  28   1.211  18.895 -11.309
  229    H    GLY  29           H        GLY  29   1.627  10.094 -11.668
  230   1HA   GLY  29          2HA       GLY  29  -0.731   9.906 -12.056
  231   2HA   GLY  29          1HA       GLY  29  -0.569  11.005 -13.425
  232    H    THR  30           H        THR  30   1.787   8.514 -13.301
  233    HA   THR  30           HA       THR  30   0.421   7.167 -15.580
  234    HB   THR  30           HB       THR  30   3.242   6.596 -14.705
  235    HG1  THR  30           HG1      THR  30   2.249   8.830 -16.117
  236   1HG2  THR  30          1HG2      THR  30   1.754   5.468 -16.617
  237   2HG2  THR  30          3HG2      THR  30   2.329   6.861 -17.531
  238   3HG2  THR  30          2HG2      THR  30   3.485   5.733 -16.825
  239    H    PHE  31           H        PHE  31  -0.995   5.735 -14.544
  240    HA   PHE  31           HA       PHE  31   0.205   3.883 -12.546
  241   1HB   PHE  31          2HB       PHE  31  -2.731   4.077 -13.199
  242   2HB   PHE  31          1HB       PHE  31  -1.971   3.500 -11.716
  243    HD1  PHE  31           HD1      PHE  31   0.148   5.846 -11.767
  244    HD2  PHE  31           HD2      PHE  31  -4.140   5.689 -11.968
  245    HE1  PHE  31           HE1      PHE  31   0.019   8.131 -10.809
  246    HE2  PHE  31           HE2      PHE  31  -4.268   7.973 -11.012
  247    HZ   PHE  31           HZ       PHE  31  -2.189   9.194 -10.432
  248    H    LEU  32           H        LEU  32   0.952   2.030 -13.444
  249    HA   LEU  32           HA       LEU  32  -0.552   0.911 -15.766
  250   1HB   LEU  32          2HB       LEU  32   1.429   0.021 -16.607
  251   2HB   LEU  32          1HB       LEU  32   2.015   1.507 -15.865
  252    HG   LEU  32           HG       LEU  32   2.066  -1.251 -14.601
  253   1HD1  LEU  32          1HD1      LEU  32   4.045   0.425 -16.080
  254   2HD1  LEU  32          3HD1      LEU  32   4.632  -0.473 -14.679
  255   3HD1  LEU  32          2HD1      LEU  32   3.879  -1.330 -16.025
  256   1HD2  LEU  32          1HD2      LEU  32   2.726   1.507 -13.598
  257   2HD2  LEU  32          3HD2      LEU  32   1.817   0.225 -12.797
  258   3HD2  LEU  32          2HD2      LEU  32   3.570   0.101 -12.953
  259    H    ILE  33           H        ILE  33   0.182  -1.708 -15.681
  260    HA   ILE  33           HA       ILE  33  -0.538  -2.645 -12.945
  261    HB   ILE  33           HB       ILE  33  -1.995  -3.142 -15.520
  262   1HG1  ILE  33          2HG1      ILE  33  -2.738  -2.692 -12.627
  263   2HG1  ILE  33          1HG1      ILE  33  -2.994  -1.600 -13.989
  264   1HG2  ILE  33          2HG2      ILE  33  -1.222  -5.394 -14.769
  265   2HG2  ILE  33          1HG2      ILE  33  -1.993  -5.099 -13.209
  266   3HG2  ILE  33          3HG2      ILE  33  -2.971  -5.203 -14.671
  267   1HD1  ILE  33          2HD1      ILE  33  -4.228  -3.981 -14.777
  268   2HD1  ILE  33          1HD1      ILE  33  -4.644  -3.821 -13.070
  269   3HD1  ILE  33          3HD1      ILE  33  -5.042  -2.527 -14.200
  270    H    ARG  34           H        ARG  34  -0.187  -5.127 -12.845
  271    HA   ARG  34           HA       ARG  34   1.495  -6.481 -14.687
  272   1HB   ARG  34          2HB       ARG  34   3.680  -6.277 -13.517
  273   2HB   ARG  34          1HB       ARG  34   3.138  -4.730 -14.168
  274   1HG   ARG  34          2HG       ARG  34   2.230  -4.127 -11.944
  275   2HG   ARG  34          1HG       ARG  34   2.807  -5.664 -11.300
  276   1HD   ARG  34          2HD       ARG  34   5.127  -5.028 -11.924
  277   2HD   ARG  34          1HD       ARG  34   4.528  -3.469 -12.493
  278    HE   ARG  34           HE       ARG  34   4.881  -2.886 -10.224
  279   1HH1  ARG  34          2HH1      ARG  34   4.546  -6.188 -10.070
  280   2HH1  ARG  34          1HH1      ARG  34   3.620  -6.219  -8.606
  281   1HH2  ARG  34          1HH2      ARG  34   3.122  -2.789  -8.533
  282   2HH2  ARG  34          2HH2      ARG  34   2.814  -4.295  -7.736
  283    H    GLU  35           H        GLU  35   2.193  -8.550 -13.831
  284    HA   GLU  35           HA       GLU  35   0.456  -9.602 -11.801
  285   1HB   GLU  35          2HB       GLU  35   2.743 -10.622 -13.421
  286   2HB   GLU  35          1HB       GLU  35   2.282 -11.533 -11.988
  287   1HG   GLU  35          2HG       GLU  35  -0.096 -11.480 -12.824
  288   2HG   GLU  35          1HG       GLU  35   0.516 -10.778 -14.325
  289    H    SER  36           H        SER  36   0.804  -9.914  -9.626
  290    HA   SER  36           HA       SER  36   3.126  -8.591  -8.418
  291   1HB   SER  36          2HB       SER  36   0.641  -9.921  -7.341
  292   2HB   SER  36          1HB       SER  36   1.967  -9.477  -6.276
  293    HG   SER  36           HG       SER  36   1.052  -7.598  -6.285
  294    H    GLU  37           H        GLU  37   4.960  -9.658  -7.842
  295    HA   GLU  37           HA       GLU  37   5.040 -12.603  -8.090
  296   1HB   GLU  37          2HB       GLU  37   7.156 -10.521  -7.520
  297   2HB   GLU  37          1HB       GLU  37   7.481 -12.250  -7.614
  298   1HG   GLU  37          2HG       GLU  37   6.222 -12.031  -9.936
  299   2HG   GLU  37          1HG       GLU  37   6.709 -10.343  -9.796
  300    H    THR  38           H        THR  38   3.806 -10.842  -5.823
  301    HA   THR  38           HA       THR  38   5.320 -11.825  -3.483
  302    HB   THR  38           HB       THR  38   4.200  -9.496  -3.717
  303    HG1  THR  38           HG1      THR  38   4.627  -9.634  -1.682
  304   1HG2  THR  38          2HG2      THR  38   1.783 -11.196  -3.047
  305   2HG2  THR  38          1HG2      THR  38   1.828  -9.432  -3.032
  306   3HG2  THR  38          3HG2      THR  38   2.034 -10.309  -4.550
  307    H    THR  39           H        THR  39   2.196 -12.163  -5.053
  308    HA   THR  39           HA       THR  39   1.481 -14.384  -3.214
  309    HB   THR  39           HB       THR  39  -0.029 -12.674  -5.191
  310    HG1  THR  39           HG1      THR  39  -0.671 -13.358  -2.534
  311   1HG2  THR  39          2HG2      THR  39  -0.979 -15.224  -3.874
  312   2HG2  THR  39          1HG2      THR  39  -2.023 -14.066  -4.696
  313   3HG2  THR  39          3HG2      THR  39  -0.792 -14.937  -5.602
  314    H    LYS  40           H        LYS  40   0.401 -16.314  -4.439
  315    HA   LYS  40           HA       LYS  40   2.165 -17.783  -5.923
  316   1HB   LYS  40          2HB       LYS  40  -0.732 -17.741  -6.740
  317   2HB   LYS  40          1HB       LYS  40   0.357 -19.125  -6.647
  318   1HG   LYS  40          2HG       LYS  40   0.475 -18.592  -4.118
  319   2HG   LYS  40          1HG       LYS  40  -0.955 -17.600  -4.404
  320   1HD   LYS  40          2HD       LYS  40  -0.715 -20.539  -5.123
  321   2HD   LYS  40          1HD       LYS  40  -1.538 -19.920  -3.690
  322   1HE   LYS  40          2HE       LYS  40  -2.563 -18.436  -5.859
  323   2HE   LYS  40          1HE       LYS  40  -2.516 -20.112  -6.408
  324   1HZ   LYS  40          3HZ       LYS  40  -3.452 -20.370  -3.908
  325   2HZ   LYS  40          2HZ       LYS  40  -4.141 -18.885  -4.361
  326   3HZ   LYS  40          1HZ       LYS  40  -4.430 -20.277  -5.290
  327    H    GLY  41           H        GLY  41   0.192 -15.152  -7.046
  328   1HA   GLY  41          2HA       GLY  41   1.699 -14.179  -9.079
  329   2HA   GLY  41          1HA       GLY  41   0.864 -15.528  -9.861
  330    H    ALA  42           H        ALA  42   0.003 -12.938  -7.567
  331    HA   ALA  42           HA       ALA  42  -2.689 -12.694  -8.670
  332   1HB   ALA  42          3HB       ALA  42  -1.275 -11.847  -6.313
  333   2HB   ALA  42          2HB       ALA  42  -1.999 -10.436  -7.083
  334   3HB   ALA  42          1HB       ALA  42  -3.012 -11.803  -6.620
  335    H    TYR  43           H        TYR  43  -2.882  -9.851  -8.613
  336    HA   TYR  43           HA       TYR  43  -1.179  -9.237 -10.977
  337   1HB   TYR  43          2HB       TYR  43  -4.005  -9.093 -10.691
  338   2HB   TYR  43          1HB       TYR  43  -3.392  -7.445 -10.848
  339    HD1  TYR  43           HD1      TYR  43  -1.122  -7.532 -12.556
  340    HD2  TYR  43           HD2      TYR  43  -4.697  -9.934 -12.744
  341    HE1  TYR  43           HE1      TYR  43  -0.745  -7.938 -14.982
  342    HE2  TYR  43           HE2      TYR  43  -4.310 -10.329 -15.157
  343    HH   TYR  43           HH       TYR  43  -2.787  -8.728 -17.060
  344    H    SER  44           H        SER  44  -1.613  -6.508 -11.140
  345    HA   SER  44           HA       SER  44  -1.072  -5.293  -8.542
  346   1HB   SER  44          2HB       SER  44   1.138  -5.253 -10.559
  347   2HB   SER  44          1HB       SER  44   1.186  -4.801  -8.846
  348    HG   SER  44           HG       SER  44   1.969  -7.009  -9.651
  349    H    LEU  45           H        LEU  45  -0.639  -2.984  -8.699
  350    HA   LEU  45           HA       LEU  45  -1.256  -1.705 -11.302
  351   1HB   LEU  45          2HB       LEU  45  -3.455  -1.792 -10.359
  352   2HB   LEU  45          1HB       LEU  45  -2.860  -1.367  -8.754
  353    HG   LEU  45           HG       LEU  45  -2.361   0.875  -9.435
  354   1HD1  LEU  45          2HD1      LEU  45  -2.480  -0.346 -12.137
  355   2HD1  LEU  45          1HD1      LEU  45  -3.096   1.303 -12.011
  356   3HD1  LEU  45          3HD1      LEU  45  -1.439   0.941 -11.528
  357   1HD2  LEU  45          3HD2      LEU  45  -5.006  -0.249 -10.211
  358   2HD2  LEU  45          2HD2      LEU  45  -4.617   0.993  -9.020
  359   3HD2  LEU  45          1HD2      LEU  45  -4.656   1.398 -10.736
  360    H    SER  46           H        SER  46   0.859  -0.856 -11.306
  361    HA   SER  46           HA       SER  46   1.859   0.562  -8.933
  362   1HB   SER  46          2HB       SER  46   3.449   0.974 -11.306
  363   2HB   SER  46          1HB       SER  46   3.869   0.122  -9.824
  364    HG   SER  46           HG       SER  46   2.904  -1.720 -10.627
  365    H    ILE  47           H        ILE  47   2.548   2.796  -9.010
  366    HA   ILE  47           HA       ILE  47   1.157   4.428 -11.080
  367    HB   ILE  47           HB       ILE  47   0.143   5.820  -9.511
  368   1HG1  ILE  47          2HG1      ILE  47   2.022   4.763  -7.372
  369   2HG1  ILE  47          1HG1      ILE  47   2.271   6.270  -8.256
  370   1HG2  ILE  47          1HG2      ILE  47   0.300   3.040  -8.335
  371   2HG2  ILE  47          3HG2      ILE  47  -0.710   4.297  -7.624
  372   3HG2  ILE  47          2HG2      ILE  47  -1.008   3.756  -9.276
  373   1HD1  ILE  47          2HD1      ILE  47  -0.317   5.736  -6.804
  374   2HD1  ILE  47          1HD1      ILE  47   1.080   6.398  -5.955
  375   3HD1  ILE  47          3HD1      ILE  47   0.367   7.283  -7.304
  376    H    ARG  48           H        ARG  48   2.238   6.387 -11.625
  377    HA   ARG  48           HA       ARG  48   5.083   6.459 -10.742
  378   1HB   ARG  48          2HB       ARG  48   4.371   6.371 -13.235
  379   2HB   ARG  48          1HB       ARG  48   3.916   8.061 -13.016
  380   1HG   ARG  48          2HG       ARG  48   6.624   7.139 -12.105
  381   2HG   ARG  48          1HG       ARG  48   6.353   7.451 -13.819
  382   1HD   ARG  48          2HD       ARG  48   5.174   9.620 -12.456
  383   2HD   ARG  48          1HD       ARG  48   6.726   9.346 -11.664
  384    HE   ARG  48           HE       ARG  48   6.918   9.344 -14.575
  385   1HH1  ARG  48          2HH1      ARG  48   6.455  11.397 -11.859
  386   2HH1  ARG  48          1HH1      ARG  48   7.495  12.648 -12.453
  387   1HH2  ARG  48          1HH2      ARG  48   8.441  10.885 -15.285
  388   2HH2  ARG  48          2HH2      ARG  48   8.620  12.358 -14.391
  389    H    ASP  49           H        ASP  49   5.165   7.723  -8.917
  390    HA   ASP  49           HA       ASP  49   3.725  10.336  -9.015
  391   1HB   ASP  49          2HB       ASP  49   4.550   9.934  -6.379
  392   2HB   ASP  49          1HB       ASP  49   2.923   9.689  -7.006
  393    H    TRP  50           H        TRP  50   4.969  12.136  -9.110
  394    HA   TRP  50           HA       TRP  50   7.819  11.946  -8.200
  395   1HB   TRP  50          2HB       TRP  50   8.069  12.078 -10.549
  396   2HB   TRP  50          1HB       TRP  50   6.667  13.129 -10.731
  397    HD1  TRP  50           HD1      TRP  50  10.380  13.239 -10.224
  398    HE1  TRP  50           HE1      TRP  50  11.154  15.681  -9.929
  399    HE3  TRP  50           HE3      TRP  50   5.874  15.479  -9.780
  400    HZ2  TRP  50           HZ2      TRP  50   9.966  18.284  -9.612
  401    HZ3  TRP  50           HZ3      TRP  50   5.688  17.930  -9.490
  402    HH2  TRP  50           HH2      TRP  50   7.723  19.339  -9.409
  403    H    ASP  51           H        ASP  51   8.685  14.195  -7.709
  404    HA   ASP  51           HA       ASP  51   6.674  16.219  -6.994
  405   1HB   ASP  51          2HB       ASP  51   7.635  14.323  -5.071
  406   2HB   ASP  51          1HB       ASP  51   8.298  15.906  -4.668
  407    H    ASP  52           H        ASP  52   7.684  18.295  -6.603
  408    HA   ASP  52           HA       ASP  52  10.371  18.490  -7.811
  409   1HB   ASP  52          2HB       ASP  52   9.864  21.042  -7.275
  410   2HB   ASP  52          1HB       ASP  52   9.113  20.244  -8.651
  411    H    MET  53           H        MET  53  10.258  17.237  -5.231
  412    HA   MET  53           HA       MET  53  12.025  19.079  -3.784
  413   1HB   MET  53          2HB       MET  53   9.721  17.605  -2.481
  414   2HB   MET  53          1HB       MET  53  10.939  18.549  -1.628
  415   1HG   MET  53          2HG       MET  53   9.874  20.485  -2.081
  416   2HG   MET  53          1HG       MET  53   9.728  20.081  -3.788
  417   1HE   MET  53          2HE       MET  53   8.699  17.706  -4.036
  418   2HE   MET  53          1HE       MET  53   7.360  17.071  -3.083
  419   3HE   MET  53          3HE       MET  53   7.044  18.137  -4.459
  420    H    LYS  54           H        LYS  54  11.878  16.301  -5.298
  421    HA   LYS  54           HA       LYS  54  14.019  15.129  -3.798
  422   1HB   LYS  54          2HB       LYS  54  12.766  12.976  -3.274
  423   2HB   LYS  54          1HB       LYS  54  12.348  14.368  -2.274
  424   1HG   LYS  54          2HG       LYS  54  10.321  14.743  -3.453
  425   2HG   LYS  54          1HG       LYS  54  10.818  13.713  -4.796
  426   1HD   LYS  54          2HD       LYS  54   9.897  11.922  -3.791
  427   2HD   LYS  54          1HD       LYS  54  10.908  12.179  -2.368
  428   1HE   LYS  54          2HE       LYS  54   9.120  14.120  -1.925
  429   2HE   LYS  54          1HE       LYS  54   8.099  13.052  -2.886
  430   1HZ   LYS  54          3HZ       LYS  54   8.987  11.236  -1.331
  431   2HZ   LYS  54          2HZ       LYS  54   9.426  12.518  -0.308
  432   3HZ   LYS  54          1HZ       LYS  54   7.799  12.291  -0.739
  433    H    GLY  55           H        GLY  55  11.636  14.829  -6.392
  434   1HA   GLY  55          2HA       GLY  55  12.804  14.275  -8.582
  435   2HA   GLY  55          1HA       GLY  55  13.463  12.911  -7.692
  436    H    ASP  56           H        ASP  56  12.278  11.738  -9.521
  437    HA   ASP  56           HA       ASP  56   9.362  11.702  -9.316
  438   1HB   ASP  56          2HB       ASP  56  10.951   9.603 -10.765
  439   2HB   ASP  56          1HB       ASP  56   9.420  10.348 -11.209
  440    H    HIS  57           H        HIS  57   8.381   9.363  -9.190
  441    HA   HIS  57           HA       HIS  57   9.755   7.440  -7.518
  442   1HB   HIS  57          2HB       HIS  57   7.826   9.384  -6.288
  443   2HB   HIS  57          1HB       HIS  57   7.855   7.723  -5.701
  444    HD1  HIS  57           HD1      HIS  57   8.925  10.361  -4.157
  445    HD2  HIS  57           HD2      HIS  57  11.250   7.464  -6.051
  446    HE1  HIS  57           HE1      HIS  57  11.222  10.480  -3.097
  447    H    VAL  58           H        VAL  58   7.824   5.871  -6.654
  448    HA   VAL  58           HA       VAL  58   5.567   5.755  -8.507
  449    HB   VAL  58           HB       VAL  58   8.045   4.191  -8.895
  450   1HG1  VAL  58          3HG1      VAL  58   5.321   2.856  -8.954
  451   2HG1  VAL  58          2HG1      VAL  58   6.731   2.218  -9.801
  452   3HG1  VAL  58          1HG1      VAL  58   6.743   2.345  -8.043
  453   1HG2  VAL  58          3HG2      VAL  58   7.035   5.787 -10.522
  454   2HG2  VAL  58          2HG2      VAL  58   7.258   4.169 -11.187
  455   3HG2  VAL  58          1HG2      VAL  58   5.656   4.700 -10.677
  456    H    LYS  59           H        LYS  59   3.885   4.903  -7.393
  457    HA   LYS  59           HA       LYS  59   4.464   3.418  -4.878
  458   1HB   LYS  59          2HB       LYS  59   2.701   5.469  -5.380
  459   2HB   LYS  59          1HB       LYS  59   1.660   4.055  -5.539
  460   1HG   LYS  59          2HG       LYS  59   1.549   4.544  -3.237
  461   2HG   LYS  59          1HG       LYS  59   2.767   3.271  -3.318
  462   1HD   LYS  59          2HD       LYS  59   4.029   5.826  -3.740
  463   2HD   LYS  59          1HD       LYS  59   3.072   5.884  -2.260
  464   1HE   LYS  59          2HE       LYS  59   4.534   3.372  -2.512
  465   2HE   LYS  59          1HE       LYS  59   5.614   4.766  -2.526
  466   1HZ   LYS  59          2HZ       LYS  59   3.464   4.396  -0.519
  467   2HZ   LYS  59          1HZ       LYS  59   5.062   3.870  -0.277
  468   3HZ   LYS  59          3HZ       LYS  59   4.736   5.522  -0.482
  469    H    HIS  60           H        HIS  60   2.227   1.845  -4.626
  470    HA   HIS  60           HA       HIS  60   1.748   0.431  -7.141
  471   1HB   HIS  60          2HB       HIS  60   3.094  -1.119  -4.936
  472   2HB   HIS  60          1HB       HIS  60   2.765  -1.643  -6.585
  473    HD1  HIS  60           HD1      HIS  60   4.410  -0.971  -8.405
  474    HD2  HIS  60           HD2      HIS  60   5.264   0.807  -4.733
  475    HE1  HIS  60           HE1      HIS  60   6.681   0.122  -8.652
  476    H    TYR  61           H        TYR  61   0.139  -1.168  -6.979
  477    HA   TYR  61           HA       TYR  61  -1.292  -1.365  -4.379
  478   1HB   TYR  61          2HB       TYR  61  -2.473  -0.505  -7.036
  479   2HB   TYR  61          1HB       TYR  61  -3.470  -1.135  -5.724
  480    HD1  TYR  61           HD1      TYR  61  -3.496   0.052  -3.505
  481    HD2  TYR  61           HD2      TYR  61  -1.582   1.713  -6.973
  482    HE1  TYR  61           HE1      TYR  61  -3.480   2.285  -2.426
  483    HE2  TYR  61           HE2      TYR  61  -1.565   3.946  -5.894
  484    HH   TYR  61           HH       TYR  61  -1.651   4.900  -3.648
  485    H    LYS  62           H        LYS  62  -0.586  -3.528  -4.226
  486    HA   LYS  62           HA       LYS  62  -0.502  -5.469  -6.230
  487   1HB   LYS  62          2HB       LYS  62   0.278  -5.804  -3.896
  488   2HB   LYS  62          1HB       LYS  62  -1.393  -5.909  -3.362
  489   1HG   LYS  62          2HG       LYS  62  -0.787  -7.671  -5.629
  490   2HG   LYS  62          1HG       LYS  62   0.173  -8.035  -4.194
  491   1HD   LYS  62          2HD       LYS  62  -2.687  -7.496  -3.672
  492   2HD   LYS  62          1HD       LYS  62  -2.366  -8.958  -4.606
  493   1HE   LYS  62          2HE       LYS  62  -0.599  -8.519  -2.265
  494   2HE   LYS  62          1HE       LYS  62  -2.287  -8.873  -1.890
  495   1HZ   LYS  62          1HZ       LYS  62  -1.509 -10.597  -3.929
  496   2HZ   LYS  62          3HZ       LYS  62  -0.276 -10.636  -2.766
  497   3HZ   LYS  62          2HZ       LYS  62  -1.876 -10.989  -2.318
  498    H    ILE  63           H        ILE  63  -2.062  -6.172  -7.580
  499    HA   ILE  63           HA       ILE  63  -4.879  -5.631  -6.951
  500    HB   ILE  63           HB       ILE  63  -3.315  -6.445  -9.336
  501   1HG1  ILE  63          2HG1      ILE  63  -5.595  -4.572  -8.702
  502   2HG1  ILE  63          1HG1      ILE  63  -3.931  -4.147  -9.102
  503   1HG2  ILE  63          3HG2      ILE  63  -5.009  -8.266  -9.164
  504   2HG2  ILE  63          2HG2      ILE  63  -6.280  -7.045  -9.090
  505   3HG2  ILE  63          1HG2      ILE  63  -5.305  -7.214 -10.549
  506   1HD1  ILE  63          3HD1      ILE  63  -4.270  -5.153 -11.360
  507   2HD1  ILE  63          2HD1      ILE  63  -5.959  -5.442 -10.942
  508   3HD1  ILE  63          1HD1      ILE  63  -5.348  -3.791 -11.054
  509    H    ARG  64           H        ARG  64  -6.080  -7.058  -5.834
  510    HA   ARG  64           HA       ARG  64  -5.145  -9.803  -5.413
  511   1HB   ARG  64          2HB       ARG  64  -7.722  -8.468  -4.520
  512   2HB   ARG  64          1HB       ARG  64  -7.081  -9.998  -3.923
  513   1HG   ARG  64          2HG       ARG  64  -5.617  -7.352  -3.711
  514   2HG   ARG  64          1HG       ARG  64  -6.593  -8.046  -2.415
  515   1HD   ARG  64          2HD       ARG  64  -4.603  -9.875  -3.624
  516   2HD   ARG  64          1HD       ARG  64  -3.929  -8.521  -2.715
  517    HE   ARG  64           HE       ARG  64  -6.058  -9.898  -1.277
  518   1HH1  ARG  64          1HH2      ARG  64  -3.982  -8.766   0.332
  519   2HH1  ARG  64          2HH2      ARG  64  -2.920 -10.090   0.678
  520   1HH2  ARG  64          2HH1      ARG  64  -4.141 -12.082  -1.884
  521   2HH2  ARG  64          1HH1      ARG  64  -3.011 -11.968  -0.577
  522    H    LYS  65           H        LYS  65  -7.091 -11.513  -5.612
  523    HA   LYS  65           HA       LYS  65  -8.851 -10.975  -7.886
  524   1HB   LYS  65          2HB       LYS  65  -6.821 -11.475  -9.111
  525   2HB   LYS  65          1HB       LYS  65  -6.542 -12.919  -8.138
  526   1HG   LYS  65          2HG       LYS  65  -8.768 -13.793  -8.975
  527   2HG   LYS  65          1HG       LYS  65  -8.799 -12.435 -10.100
  528   1HD   LYS  65          2HD       LYS  65  -7.467 -13.574 -11.512
  529   2HD   LYS  65          1HD       LYS  65  -6.223 -13.670 -10.266
  530   1HE   LYS  65          2HE       LYS  65  -8.088 -15.552  -9.443
  531   2HE   LYS  65          1HE       LYS  65  -8.086 -15.730 -11.197
  532   1HZ   LYS  65          2HZ       LYS  65  -5.463 -15.432 -10.052
  533   2HZ   LYS  65          1HZ       LYS  65  -6.277 -16.827  -9.525
  534   3HZ   LYS  65          3HZ       LYS  65  -6.032 -16.564 -11.183
  535    H    LEU  66           H        LEU  66 -10.689 -12.009  -7.450
  536    HA   LEU  66           HA       LEU  66 -10.826 -14.065  -5.383
  537   1HB   LEU  66          2HB       LEU  66 -12.851 -12.884  -7.292
  538   2HB   LEU  66          1HB       LEU  66 -13.255 -14.208  -6.205
  539    HG   LEU  66           HG       LEU  66 -13.894 -12.278  -5.012
  540   1HD1  LEU  66          2HD1      LEU  66 -12.012 -13.887  -3.957
  541   2HD1  LEU  66          1HD1      LEU  66 -11.133 -12.358  -3.909
  542   3HD1  LEU  66          3HD1      LEU  66 -12.680 -12.512  -3.078
  543   1HD2  LEU  66          3HD2      LEU  66 -11.274 -11.076  -5.936
  544   2HD2  LEU  66          2HD2      LEU  66 -12.894 -10.593  -6.436
  545   3HD2  LEU  66          1HD2      LEU  66 -12.361 -10.307  -4.781
  546    H    ASP  67           H        ASP  67 -11.271 -16.269  -5.687
  547    HA   ASP  67           HA       ASP  67 -10.256 -17.421  -8.147
  548   1HB   ASP  67          2HB       ASP  67 -11.124 -18.354  -5.521
  549   2HB   ASP  67          1HB       ASP  67 -11.686 -19.414  -6.811
  550    H    ASN  68           H        ASN  68 -13.258 -16.253  -7.030
  551    HA   ASN  68           HA       ASN  68 -14.884 -17.827  -8.918
  552   1HB   ASN  68          2HB       ASN  68 -15.600 -15.426  -7.201
  553   2HB   ASN  68          1HB       ASN  68 -16.745 -16.451  -8.070
  554   1HD2  ASN  68          2HD2      ASN  68 -15.487 -17.589  -4.429
  555   2HD2  ASN  68          1HD2      ASN  68 -15.188 -16.046  -5.069
  556    H    GLY  69           H        GLY  69 -12.872 -15.141  -9.041
  557   1HA   GLY  69          2HA       GLY  69 -12.416 -14.044 -11.157
  558   2HA   GLY  69          1HA       GLY  69 -14.103 -14.296 -11.586
  559    H    GLY  70           H        GLY  70 -11.946 -12.389  -9.548
  560   1HA   GLY  70          2HA       GLY  70 -13.711 -10.118  -9.734
  561   2HA   GLY  70          1HA       GLY  70 -13.635 -10.786  -8.118
  562    H    TYR  71           H        TYR  71 -11.747  -9.152 -10.640
  563    HA   TYR  71           HA       TYR  71  -9.290  -9.129  -9.084
  564   1HB   TYR  71          2HB       TYR  71 -10.281  -7.678 -11.529
  565   2HB   TYR  71          1HB       TYR  71  -8.841  -7.086 -10.707
  566    HD1  TYR  71           HD1      TYR  71  -7.740  -9.773  -9.766
  567    HD2  TYR  71           HD2      TYR  71  -9.319  -8.485 -13.547
  568    HE1  TYR  71           HE1      TYR  71  -6.388 -11.497 -10.926
  569    HE2  TYR  71           HE2      TYR  71  -7.977 -10.205 -14.703
  570    HH   TYR  71           HH       TYR  71  -6.876 -12.718 -13.612
  571    H    TYR  72           H        TYR  72  -8.988  -7.897  -7.262
  572    HA   TYR  72           HA       TYR  72 -10.237  -5.197  -7.150
  573   1HB   TYR  72          2HB       TYR  72 -11.152  -5.571  -4.931
  574   2HB   TYR  72          1HB       TYR  72 -11.796  -6.796  -6.016
  575    HD1  TYR  72           HD1      TYR  72 -10.967  -9.118  -5.926
  576    HD2  TYR  72           HD2      TYR  72  -9.584  -6.153  -3.164
  577    HE1  TYR  72           HE1      TYR  72 -10.004 -10.899  -4.502
  578    HE2  TYR  72           HE2      TYR  72  -8.626  -7.908  -1.734
  579    HH   TYR  72           HH       TYR  72  -9.362 -10.720  -1.534
  580    H    ILE  73           H        ILE  73  -8.645  -3.766  -6.431
  581    HA   ILE  73           HA       ILE  73  -6.197  -4.860  -5.227
  582    HB   ILE  73           HB       ILE  73  -7.096  -1.979  -5.645
  583   1HG1  ILE  73          2HG1      ILE  73  -4.959  -3.588  -7.066
  584   2HG1  ILE  73          1HG1      ILE  73  -6.588  -3.350  -7.698
  585   1HG2  ILE  73          2HG2      ILE  73  -5.408  -2.631  -3.725
  586   2HG2  ILE  73          1HG2      ILE  73  -4.276  -2.795  -5.067
  587   3HG2  ILE  73          3HG2      ILE  73  -5.076  -1.251  -4.773
  588   1HD1  ILE  73          2HD1      ILE  73  -4.951  -0.972  -6.861
  589   2HD1  ILE  73          1HD1      ILE  73  -4.674  -1.713  -8.436
  590   3HD1  ILE  73          3HD1      ILE  73  -6.262  -1.058  -8.036
  591    H    THR  74           H        THR  74  -9.215  -3.507  -4.305
  592    HA   THR  74           HA       THR  74  -8.525  -3.905  -1.446
  593    HB   THR  74           HB       THR  74  -8.786  -1.678  -1.140
  594    HG1  THR  74           HG1      THR  74 -10.945  -1.043  -0.955
  595   1HG2  THR  74          2HG2      THR  74  -8.632  -1.425  -3.682
  596   2HG2  THR  74          1HG2      THR  74 -10.396  -1.383  -3.678
  597   3HG2  THR  74          3HG2      THR  74  -9.482  -0.138  -2.826
  598    H    THR  75           H        THR  75 -10.117  -5.003  -0.347
  599    HA   THR  75           HA       THR  75 -11.904  -6.606  -1.872
  600    HB   THR  75           HB       THR  75 -12.812  -7.323   0.300
  601    HG1  THR  75           HG1      THR  75 -12.808  -5.269   1.299
  602   1HG2  THR  75          1HG2      THR  75 -10.101  -7.350  -0.581
  603   2HG2  THR  75          3HG2      THR  75 -10.094  -7.219   1.181
  604   3HG2  THR  75          2HG2      THR  75 -10.939  -8.558   0.401
  605    H    ARG  76           H        ARG  76 -12.244  -3.366  -1.048
  606    HA   ARG  76           HA       ARG  76 -15.074  -3.246  -0.583
  607   1HB   ARG  76          2HB       ARG  76 -13.150  -1.427  -0.317
  608   2HB   ARG  76          1HB       ARG  76 -13.646  -1.003  -1.955
  609   1HG   ARG  76          2HG       ARG  76 -16.051  -1.351  -0.570
  610   2HG   ARG  76          1HG       ARG  76 -15.008  -0.502   0.572
  611   1HD   ARG  76          2HD       ARG  76 -14.601   1.275  -0.991
  612   2HD   ARG  76          1HD       ARG  76 -15.343   0.369  -2.309
  613    HE   ARG  76           HE       ARG  76 -17.037   1.107   0.020
  614   1HH1  ARG  76          2HH1      ARG  76 -18.114   0.000  -2.574
  615   2HH1  ARG  76          1HH1      ARG  76 -18.688   1.434  -3.356
  616   1HH2  ARG  76          1HH2      ARG  76 -16.920   3.586  -1.290
  617   2HH2  ARG  76          2HH2      ARG  76 -18.011   3.465  -2.629
  618    H    ALA  77           H        ALA  77 -13.173  -3.760  -3.460
  619    HA   ALA  77           HA       ALA  77 -15.635  -4.050  -5.012
  620   1HB   ALA  77          3HB       ALA  77 -13.843  -1.674  -5.364
  621   2HB   ALA  77          2HB       ALA  77 -14.676  -2.347  -6.766
  622   3HB   ALA  77          1HB       ALA  77 -15.604  -1.756  -5.386
  623    H    GLN  78           H        GLN  78 -15.331  -5.558  -6.552
  624    HA   GLN  78           HA       GLN  78 -12.575  -6.120  -7.534
  625   1HB   GLN  78          2HB       GLN  78 -13.868  -8.499  -7.885
  626   2HB   GLN  78          1HB       GLN  78 -12.883  -8.136  -6.476
  627   1HG   GLN  78          2HG       GLN  78 -15.803  -7.418  -6.547
  628   2HG   GLN  78          1HG       GLN  78 -15.276  -9.029  -6.066
  629   1HE2  GLN  78          2HE2      GLN  78 -13.385  -7.571  -3.216
  630   2HE2  GLN  78          1HE2      GLN  78 -13.024  -8.567  -4.543
  631    H    PHE  79           H        PHE  79 -12.768  -7.378  -9.731
  632    HA   PHE  79           HA       PHE  79 -15.195  -6.559 -11.245
  633   1HB   PHE  79          2HB       PHE  79 -12.354  -5.746 -11.877
  634   2HB   PHE  79          1HB       PHE  79 -13.628  -5.746 -13.098
  635    HD1  PHE  79           HD1      PHE  79 -12.893  -4.519  -9.643
  636    HD2  PHE  79           HD2      PHE  79 -15.033  -3.874 -13.309
  637    HE1  PHE  79           HE1      PHE  79 -13.721  -2.360  -8.775
  638    HE2  PHE  79           HE2      PHE  79 -15.858  -1.701 -12.444
  639    HZ   PHE  79           HZ       PHE  79 -15.203  -0.942 -10.173
  640    H    GLU  80           H        GLU  80 -14.410  -7.334 -13.767
  641    HA   GLU  80           HA       GLU  80 -13.985 -10.230 -13.300
  642   1HB   GLU  80          2HB       GLU  80 -14.841 -10.448 -15.650
  643   2HB   GLU  80          1HB       GLU  80 -15.982  -9.663 -14.558
  644   1HG   GLU  80          2HG       GLU  80 -14.318  -7.623 -15.616
  645   2HG   GLU  80          1HG       GLU  80 -14.829  -8.627 -16.973
  646    H    THR  81           H        THR  81 -12.540  -7.439 -14.843
  647    HA   THR  81           HA       THR  81 -10.147  -9.106 -15.409
  648    HB   THR  81           HB       THR  81 -10.864  -9.168 -17.605
  649    HG1  THR  81           HG1      THR  81 -10.227  -6.552 -18.052
  650   1HG2  THR  81          2HG2      THR  81 -12.983  -7.900 -16.901
  651   2HG2  THR  81          1HG2      THR  81 -12.108  -6.448 -17.382
  652   3HG2  THR  81          3HG2      THR  81 -12.449  -7.706 -18.566
  653    H    LEU  82           H        LEU  82  -8.379  -7.453 -16.299
  654    HA   LEU  82           HA       LEU  82  -8.191  -5.384 -14.235
  655   1HB   LEU  82          2HB       LEU  82  -6.240  -5.967 -16.475
  656   2HB   LEU  82          1HB       LEU  82  -5.911  -5.121 -14.961
  657    HG   LEU  82           HG       LEU  82  -7.084  -7.626 -14.293
  658   1HD1  LEU  82          1HD1      LEU  82  -6.203  -8.086 -16.715
  659   2HD1  LEU  82          3HD1      LEU  82  -4.614  -8.087 -15.942
  660   3HD1  LEU  82          2HD1      LEU  82  -5.850  -9.243 -15.431
  661   1HD2  LEU  82          1HD2      LEU  82  -5.098  -6.001 -13.371
  662   2HD2  LEU  82          3HD2      LEU  82  -5.365  -7.650 -12.807
  663   3HD2  LEU  82          2HD2      LEU  82  -4.155  -7.328 -14.049
  664    H    GLN  83           H        GLN  83  -8.708  -5.626 -17.696
  665    HA   GLN  83           HA       GLN  83  -8.465  -2.798 -18.230
  666   1HB   GLN  83          2HB       GLN  83  -8.313  -4.333 -20.093
  667   2HB   GLN  83          1HB       GLN  83  -9.880  -5.041 -19.702
  668   1HG   GLN  83          2HG       GLN  83  -9.893  -3.354 -21.610
  669   2HG   GLN  83          1HG       GLN  83 -11.037  -3.030 -20.307
  670   1HE2  GLN  83          2HE2      GLN  83  -9.689   0.202 -19.957
  671   2HE2  GLN  83          1HE2      GLN  83 -11.071  -0.775 -20.083
  672    H    GLN  84           H        GLN  84 -10.917  -4.884 -16.930
  673    HA   GLN  84           HA       GLN  84 -13.114  -3.005 -17.314
  674   1HB   GLN  84          2HB       GLN  84 -12.752  -5.637 -15.945
  675   2HB   GLN  84          1HB       GLN  84 -14.138  -4.644 -15.526
  676   1HG   GLN  84          2HG       GLN  84 -14.374  -6.379 -17.471
  677   2HG   GLN  84          1HG       GLN  84 -15.060  -4.777 -17.661
  678   1HE2  GLN  84          2HE2      GLN  84 -12.719  -5.935 -20.546
  679   2HE2  GLN  84          1HE2      GLN  84 -13.751  -6.890 -19.595
  680    H    LEU  85           H        LEU  85 -10.911  -3.899 -14.699
  681    HA   LEU  85           HA       LEU  85 -12.226  -2.128 -12.775
  682   1HB   LEU  85          2HB       LEU  85 -10.722  -2.928 -11.229
  683   2HB   LEU  85          1HB       LEU  85 -10.546  -4.212 -12.423
  684    HG   LEU  85           HG       LEU  85  -8.791  -2.325 -13.363
  685   1HD1  LEU  85          2HD1      LEU  85  -9.247  -1.846 -10.503
  686   2HD1  LEU  85          1HD1      LEU  85  -7.552  -2.134 -10.903
  687   3HD1  LEU  85          3HD1      LEU  85  -8.437  -0.833 -11.700
  688   1HD2  LEU  85          3HD2      LEU  85  -8.747  -4.922 -12.410
  689   2HD2  LEU  85          2HD2      LEU  85  -7.407  -4.068 -13.175
  690   3HD2  LEU  85          1HD2      LEU  85  -7.550  -4.090 -11.416
  691    H    VAL  86           H        VAL  86  -9.739  -1.814 -15.186
  692    HA   VAL  86           HA       VAL  86  -8.892   0.779 -14.172
  693    HB   VAL  86           HB       VAL  86  -7.512   0.937 -16.132
  694   1HG1  VAL  86          3HG1      VAL  86  -7.695  -1.614 -14.694
  695   2HG1  VAL  86          2HG1      VAL  86  -6.911  -1.756 -16.267
  696   3HG1  VAL  86          1HG1      VAL  86  -6.277  -0.634 -15.064
  697   1HG2  VAL  86          2HG2      VAL  86  -9.344   0.333 -17.728
  698   2HG2  VAL  86          1HG2      VAL  86  -7.817  -0.470 -18.093
  699   3HG2  VAL  86          3HG2      VAL  86  -9.109  -1.357 -17.289
  700    H    GLN  87           H        GLN  87 -11.322  -0.626 -16.114
  701    HA   GLN  87           HA       GLN  87 -12.153   1.669 -17.614
  702   1HB   GLN  87          2HB       GLN  87 -12.795  -0.713 -18.094
  703   2HB   GLN  87          1HB       GLN  87 -13.827  -0.665 -16.675
  704   1HG   GLN  87          2HG       GLN  87 -15.247   0.968 -17.608
  705   2HG   GLN  87          1HG       GLN  87 -14.077   1.401 -18.854
  706   1HE2  GLN  87          2HE2      GLN  87 -16.707  -0.857 -20.340
  707   2HE2  GLN  87          1HE2      GLN  87 -16.772   0.622 -19.510
  708    H    HIS  88           H        HIS  88 -13.180   0.214 -14.562
  709    HA   HIS  88           HA       HIS  88 -15.124   2.309 -14.022
  710   1HB   HIS  88          2HB       HIS  88 -15.068  -0.198 -13.233
  711   2HB   HIS  88          1HB       HIS  88 -14.059   0.440 -11.942
  712    HD1  HIS  88           HD1      HIS  88 -16.853  -0.654 -11.251
  713    HD2  HIS  88           HD2      HIS  88 -16.116   3.350 -12.144
  714    HE1  HIS  88           HE1      HIS  88 -18.744   0.671 -10.212
  715    H    TYR  89           H        TYR  89 -11.891   1.463 -13.142
  716    HA   TYR  89           HA       TYR  89 -11.565   3.491 -11.094
  717   1HB   TYR  89          2HB       TYR  89  -9.669   1.686 -12.602
  718   2HB   TYR  89          1HB       TYR  89  -9.101   2.859 -11.425
  719    HD1  TYR  89           HD1      TYR  89 -12.215   0.791 -11.298
  720    HD2  TYR  89           HD2      TYR  89  -8.298   1.481  -9.677
  721    HE1  TYR  89           HE1      TYR  89 -12.666  -0.846  -9.527
  722    HE2  TYR  89           HE2      TYR  89  -8.756  -0.177  -7.892
  723    HH   TYR  89           HH       TYR  89 -11.318  -1.068  -6.826
  724    H    SER  90           H        SER  90 -11.753   3.551 -14.452
  725    HA   SER  90           HA       SER  90  -9.829   5.651 -14.944
  726   1HB   SER  90          2HB       SER  90 -11.514   3.920 -16.509
  727   2HB   SER  90          1HB       SER  90 -11.738   5.592 -17.024
  728    HG   SER  90           HG       SER  90 -10.010   4.821 -18.143
  729    H    GLU  91           H        GLU  91 -13.263   5.421 -14.249
  730    HA   GLU  91           HA       GLU  91 -13.592   8.338 -14.657
  731   1HB   GLU  91          2HB       GLU  91 -15.656   6.316 -13.735
  732   2HB   GLU  91          1HB       GLU  91 -15.957   7.938 -14.357
  733   1HG   GLU  91          2HG       GLU  91 -14.419   6.712 -16.343
  734   2HG   GLU  91          1HG       GLU  91 -15.537   5.453 -15.819
  735    H    ARG  92           H        ARG  92 -13.023   5.989 -12.203
  736    HA   ARG  92           HA       ARG  92 -13.198   8.159 -10.166
  737   1HB   ARG  92          2HB       ARG  92 -14.138   6.430  -8.565
  738   2HB   ARG  92          1HB       ARG  92 -15.238   6.956  -9.835
  739   1HG   ARG  92          2HG       ARG  92 -15.018   4.956 -11.039
  740   2HG   ARG  92          1HG       ARG  92 -13.482   4.556 -10.269
  741   1HD   ARG  92          2HD       ARG  92 -15.622   3.268  -9.516
  742   2HD   ARG  92          1HD       ARG  92 -14.520   3.864  -8.275
  743    HE   ARG  92           HE       ARG  92 -16.122   5.582  -7.730
  744   1HH1  ARG  92          1HH2      ARG  92 -17.418   6.594  -9.971
  745   2HH1  ARG  92          2HH2      ARG  92 -18.914   5.730 -10.103
  746   1HH2  ARG  92          2HH1      ARG  92 -17.900   3.129  -8.045
  747   2HH2  ARG  92          1HH1      ARG  92 -19.187   3.769  -9.012
  748    H    ALA  93           H        ALA  93 -12.124   7.319  -8.062
  749    HA   ALA  93           HA       ALA  93  -9.486   6.269  -8.817
  750   1HB   ALA  93          1HB       ALA  93 -10.616   7.033  -6.102
  751   2HB   ALA  93          3HB       ALA  93  -8.926   6.643  -6.428
  752   3HB   ALA  93          2HB       ALA  93  -9.655   8.079  -7.148
  753    H    ALA  94           H        ALA  94 -12.377   5.173  -7.168
  754    HA   ALA  94           HA       ALA  94 -13.090   2.932  -6.920
  755   1HB   ALA  94          2HB       ALA  94 -10.907   2.527  -8.518
  756   2HB   ALA  94          1HB       ALA  94 -10.407   1.712  -7.034
  757   3HB   ALA  94          3HB       ALA  94 -11.901   1.238  -7.841
  758    H    GLY  95           H        GLY  95 -10.475   4.499  -5.308
  759   1HA   GLY  95          2HA       GLY  95 -11.115   4.381  -2.767
  760   2HA   GLY  95          1HA       GLY  95 -10.787   2.670  -2.992
  761    H    LEU  96           H        LEU  96  -8.525   3.359  -4.925
  762    HA   LEU  96           HA       LEU  96  -6.519   3.783  -2.798
  763   1HB   LEU  96          2HB       LEU  96  -4.898   3.141  -4.559
  764   2HB   LEU  96          1HB       LEU  96  -6.180   1.940  -4.390
  765    HG   LEU  96           HG       LEU  96  -6.704   4.149  -6.303
  766   1HD1  LEU  96          1HD1      LEU  96  -4.552   2.079  -6.652
  767   2HD1  LEU  96          3HD1      LEU  96  -5.419   2.737  -8.039
  768   3HD1  LEU  96          2HD1      LEU  96  -4.483   3.809  -6.995
  769   1HD2  LEU  96          1HD2      LEU  96  -7.901   1.777  -5.667
  770   2HD2  LEU  96          3HD2      LEU  96  -8.114   2.617  -7.201
  771   3HD2  LEU  96          2HD2      LEU  96  -6.939   1.312  -7.069
  772    H    SER  97           H        SER  97  -4.495   5.102  -3.840
  773    HA   SER  97           HA       SER  97  -5.657   7.751  -4.529
  774   1HB   SER  97          2HB       SER  97  -3.809   8.730  -3.506
  775   2HB   SER  97          1HB       SER  97  -3.980   7.257  -2.549
  776    HG   SER  97           HG       SER  97  -2.533   6.407  -4.384
  777    H    SER  98           H        SER  98  -5.169   5.473  -6.485
  778    HA   SER  98           HA       SER  98  -4.058   7.106  -8.593
  779   1HB   SER  98          2HB       SER  98  -2.265   5.210  -7.158
  780   2HB   SER  98          1HB       SER  98  -2.147   5.252  -8.917
  781    HG   SER  98           HG       SER  98  -1.560   7.213  -7.033
  782    H    ARG  99           H        ARG  99  -6.155   6.304  -9.345
  783    HA   ARG  99           HA       ARG  99  -6.810   3.580  -9.736
  784   1HB   ARG  99          2HB       ARG  99  -8.289   4.500 -11.577
  785   2HB   ARG  99          1HB       ARG  99  -8.491   5.269 -10.013
  786   1HG   ARG  99          2HG       ARG  99  -6.481   6.777 -11.125
  787   2HG   ARG  99          1HG       ARG  99  -7.465   6.389 -12.536
  788   1HD   ARG  99          2HD       ARG  99  -8.668   8.208 -11.840
  789   2HD   ARG  99          1HD       ARG  99  -9.420   7.022 -10.773
  790    HE   ARG  99           HE       ARG  99  -7.557   7.774  -9.106
  791   1HH1  ARG  99          2HH1      ARG  99  -6.490   9.913 -10.911
  792   2HH1  ARG  99          1HH1      ARG  99  -7.338  11.317 -10.351
  793   1HH2  ARG  99          1HH2      ARG  99  -9.750   9.504  -8.642
  794   2HH2  ARG  99          2HH2      ARG  99  -9.183  11.085  -9.066
  795    H    LEU 100           H        LEU 100  -6.944   4.639 -12.892
  796    HA   LEU 100           HA       LEU 100  -4.474   3.090 -13.517
  797   1HB   LEU 100          2HB       LEU 100  -5.592   3.192 -15.934
  798   2HB   LEU 100          1HB       LEU 100  -6.047   1.967 -14.759
  799    HG   LEU 100           HG       LEU 100  -7.979   3.099 -15.919
  800   1HD1  LEU 100          3HD1      LEU 100  -7.675   2.289 -13.280
  801   2HD1  LEU 100          2HD1      LEU 100  -8.509   3.835 -13.179
  802   3HD1  LEU 100          1HD1      LEU 100  -9.193   2.538 -14.135
  803   1HD2  LEU 100          2HD2      LEU 100  -6.613   5.439 -15.301
  804   2HD2  LEU 100          1HD2      LEU 100  -8.261   5.324 -15.895
  805   3HD2  LEU 100          3HD2      LEU 100  -7.959   5.421 -14.165
  806    H    VAL 101           H        VAL 101  -3.869   3.912 -16.044
  807    HA   VAL 101           HA       VAL 101  -2.390   6.273 -15.672
  808    HB   VAL 101           HB       VAL 101  -2.601   6.371 -18.294
  809   1HG1  VAL 101          3HG1      VAL 101  -0.662   5.519 -16.961
  810   2HG1  VAL 101          2HG1      VAL 101  -1.430   3.932 -16.930
  811   3HG1  VAL 101          1HG1      VAL 101  -0.909   4.630 -18.463
  812   1HG2  VAL 101          3HG2      VAL 101  -4.682   4.839 -18.106
  813   2HG2  VAL 101          2HG2      VAL 101  -3.489   4.458 -19.349
  814   3HG2  VAL 101          1HG2      VAL 101  -3.520   3.537 -17.845
  815    H    VAL 102           H        VAL 102  -2.925   8.408 -15.691
  816    HA   VAL 102           HA       VAL 102  -5.572   9.324 -15.544
  817    HB   VAL 102           HB       VAL 102  -3.417  11.079 -16.697
  818   1HG1  VAL 102          3HG1      VAL 102  -6.000  11.381 -15.411
  819   2HG1  VAL 102          2HG1      VAL 102  -4.750  12.255 -14.526
  820   3HG1  VAL 102          1HG1      VAL 102  -5.020  12.593 -16.237
  821   1HG2  VAL 102          3HG2      VAL 102  -3.321   9.545 -14.205
  822   2HG2  VAL 102          2HG2      VAL 102  -2.045  10.463 -15.006
  823   3HG2  VAL 102          1HG2      VAL 102  -3.185  11.284 -13.940
  824    HA   PRO 103           HA       PRO 103  -5.432  10.302 -20.217
  825   1HB   PRO 103          2HB       PRO 103  -3.400   9.177 -21.687
  826   2HB   PRO 103          1HB       PRO 103  -3.304  10.784 -20.950
  827   1HG   PRO 103          2HG       PRO 103  -1.994   8.239 -20.106
  828   2HG   PRO 103          1HG       PRO 103  -1.484   9.909 -19.819
  829   1HD   PRO 103          2HD       PRO 103  -2.774   8.197 -17.957
  830   2HD   PRO 103          1HD       PRO 103  -2.513   9.941 -17.771
  831    H    SER 104           H        SER 104  -3.635   7.220 -20.441
  832    HA   SER 104           HA       SER 104  -4.422   5.037 -20.865
  833   1HB   SER 104          2HB       SER 104  -6.583   6.278 -19.540
  834   2HB   SER 104          1HB       SER 104  -7.270   5.527 -20.981
  835    HG   SER 104           HG       SER 104  -7.039   4.180 -19.025
  836    H    HIS 105           H        HIS 105  -3.512   5.836 -23.025
  837    HA   HIS 105           HA       HIS 105  -4.854   6.922 -25.152
  838   1HB   HIS 105          2HB       HIS 105  -2.753   4.878 -24.879
  839   2HB   HIS 105          1HB       HIS 105  -3.644   4.797 -26.401
  840    HD1  HIS 105           HD1      HIS 105  -0.967   5.695 -27.004
  841    HD2  HIS 105           HD2      HIS 105  -3.759   8.394 -25.493
  842    HE1  HIS 105           HE1      HIS 105  -0.128   8.006 -27.616
  843    H    LYS 106           HN       LYS 106  -6.519   6.379 -26.491
  844    HA   LYS 106           HA       LYS 106  -8.587   4.710 -25.783
  845   1HB   LYS 106          2HB       LYS 106  -8.198   6.301 -27.895
  846   2HB   LYS 106          1HB       LYS 106  -7.912   4.753 -28.690
  847   1HG   LYS 106          2HG       LYS 106 -10.220   4.965 -28.939
  848   2HG   LYS 106          1HG       LYS 106 -10.124   4.045 -27.438
  849   1HD   LYS 106          2HD       LYS 106 -11.055   5.729 -26.258
  850   2HD   LYS 106          1HD       LYS 106  -9.931   6.905 -26.939
  851   1HE   LYS 106          2HE       LYS 106 -11.476   6.535 -29.100
  852   2HE   LYS 106          1HE       LYS 106 -12.662   6.134 -27.859
  853   1HZ   LYS 106          2HZ       LYS 106 -11.311   8.401 -26.995
  854   2HZ   LYS 106          1HZ       LYS 106 -11.706   8.670 -28.625
  855   3HZ   LYS 106          3HZ       LYS 106 -12.926   8.289 -27.511
  856   1H    GLU 201          1HT       GLU 201   5.702  -3.079   8.696
  857   2H    GLU 201          3HT       GLU 201   7.251  -3.624   9.121
  858   3H    GLU 201          2HT       GLU 201   7.069  -2.160   8.280
  859    HA   GLU 201           HA       GLU 201   7.468  -3.329   6.442
  860   1HB   GLU 201          2HB       GLU 201   7.382  -5.448   8.418
  861   2HB   GLU 201          1HB       GLU 201   6.666  -5.989   6.899
  862   1HG   GLU 201          2HG       GLU 201   9.258  -4.471   6.854
  863   2HG   GLU 201          1HG       GLU 201   9.263  -6.192   7.244
  864    HA   PRO 202           HA       PRO 202   2.910  -3.190   5.806
  865   1HB   PRO 202          2HB       PRO 202   2.992  -1.044   4.090
  866   2HB   PRO 202          1HB       PRO 202   2.852  -0.886   5.850
  867   1HG   PRO 202          2HG       PRO 202   5.219  -0.392   4.103
  868   2HG   PRO 202          1HG       PRO 202   4.820   0.313   5.679
  869   1HD   PRO 202          2HD       PRO 202   6.690  -1.763   5.215
  870   2HD   PRO 202          1HD       PRO 202   6.039  -1.276   6.795
  871    H    GLN 203           H        GLN 203   1.830  -3.991   3.938
  872    HA   GLN 203           HA       GLN 203   3.640  -4.754   1.683
  873   1HB   GLN 203          2HB       GLN 203   1.430  -6.146   3.099
  874   2HB   GLN 203          1HB       GLN 203   1.490  -6.367   1.350
  875   1HG   GLN 203          2HG       GLN 203   3.130  -7.880   1.641
  876   2HG   GLN 203          1HG       GLN 203   4.158  -6.591   2.267
  877   1HE2  GLN 203          2HE2      GLN 203   3.739  -9.270   4.894
  878   2HE2  GLN 203          1HE2      GLN 203   4.266  -9.299   3.280
  879   1HN   PTR 204          1HN       PTR 204   3.299  -3.523  -0.099
  880    HA   PTR 204           HA       PTR 204   2.208  -2.050  -1.582
  881   1HB   PTR 204          1HB       PTR 204  -0.128  -3.027  -2.229
  882    HD1  PTR 204           HD1      PTR 204   1.226  -2.482  -4.235
  883    HD2  PTR 204           HD2      PTR 204   2.066  -5.919  -1.799
  884    HE1  PTR 204           HE1      PTR 204   2.643  -3.422  -6.045
  885    HE2  PTR 204           HE2      PTR 204   3.485  -6.854  -3.604
  886    H    GLU 205           H        GLU 205  -0.391  -1.210  -1.854
  887    HA   GLU 205           HA       GLU 205  -0.760   0.322   0.658
  888   1HB   GLU 205          2HB       GLU 205  -1.630   0.669  -2.194
  889   2HB   GLU 205          1HB       GLU 205  -2.531   1.482  -0.915
  890   1HG   GLU 205          2HG       GLU 205   0.458   1.708  -1.379
  891   2HG   GLU 205          1HG       GLU 205  -0.740   2.937  -1.787
  892    H    GLU 206           H        GLU 206  -2.984   0.587   1.508
  893    HA   GLU 206           HA       GLU 206  -4.913  -1.522   0.733
  894   1HB   GLU 206          2HB       GLU 206  -3.210  -1.683   3.062
  895   2HB   GLU 206          1HB       GLU 206  -4.899  -1.551   3.559
  896   1HG   GLU 206          2HG       GLU 206  -5.526  -3.459   2.249
  897   2HG   GLU 206          1HG       GLU 206  -3.960  -3.494   1.438
  898    H    ILE 207           H        ILE 207  -7.038  -0.871   1.107
  899    HA   ILE 207           HA       ILE 207  -7.348   1.879   2.210
  900    HB   ILE 207           HB       ILE 207  -9.052   0.226   0.335
  901   1HG1  ILE 207          2HG1      ILE 207  -8.681   2.510  -0.950
  902   2HG1  ILE 207          1HG1      ILE 207  -7.297   2.652   0.136
  903   1HG2  ILE 207          3HG2      ILE 207  -9.866   2.270   2.201
  904   2HG2  ILE 207          2HG2      ILE 207 -10.065   2.858   0.551
  905   3HG2  ILE 207          1HG2      ILE 207 -10.855   1.364   1.056
  906   1HD1  ILE 207          1HD1      ILE 207  -7.257  -0.006  -0.800
  907   2HD1  ILE 207          3HD1      ILE 207  -7.592   0.994  -2.214
  908   3HD1  ILE 207          2HD1      ILE 207  -6.151   1.294  -1.244
  909    HA   PRO 208           HA       PRO 208  -9.366  -0.060   5.664
  910   1HB   PRO 208          2HB       PRO 208 -10.064   2.280   6.927
  911   2HB   PRO 208          1HB       PRO 208  -8.429   1.597   6.968
  912   1HG   PRO 208          2HG       PRO 208  -9.443   3.943   5.435
  913   2HG   PRO 208          1HG       PRO 208  -7.801   3.597   5.998
  914   1HD   PRO 208          2HD       PRO 208  -8.761   3.250   3.355
  915   2HD   PRO 208          1HD       PRO 208  -7.231   2.622   4.005
  916    H    ILE 209           H        ILE 209 -11.572  -0.242   6.489
  917    HA   ILE 209           HA       ILE 209 -13.759   1.375   5.669
  918    HB   ILE 209           HB       ILE 209 -13.078   0.442   3.413
  919   1HG1  ILE 209          2HG1      ILE 209 -15.710  -0.749   3.677
  920   2HG1  ILE 209          1HG1      ILE 209 -15.619   0.762   4.584
  921   1HG2  ILE 209          2HG2      ILE 209 -13.958  -2.121   4.769
  922   2HG2  ILE 209          1HG2      ILE 209 -13.793  -1.947   3.023
  923   3HG2  ILE 209          3HG2      ILE 209 -12.379  -1.779   4.063
  924   1HD1  ILE 209          2HD1      ILE 209 -14.304   1.010   2.004
  925   2HD1  ILE 209          1HD1      ILE 209 -15.982   0.501   1.818
  926   3HD1  ILE 209          3HD1      ILE 209 -15.603   1.985   2.691
  927    H    TYR 210           H        TYR 210 -12.757  -0.212   7.935
  928    HA   TYR 210           HA       TYR 210 -14.405  -2.548   8.284
  929   1HB   TYR 210          2HB       TYR 210 -13.424  -0.902  10.596
  930   2HB   TYR 210          1HB       TYR 210 -13.499  -2.654  10.428
  931    HD1  TYR 210           HD1      TYR 210 -12.178  -3.318   8.004
  932    HD2  TYR 210           HD2      TYR 210 -11.213  -0.185  10.780
  933    HE1  TYR 210           HE1      TYR 210  -9.825  -3.349   7.222
  934    HE2  TYR 210           HE2      TYR 210  -8.860  -0.217   9.999
  935    HH   TYR 210           HH       TYR 210  -7.668  -0.928   7.788
  936    H    LEU 211           HN       LEU 211 -16.012  -2.570  10.241
  937    HA   LEU 211           HA       LEU 211 -18.075  -1.847  11.092
  938   1HB   LEU 211          2HB       LEU 211 -16.981   0.929  10.552
  939   2HB   LEU 211          1HB       LEU 211 -18.271   0.502  11.676
  940    HG   LEU 211           HG       LEU 211 -15.758  -0.985  12.093
  941   1HD1  LEU 211          2HD1      LEU 211 -15.909   2.021  12.353
  942   2HD1  LEU 211          1HD1      LEU 211 -14.802   1.059  13.331
  943   3HD1  LEU 211          3HD1      LEU 211 -14.657   1.057  11.572
  944   1HD2  LEU 211          3HD2      LEU 211 -17.731  -1.068  13.600
  945   2HD2  LEU 211          2HD2      LEU 211 -16.296  -0.474  14.433
  946   3HD2  LEU 211          1HD2      LEU 211 -17.545   0.657  13.914
   
  No H/Q in entry =         946
  Start of MODEL   15
    1   1H    SER   1          3HT       SER   1  -9.108 -11.054 -24.357
    2   2H    SER   1          2HT       SER   1  -8.028 -10.486 -25.539
    3   3H    SER   1          1HT       SER   1  -7.957 -12.105 -25.027
    4    HA   SER   1           HA       SER   1  -7.249 -11.441 -22.837
    5   1HB   SER   1          2HB       SER   1  -5.107 -10.152 -23.629
    6   2HB   SER   1          1HB       SER   1  -5.378 -11.798 -24.200
    7    HG   SER   1           HG       SER   1  -6.021  -9.394 -25.556
    8    H    ILE   2           H        ILE   2  -6.712  -9.705 -21.375
    9    HA   ILE   2           HA       ILE   2  -8.492  -7.560 -21.244
   10    HB   ILE   2           HB       ILE   2  -6.752  -6.455 -19.768
   11   1HG1  ILE   2          2HG1      ILE   2  -5.174  -8.892 -20.649
   12   2HG1  ILE   2          1HG1      ILE   2  -4.737  -7.204 -20.905
   13   1HG2  ILE   2          3HG2      ILE   2  -8.044  -9.047 -19.469
   14   2HG2  ILE   2          2HG2      ILE   2  -6.581  -8.939 -18.491
   15   3HG2  ILE   2          1HG2      ILE   2  -7.866  -7.747 -18.291
   16   1HD1  ILE   2          2HD1      ILE   2  -4.617  -6.881 -18.446
   17   2HD1  ILE   2          1HD1      ILE   2  -5.002  -8.587 -18.216
   18   3HD1  ILE   2          3HD1      ILE   2  -3.489  -8.120 -18.996
   19    H    GLN   3           H        GLN   3  -7.722  -5.139 -21.329
   20    HA   GLN   3           HA       GLN   3  -7.334  -4.364 -23.993
   21   1HB   GLN   3          2HB       GLN   3  -7.453  -3.062 -21.451
   22   2HB   GLN   3          1HB       GLN   3  -6.076  -2.404 -22.336
   23   1HG   GLN   3          2HG       GLN   3  -8.354  -2.741 -24.098
   24   2HG   GLN   3          1HG       GLN   3  -8.790  -1.752 -22.704
   25   1HE2  GLN   3          2HE2      GLN   3  -6.152  -0.310 -25.469
   26   2HE2  GLN   3          1HE2      GLN   3  -6.682  -1.920 -25.546
   27    H    ALA   4           H        ALA   4  -5.001  -5.541 -21.726
   28    HA   ALA   4           HA       ALA   4  -2.717  -5.965 -21.942
   29   1HB   ALA   4          2HB       ALA   4  -3.840  -6.672 -24.275
   30   2HB   ALA   4          1HB       ALA   4  -2.771  -5.395 -24.854
   31   3HB   ALA   4          3HB       ALA   4  -2.102  -6.780 -23.990
   32    H    GLU   5           H        GLU   5  -3.809  -3.120 -21.750
   33    HA   GLU   5           HA       GLU   5  -1.408  -1.705 -21.600
   34   1HB   GLU   5          2HB       GLU   5  -1.758  -0.277 -23.775
   35   2HB   GLU   5          1HB       GLU   5  -0.913  -1.820 -23.882
   36   1HG   GLU   5          2HG       GLU   5  -2.725  -2.899 -24.872
   37   2HG   GLU   5          1HG       GLU   5  -3.898  -1.768 -24.194
   38    H    GLU   6           H        GLU   6  -1.950   0.844 -22.138
   39    HA   GLU   6           HA       GLU   6  -3.290   2.689 -21.592
   40   1HB   GLU   6          2HB       GLU   6  -5.612   0.743 -21.550
   41   2HB   GLU   6          1HB       GLU   6  -5.685   2.493 -21.754
   42   1HG   GLU   6          2HG       GLU   6  -3.954   1.752 -23.763
   43   2HG   GLU   6          1HG       GLU   6  -5.086   0.399 -23.732
   44    H    TRP   7           H        TRP   7  -2.546   0.209 -19.633
   45    HA   TRP   7           HA       TRP   7  -2.783   1.572 -17.207
   46   1HB   TRP   7          2HB       TRP   7  -4.770   0.304 -16.216
   47   2HB   TRP   7          1HB       TRP   7  -5.169   1.582 -17.364
   48    HD1  TRP   7           HD1      TRP   7  -6.048   0.877 -19.749
   49    HE1  TRP   7           HE1      TRP   7  -7.013  -1.333 -20.664
   50    HE3  TRP   7           HE3      TRP   7  -4.609  -2.315 -16.036
   51    HZ2  TRP   7           HZ2      TRP   7  -7.150  -4.088 -19.918
   52    HZ3  TRP   7           HZ3      TRP   7  -5.166  -4.728 -16.165
   53    HH2  TRP   7           HH2      TRP   7  -6.434  -5.617 -18.101
   54    H    TYR   8           H        TYR   8  -2.548  -1.390 -18.983
   55    HA   TYR   8           HA       TYR   8  -1.288  -2.645 -16.608
   56   1HB   TYR   8          2HB       TYR   8  -3.023  -4.069 -16.749
   57   2HB   TYR   8          1HB       TYR   8  -3.435  -3.561 -18.377
   58    HD1  TYR   8           HD1      TYR   8  -2.074  -4.477 -20.324
   59    HD2  TYR   8           HD2      TYR   8  -1.872  -6.091 -16.349
   60    HE1  TYR   8           HE1      TYR   8  -1.118  -6.579 -21.227
   61    HE2  TYR   8           HE2      TYR   8  -0.908  -8.183 -17.249
   62    HH   TYR   8           HH       TYR   8  -1.128  -9.338 -19.849
   63    H    PHE   9           H        PHE   9   0.632  -3.721 -16.906
   64    HA   PHE   9           HA       PHE   9   1.950  -3.278 -19.534
   65   1HB   PHE   9          2HB       PHE   9   2.907  -3.518 -16.706
   66   2HB   PHE   9          1HB       PHE   9   4.010  -3.952 -18.011
   67    HD1  PHE   9           HD1      PHE   9   1.383  -1.448 -18.550
   68    HD2  PHE   9           HD2      PHE   9   5.509  -2.043 -17.500
   69    HE1  PHE   9           HE1      PHE   9   1.835   0.956 -18.957
   70    HE2  PHE   9           HE2      PHE   9   5.956   0.361 -17.905
   71    HZ   PHE   9           HZ       PHE   9   4.121   1.860 -18.634
   72    H    GLY  10           H        GLY  10   1.712  -5.787 -16.990
   73   1HA   GLY  10          2HA       GLY  10   1.066  -7.997 -18.412
   74   2HA   GLY  10          1HA       GLY  10   2.746  -7.794 -18.882
   75    H    LYS  11           H        LYS  11   3.821  -9.342 -17.803
   76    HA   LYS  11           HA       LYS  11   3.302  -9.661 -14.885
   77   1HB   LYS  11          2HB       LYS  11   4.854 -11.833 -15.990
   78   2HB   LYS  11          1HB       LYS  11   3.279 -11.902 -15.203
   79   1HG   LYS  11          2HG       LYS  11   2.379 -11.025 -17.502
   80   2HG   LYS  11          1HG       LYS  11   3.915 -11.626 -18.129
   81   1HD   LYS  11          2HD       LYS  11   2.764 -13.587 -16.356
   82   2HD   LYS  11          1HD       LYS  11   1.577 -13.128 -17.576
   83   1HE   LYS  11          2HE       LYS  11   2.738 -14.803 -18.702
   84   2HE   LYS  11          1HE       LYS  11   3.632 -13.373 -19.220
   85   1HZ   LYS  11          1HZ       LYS  11   4.406 -14.907 -16.813
   86   2HZ   LYS  11          3HZ       LYS  11   4.971 -15.328 -18.356
   87   3HZ   LYS  11          2HZ       LYS  11   5.336 -13.801 -17.706
   88    H    LEU  12           H        LEU  12   4.722  -7.753 -14.771
   89    HA   LEU  12           HA       LEU  12   7.598  -8.474 -15.138
   90   1HB   LEU  12          2HB       LEU  12   7.929  -6.430 -16.038
   91   2HB   LEU  12          1HB       LEU  12   6.181  -6.312 -16.143
   92    HG   LEU  12           HG       LEU  12   7.994  -5.162 -14.022
   93   1HD1  LEU  12          3HD1      LEU  12   5.897  -4.013 -15.888
   94   2HD1  LEU  12          2HD1      LEU  12   6.746  -3.080 -14.651
   95   3HD1  LEU  12          1HD1      LEU  12   7.642  -3.781 -16.001
   96   1HD2  LEU  12          1HD2      LEU  12   5.363  -6.195 -13.632
   97   2HD2  LEU  12          3HD2      LEU  12   6.412  -5.351 -12.488
   98   3HD2  LEU  12          2HD2      LEU  12   5.312  -4.432 -13.521
   99    H    GLY  13           H        GLY  13   8.815  -6.674 -13.483
  100   1HA   GLY  13          2HA       GLY  13   7.860  -7.589 -10.809
  101   2HA   GLY  13          1HA       GLY  13   9.514  -7.093 -11.174
  102    H    ARG  14           H        ARG  14   7.822  -6.004  -9.052
  103    HA   ARG  14           HA       ARG  14   6.654  -3.502  -9.770
  104   1HB   ARG  14          2HB       ARG  14   7.185  -2.894  -7.347
  105   2HB   ARG  14          1HB       ARG  14   6.218  -4.350  -7.573
  106   1HG   ARG  14          2HG       ARG  14   7.770  -5.448  -6.357
  107   2HG   ARG  14          1HG       ARG  14   8.874  -5.231  -7.714
  108   1HD   ARG  14          2HD       ARG  14   9.903  -3.372  -6.753
  109   2HD   ARG  14          1HD       ARG  14   8.503  -2.990  -5.752
  110    HE   ARG  14           HE       ARG  14   9.144  -5.119  -4.449
  111   1HH1  ARG  14          1HH2      ARG  14  11.457  -6.053  -5.918
  112   2HH1  ARG  14          2HH2      ARG  14  12.793  -5.273  -5.138
  113   1HH2  ARG  14          2HH1      ARG  14  10.828  -2.879  -3.580
  114   2HH2  ARG  14          1HH1      ARG  14  12.437  -3.477  -3.816
  115    H    LYS  15           H        LYS  15   9.917  -4.537  -9.545
  116    HA   LYS  15           HA       LYS  15  11.104  -1.937  -9.180
  117   1HB   LYS  15          2HB       LYS  15  12.227  -4.125  -8.604
  118   2HB   LYS  15          1HB       LYS  15  12.376  -4.426 -10.336
  119   1HG   LYS  15          2HG       LYS  15  14.186  -3.089 -10.461
  120   2HG   LYS  15          1HG       LYS  15  13.303  -1.760  -9.710
  121   1HD   LYS  15          2HD       LYS  15  14.233  -2.147  -7.678
  122   2HD   LYS  15          1HD       LYS  15  14.031  -3.893  -7.825
  123   1HE   LYS  15          2HE       LYS  15  16.279  -3.966  -8.098
  124   2HE   LYS  15          1HE       LYS  15  15.975  -3.334  -9.717
  125   1HZ   LYS  15          1HZ       LYS  15  16.383  -1.647  -7.310
  126   2HZ   LYS  15          3HZ       LYS  15  17.598  -2.016  -8.435
  127   3HZ   LYS  15          2HZ       LYS  15  16.240  -1.112  -8.915
  128    H    ASP  16           H        ASP  16  10.076  -3.931 -11.861
  129    HA   ASP  16           HA       ASP  16  11.435  -2.449 -13.893
  130   1HB   ASP  16          2HB       ASP  16  10.109  -4.828 -13.771
  131   2HB   ASP  16          1HB       ASP  16   8.914  -3.793 -14.508
  132    H    ALA  17           H        ALA  17   8.445  -2.204 -12.133
  133    HA   ALA  17           HA       ALA  17   7.131  -0.356 -13.900
  134   1HB   ALA  17          1HB       ALA  17   6.745  -0.901 -10.948
  135   2HB   ALA  17          3HB       ALA  17   5.665   0.089 -11.929
  136   3HB   ALA  17          2HB       ALA  17   5.842  -1.632 -12.277
  137    H    GLU  18           H        GLU  18   9.158   0.010 -11.013
  138    HA   GLU  18           HA       GLU  18   8.967   2.890 -10.944
  139   1HB   GLU  18          2HB       GLU  18  10.872   2.790  -9.419
  140   2HB   GLU  18          1HB       GLU  18   9.747   1.498  -9.013
  141   1HG   GLU  18          2HG       GLU  18  11.226  -0.124  -9.569
  142   2HG   GLU  18          1HG       GLU  18  11.753   0.727 -11.017
  143    H    ARG  19           H        ARG  19  10.838   0.629 -12.779
  144    HA   ARG  19           HA       ARG  19  12.738   2.690 -13.701
  145   1HB   ARG  19          2HB       ARG  19  12.555  -0.222 -13.789
  146   2HB   ARG  19          1HB       ARG  19  13.019   0.458 -15.348
  147   1HG   ARG  19          2HG       ARG  19  14.391   1.752 -13.110
  148   2HG   ARG  19          1HG       ARG  19  14.725   0.023 -13.198
  149   1HD   ARG  19          2HD       ARG  19  15.119   0.429 -15.724
  150   2HD   ARG  19          1HD       ARG  19  15.215   2.138 -15.294
  151    HE   ARG  19           HE       ARG  19  17.068   0.044 -14.233
  152   1HH1  ARG  19          2HH1      ARG  19  16.749   2.693 -12.742
  153   2HH1  ARG  19          1HH1      ARG  19  18.073   3.600 -13.394
  154   1HH2  ARG  19          1HH2      ARG  19  18.559   1.463 -16.081
  155   2HH2  ARG  19          2HH2      ARG  19  19.098   2.903 -15.284
  156    H    GLN  20           H        GLN  20   9.711   1.310 -14.684
  157    HA   GLN  20           HA       GLN  20   9.998   2.277 -17.460
  158   1HB   GLN  20          2HB       GLN  20   8.452   0.267 -16.189
  159   2HB   GLN  20          1HB       GLN  20   7.310   1.468 -16.793
  160   1HG   GLN  20          2HG       GLN  20   7.566   0.562 -18.841
  161   2HG   GLN  20          1HG       GLN  20   9.222   1.169 -18.837
  162   1HE2  GLN  20          2HE2      GLN  20   9.762  -2.395 -19.332
  163   2HE2  GLN  20          1HE2      GLN  20   9.377  -0.995 -20.212
  164    H    LEU  21           H        LEU  21   8.759   3.351 -14.423
  165    HA   LEU  21           HA       LEU  21   7.043   5.401 -15.691
  166   1HB   LEU  21          2HB       LEU  21   7.388   4.296 -12.956
  167   2HB   LEU  21          1HB       LEU  21   6.966   6.006 -13.052
  168    HG   LEU  21           HG       LEU  21   5.003   5.508 -14.385
  169   1HD1  LEU  21          1HD1      LEU  21   6.168   3.572 -15.586
  170   2HD1  LEU  21          3HD1      LEU  21   5.726   2.575 -14.200
  171   3HD1  LEU  21          2HD1      LEU  21   4.469   3.321 -15.187
  172   1HD2  LEU  21          3HD2      LEU  21   5.246   4.894 -11.757
  173   2HD2  LEU  21          2HD2      LEU  21   3.732   4.723 -12.647
  174   3HD2  LEU  21          1HD2      LEU  21   4.768   3.319 -12.390
  175    H    LEU  22           H        LEU  22   9.974   5.162 -13.704
  176    HA   LEU  22           HA       LEU  22  10.421   8.067 -13.915
  177   1HB   LEU  22          2HB       LEU  22  12.359   6.034 -12.800
  178   2HB   LEU  22          1HB       LEU  22  12.230   7.747 -12.407
  179    HG   LEU  22           HG       LEU  22  10.332   5.518 -11.650
  180   1HD1  LEU  22          2HD1      LEU  22  12.498   6.509 -10.341
  181   2HD1  LEU  22          1HD1      LEU  22  11.245   7.596  -9.742
  182   3HD1  LEU  22          3HD1      LEU  22  11.082   5.855  -9.516
  183   1HD2  LEU  22          3HD2      LEU  22   9.794   8.368 -12.131
  184   2HD2  LEU  22          2HD2      LEU  22   8.667   7.023 -11.972
  185   3HD2  LEU  22          1HD2      LEU  22   9.305   7.814 -10.530
  186    H    SER  23           H        SER  23  11.511   5.095 -15.424
  187    HA   SER  23           HA       SER  23  13.545   6.647 -16.962
  188   1HB   SER  23          2HB       SER  23  13.733   4.172 -15.732
  189   2HB   SER  23          1HB       SER  23  13.446   3.752 -17.421
  190    HG   SER  23           HG       SER  23  15.265   5.787 -16.889
  191    H    PHE  24           H        PHE  24  11.032   7.271 -17.757
  192    HA   PHE  24           HA       PHE  24  10.962   6.187 -20.477
  193   1HB   PHE  24          2HB       PHE  24   9.590   4.612 -18.948
  194   2HB   PHE  24          1HB       PHE  24   8.429   5.938 -18.860
  195    HD1  PHE  24           HD1      PHE  24   7.564   6.929 -21.071
  196    HD2  PHE  24           HD2      PHE  24   9.630   3.170 -20.816
  197    HE1  PHE  24           HE1      PHE  24   6.653   6.278 -23.284
  198    HE2  PHE  24           HE2      PHE  24   8.719   2.519 -23.029
  199    HZ   PHE  24           HZ       PHE  24   7.231   4.073 -24.263
  200    H    GLY  25           H        GLY  25   9.439   8.223 -18.013
  201   1HA   GLY  25          2HA       GLY  25   9.392  10.678 -18.644
  202   2HA   GLY  25          1HA       GLY  25   8.739  10.150 -20.194
  203    H    ASN  26           H        ASN  26   7.468   8.116 -17.909
  204    HA   ASN  26           HA       ASN  26   4.851   9.376 -18.073
  205   1HB   ASN  26          2HB       ASN  26   5.967   6.860 -16.910
  206   2HB   ASN  26          1HB       ASN  26   4.413   7.432 -16.304
  207   1HD2  ASN  26          2HD2      ASN  26   4.452   5.493 -19.770
  208   2HD2  ASN  26          1HD2      ASN  26   5.679   5.406 -18.601
  209    HA   PRO  27           HA       PRO  27   5.734  11.750 -14.361
  210   1HB   PRO  27          2HB       PRO  27   3.541  13.386 -14.626
  211   2HB   PRO  27          1HB       PRO  27   5.061  13.638 -15.496
  212   1HG   PRO  27          2HG       PRO  27   2.458  12.579 -16.510
  213   2HG   PRO  27          1HG       PRO  27   3.741  13.426 -17.388
  214   1HD   PRO  27          2HD       PRO  27   3.268  10.630 -17.411
  215   2HD   PRO  27          1HD       PRO  27   4.724  11.448 -18.015
  216    H    ARG  28           H        ARG  28   4.022  12.526 -12.535
  217    HA   ARG  28           HA       ARG  28   3.020  10.220 -11.258
  218   1HB   ARG  28          2HB       ARG  28   1.925  11.707  -9.720
  219   2HB   ARG  28          1HB       ARG  28   3.422  12.499 -10.213
  220   1HG   ARG  28          2HG       ARG  28   2.087  13.713 -11.985
  221   2HG   ARG  28          1HG       ARG  28   0.628  13.052 -11.248
  222   1HD   ARG  28          2HD       ARG  28   1.118  14.163  -9.148
  223   2HD   ARG  28          1HD       ARG  28   2.689  14.695  -9.749
  224    HE   ARG  28           HE       ARG  28   1.578  16.346 -11.089
  225   1HH1  ARG  28          2HH1      ARG  28  -0.241  15.414  -8.497
  226   2HH1  ARG  28          1HH1      ARG  28  -1.777  15.876  -9.150
  227   1HH2  ARG  28          1HH2      ARG  28  -0.547  16.445 -12.342
  228   2HH2  ARG  28          2HH2      ARG  28  -1.951  16.459 -11.327
  229    H    GLY  29           H        GLY  29   0.845   9.431 -11.002
  230   1HA   GLY  29          2HA       GLY  29  -1.500   9.370 -11.581
  231   2HA   GLY  29          1HA       GLY  29  -1.169  10.465 -12.923
  232    H    THR  30           H        THR  30   1.234   8.138 -12.854
  233    HA   THR  30           HA       THR  30  -0.021   6.734 -15.139
  234    HB   THR  30           HB       THR  30   2.733   6.174 -14.050
  235    HG1  THR  30           HG1      THR  30   1.759   8.450 -15.318
  236   1HG2  THR  30          3HG2      THR  30   1.231   5.805 -16.602
  237   2HG2  THR  30          2HG2      THR  30   2.964   6.113 -16.709
  238   3HG2  THR  30          1HG2      THR  30   2.370   4.722 -15.803
  239    H    PHE  31           H        PHE  31  -1.612   5.691 -13.594
  240    HA   PHE  31           HA       PHE  31  -0.509   3.669 -11.786
  241   1HB   PHE  31          2HB       PHE  31  -3.313   4.463 -12.548
  242   2HB   PHE  31          1HB       PHE  31  -2.986   3.072 -11.521
  243    HD1  PHE  31           HD1      PHE  31  -1.575   6.548 -11.797
  244    HD2  PHE  31           HD2      PHE  31  -3.329   3.549  -9.272
  245    HE1  PHE  31           HE1      PHE  31  -1.333   8.052  -9.842
  246    HE2  PHE  31           HE2      PHE  31  -3.089   5.054  -7.317
  247    HZ   PHE  31           HZ       PHE  31  -2.091   7.307  -7.601
  248    H    LEU  32           H        LEU  32   0.629   2.311 -13.322
  249    HA   LEU  32           HA       LEU  32  -0.984   0.958 -15.395
  250   1HB   LEU  32          2HB       LEU  32   1.115  -0.009 -16.128
  251   2HB   LEU  32          1HB       LEU  32   1.381   1.708 -15.827
  252    HG   LEU  32           HG       LEU  32   2.013   0.877 -13.404
  253   1HD1  LEU  32          2HD1      LEU  32   2.008  -1.590 -15.087
  254   2HD1  LEU  32          1HD1      LEU  32   3.313  -1.399 -13.916
  255   3HD1  LEU  32          3HD1      LEU  32   1.635  -1.402 -13.374
  256   1HD2  LEU  32          3HD2      LEU  32   3.514   1.188 -15.896
  257   2HD2  LEU  32          2HD2      LEU  32   3.897   1.778 -14.278
  258   3HD2  LEU  32          1HD2      LEU  32   4.336   0.133 -14.744
  259    H    ILE  33           H        ILE  33  -0.370  -1.566 -15.490
  260    HA   ILE  33           HA       ILE  33  -0.770  -2.663 -12.739
  261    HB   ILE  33           HB       ILE  33  -2.176  -3.302 -15.314
  262   1HG1  ILE  33          2HG1      ILE  33  -2.951  -2.817 -12.441
  263   2HG1  ILE  33          1HG1      ILE  33  -3.367  -1.854 -13.860
  264   1HG2  ILE  33          2HG2      ILE  33  -1.196  -5.451 -14.545
  265   2HG2  ILE  33          1HG2      ILE  33  -1.953  -5.205 -12.969
  266   3HG2  ILE  33          3HG2      ILE  33  -2.953  -5.432 -14.402
  267   1HD1  ILE  33          3HD1      ILE  33  -4.274  -4.715 -13.426
  268   2HD1  ILE  33          2HD1      ILE  33  -5.253  -3.298 -13.047
  269   3HD1  ILE  33          1HD1      ILE  33  -4.787  -3.626 -14.714
  270    H    ARG  34           H        ARG  34  -0.137  -5.058 -12.665
  271    HA   ARG  34           HA       ARG  34   1.658  -6.194 -14.565
  272   1HB   ARG  34          2HB       ARG  34   3.711  -5.856 -12.909
  273   2HB   ARG  34          1HB       ARG  34   3.361  -4.672 -14.165
  274   1HG   ARG  34          2HG       ARG  34   2.820  -3.081 -12.646
  275   2HG   ARG  34          1HG       ARG  34   1.835  -4.202 -11.708
  276   1HD   ARG  34          2HD       ARG  34   4.852  -3.917 -11.600
  277   2HD   ARG  34          1HD       ARG  34   3.705  -3.480 -10.332
  278    HE   ARG  34           HE       ARG  34   3.501  -6.282 -11.095
  279   1HH1  ARG  34          2HH1      ARG  34   3.429  -4.678  -8.367
  280   2HH1  ARG  34          1HH1      ARG  34   4.725  -5.482  -7.545
  281   1HH2  ARG  34          1HH2      ARG  34   5.943  -7.015 -10.407
  282   2HH2  ARG  34          2HH2      ARG  34   6.148  -6.803  -8.700
  283    H    GLU  35           H        GLU  35   2.682  -8.172 -13.683
  284    HA   GLU  35           HA       GLU  35   0.960  -9.440 -11.719
  285   1HB   GLU  35          2HB       GLU  35   2.117 -11.423 -12.240
  286   2HB   GLU  35          1HB       GLU  35   2.185 -10.516 -13.739
  287   1HG   GLU  35          2HG       GLU  35   4.448  -9.764 -13.222
  288   2HG   GLU  35          1HG       GLU  35   4.364 -10.517 -11.629
  289    H    SER  36           H        SER  36   1.354  -9.765  -9.540
  290    HA   SER  36           HA       SER  36   3.700  -8.416  -8.374
  291   1HB   SER  36          2HB       SER  36   1.332  -9.812  -7.089
  292   2HB   SER  36          1HB       SER  36   2.602  -8.973  -6.216
  293    HG   SER  36           HG       SER  36   1.534  -7.226  -6.549
  294    H    GLU  37           H        GLU  37   5.516  -9.552  -7.875
  295    HA   GLU  37           HA       GLU  37   5.434 -12.505  -7.968
  296   1HB   GLU  37          2HB       GLU  37   7.697 -10.539  -7.548
  297   2HB   GLU  37          1HB       GLU  37   7.900 -12.288  -7.614
  298   1HG   GLU  37          2HG       GLU  37   6.389 -11.705  -9.884
  299   2HG   GLU  37          1HG       GLU  37   7.553 -10.383  -9.801
  300    H    THR  38           H        THR  38   4.411 -10.491  -5.763
  301    HA   THR  38           HA       THR  38   5.936 -11.212  -3.405
  302    HB   THR  38           HB       THR  38   4.395  -9.150  -3.791
  303    HG1  THR  38           HG1      THR  38   4.073  -9.040  -1.591
  304   1HG2  THR  38          1HG2      THR  38   2.401 -10.429  -4.467
  305   2HG2  THR  38          3HG2      THR  38   2.359 -11.199  -2.881
  306   3HG2  THR  38          2HG2      THR  38   2.077  -9.464  -3.026
  307    H    THR  39           H        THR  39   2.849 -12.213  -4.825
  308    HA   THR  39           HA       THR  39   2.805 -14.497  -2.887
  309    HB   THR  39           HB       THR  39   0.795 -12.947  -3.144
  310    HG1  THR  39           HG1      THR  39  -0.583 -14.666  -2.921
  311   1HG2  THR  39          3HG2      THR  39   1.209 -13.628  -5.872
  312   2HG2  THR  39          2HG2      THR  39  -0.338 -14.320  -5.382
  313   3HG2  THR  39          1HG2      THR  39  -0.041 -12.594  -5.185
  314    H    LYS  40           H        LYS  40   1.414 -16.400  -4.214
  315    HA   LYS  40           HA       LYS  40   3.221 -17.776  -5.784
  316   1HB   LYS  40          2HB       LYS  40   0.285 -17.810  -6.470
  317   2HB   LYS  40          1HB       LYS  40   1.429 -19.153  -6.493
  318   1HG   LYS  40          2HG       LYS  40   1.651 -18.726  -3.946
  319   2HG   LYS  40          1HG       LYS  40   0.165 -17.791  -4.119
  320   1HD   LYS  40          2HD       LYS  40  -0.141 -20.281  -5.516
  321   2HD   LYS  40          1HD       LYS  40   0.429 -20.615  -3.882
  322   1HE   LYS  40          2HE       LYS  40  -1.609 -20.151  -3.048
  323   2HE   LYS  40          1HE       LYS  40  -1.562 -18.543  -3.773
  324   1HZ   LYS  40          1HZ       LYS  40  -2.369 -21.036  -5.174
  325   2HZ   LYS  40          3HZ       LYS  40  -3.434 -19.854  -4.584
  326   3HZ   LYS  40          2HZ       LYS  40  -2.357 -19.473  -5.841
  327    H    GLY  41           H        GLY  41   0.976 -15.264  -6.754
  328   1HA   GLY  41          2HA       GLY  41   2.393 -14.086  -8.767
  329   2HA   GLY  41          1HA       GLY  41   1.648 -15.463  -9.586
  330    H    ALA  42           H        ALA  42   0.831 -12.732  -7.471
  331    HA   ALA  42           HA       ALA  42  -1.974 -12.747  -8.392
  332   1HB   ALA  42          1HB       ALA  42  -0.400 -11.074  -6.416
  333   2HB   ALA  42          3HB       ALA  42  -2.082 -10.731  -6.826
  334   3HB   ALA  42          2HB       ALA  42  -1.659 -12.258  -6.058
  335    H    TYR  43           H        TYR  43  -2.389  -9.951  -8.432
  336    HA   TYR  43           HA       TYR  43  -0.748  -9.225 -10.814
  337   1HB   TYR  43          2HB       TYR  43  -3.586  -9.309 -10.468
  338   2HB   TYR  43          1HB       TYR  43  -3.095  -7.633 -10.707
  339    HD1  TYR  43           HD1      TYR  43  -0.901  -7.603 -12.467
  340    HD2  TYR  43           HD2      TYR  43  -4.247 -10.306 -12.464
  341    HE1  TYR  43           HE1      TYR  43  -0.545  -8.063 -14.886
  342    HE2  TYR  43           HE2      TYR  43  -3.887 -10.763 -14.872
  343    HH   TYR  43           HH       TYR  43  -1.286 -10.345 -16.449
  344    H    SER  44           H        SER  44  -1.263  -6.542 -10.989
  345    HA   SER  44           HA       SER  44  -0.950  -5.296  -8.355
  346   1HB   SER  44          2HB       SER  44   1.286  -6.175  -8.677
  347   2HB   SER  44          1HB       SER  44   1.344  -5.473 -10.293
  348    HG   SER  44           HG       SER  44   1.089  -4.050  -7.854
  349    H    LEU  45           H        LEU  45  -0.553  -2.965  -8.545
  350    HA   LEU  45           HA       LEU  45  -1.256  -1.822 -11.205
  351   1HB   LEU  45          2HB       LEU  45  -3.362  -1.965  -9.883
  352   2HB   LEU  45          1HB       LEU  45  -2.609  -0.974  -8.634
  353    HG   LEU  45           HG       LEU  45  -2.144   0.747 -10.456
  354   1HD1  LEU  45          2HD1      LEU  45  -2.538  -0.987 -12.286
  355   2HD1  LEU  45          1HD1      LEU  45  -4.260  -0.789 -11.971
  356   3HD1  LEU  45          3HD1      LEU  45  -3.303   0.582 -12.533
  357   1HD2  LEU  45          2HD2      LEU  45  -4.713   0.045  -9.214
  358   2HD2  LEU  45          1HD2      LEU  45  -3.875   1.594  -9.273
  359   3HD2  LEU  45          3HD2      LEU  45  -4.866   1.077 -10.637
  360    H    SER  46           H        SER  46   0.986  -1.242 -11.236
  361    HA   SER  46           HA       SER  46   2.262   0.318  -9.198
  362   1HB   SER  46          2HB       SER  46   3.167   0.864 -11.935
  363   2HB   SER  46          1HB       SER  46   4.062   0.197 -10.569
  364    HG   SER  46           HG       SER  46   3.827  -1.662 -11.469
  365    H    ILE  47           H        ILE  47   2.671   2.630  -9.199
  366    HA   ILE  47           HA       ILE  47   1.028   4.244 -11.054
  367    HB   ILE  47           HB       ILE  47  -0.278   5.289  -9.423
  368   1HG1  ILE  47          2HG1      ILE  47   1.651   4.209  -7.338
  369   2HG1  ILE  47          1HG1      ILE  47   1.565   5.881  -7.895
  370   1HG2  ILE  47          3HG2      ILE  47   0.181   2.427  -8.548
  371   2HG2  ILE  47          2HG2      ILE  47  -1.124   3.433  -7.919
  372   3HG2  ILE  47          1HG2      ILE  47  -1.070   3.030  -9.635
  373   1HD1  ILE  47          2HD1      ILE  47  -0.886   4.533  -6.794
  374   2HD1  ILE  47          1HD1      ILE  47   0.311   5.227  -5.701
  375   3HD1  ILE  47          3HD1      ILE  47  -0.509   6.254  -6.876
  376    H    ARG  48           H        ARG  48   2.303   5.821 -11.812
  377    HA   ARG  48           HA       ARG  48   4.853   6.457 -10.598
  378   1HB   ARG  48          2HB       ARG  48   4.695   6.701 -12.973
  379   2HB   ARG  48          1HB       ARG  48   3.253   7.706 -12.843
  380   1HG   ARG  48          2HG       ARG  48   5.130   9.163 -13.293
  381   2HG   ARG  48          1HG       ARG  48   4.652   9.411 -11.616
  382   1HD   ARG  48          2HD       ARG  48   6.700   8.806 -10.918
  383   2HD   ARG  48          1HD       ARG  48   6.534   7.249 -11.729
  384    HE   ARG  48           HE       ARG  48   8.002   8.078 -13.364
  385   1HH1  ARG  48          2HH1      ARG  48   6.673  10.633 -11.496
  386   2HH1  ARG  48          1HH1      ARG  48   7.292  11.888 -12.517
  387   1HH2  ARG  48          1HH2      ARG  48   8.644   9.699 -14.841
  388   2HH2  ARG  48          2HH2      ARG  48   8.408  11.360 -14.411
  389    H    ASP  49           H        ASP  49   5.414   8.336  -9.402
  390    HA   ASP  49           HA       ASP  49   3.395  10.397  -8.911
  391   1HB   ASP  49          2HB       ASP  49   3.422   8.132  -7.231
  392   2HB   ASP  49          1HB       ASP  49   4.187   9.426  -6.309
  393    H    TRP  50           H        TRP  50   5.138  11.736  -9.702
  394    HA   TRP  50           HA       TRP  50   7.702  11.818  -8.302
  395   1HB   TRP  50          2HB       TRP  50   7.802  12.535 -10.563
  396   2HB   TRP  50          1HB       TRP  50   6.357  13.530 -10.399
  397    HD1  TRP  50           HD1      TRP  50  10.066  13.688 -10.143
  398    HE1  TRP  50           HE1      TRP  50  10.797  16.008  -9.282
  399    HE3  TRP  50           HE3      TRP  50   5.564  15.502  -8.721
  400    HZ2  TRP  50           HZ2      TRP  50   9.588  18.359  -8.177
  401    HZ3  TRP  50           HZ3      TRP  50   5.348  17.791  -7.776
  402    HH2  TRP  50           HH2      TRP  50   7.358  19.220  -7.506
  403    H    ASP  51           H        ASP  51   8.398  13.853  -7.126
  404    HA   ASP  51           HA       ASP  51   6.138  15.327  -5.882
  405   1HB   ASP  51          2HB       ASP  51   7.307  13.174  -4.604
  406   2HB   ASP  51          1HB       ASP  51   8.195  14.545  -3.941
  407    H    ASP  52           H        ASP  52   6.823  17.316  -4.832
  408    HA   ASP  52           HA       ASP  52   9.160  18.514  -6.153
  409   1HB   ASP  52          2HB       ASP  52   8.308  20.602  -5.404
  410   2HB   ASP  52          1HB       ASP  52   6.878  19.650  -5.795
  411    H    MET  53           H        MET  53   9.974  16.505  -4.329
  412    HA   MET  53           HA       MET  53  11.691  18.093  -2.632
  413   1HB   MET  53          2HB       MET  53  10.957  17.353  -0.494
  414   2HB   MET  53          1HB       MET  53   9.498  17.866  -1.340
  415   1HG   MET  53          2HG       MET  53   9.963  15.124  -1.996
  416   2HG   MET  53          1HG       MET  53  10.092  15.291  -0.244
  417   1HE   MET  53          1HE       MET  53   8.234  16.309  -3.356
  418   2HE   MET  53          3HE       MET  53   6.601  16.748  -2.835
  419   3HE   MET  53          2HE       MET  53   7.965  17.794  -2.446
  420    H    LYS  54           H        LYS  54  11.667  15.809  -4.716
  421    HA   LYS  54           HA       LYS  54  13.971  14.483  -3.693
  422   1HB   LYS  54          2HB       LYS  54  12.973  12.181  -3.500
  423   2HB   LYS  54          1HB       LYS  54  12.452  13.300  -2.239
  424   1HG   LYS  54          2HG       LYS  54  10.308  13.006  -2.855
  425   2HG   LYS  54          1HG       LYS  54  10.688  13.587  -4.476
  426   1HD   LYS  54          2HD       LYS  54  10.257  11.494  -5.207
  427   2HD   LYS  54          1HD       LYS  54  11.744  10.998  -4.400
  428   1HE   LYS  54          2HE       LYS  54   9.974   9.584  -3.572
  429   2HE   LYS  54          1HE       LYS  54  10.388  10.713  -2.283
  430   1HZ   LYS  54          2HZ       LYS  54   8.512  12.064  -3.663
  431   2HZ   LYS  54          1HZ       LYS  54   7.951  10.466  -3.797
  432   3HZ   LYS  54          3HZ       LYS  54   8.212  11.146  -2.265
  433    H    GLY  55           H        GLY  55  11.348  14.536  -6.047
  434   1HA   GLY  55          2HA       GLY  55  12.231  14.591  -8.414
  435   2HA   GLY  55          1HA       GLY  55  13.175  13.189  -7.936
  436    H    ASP  56           H        ASP  56  11.926  12.239  -9.833
  437    HA   ASP  56           HA       ASP  56   9.087  11.775  -9.495
  438   1HB   ASP  56          2HB       ASP  56  10.795   9.982 -11.190
  439   2HB   ASP  56          1HB       ASP  56   9.204  10.658 -11.525
  440    H    HIS  57           H        HIS  57   8.281   9.403  -9.420
  441    HA   HIS  57           HA       HIS  57   9.953   7.432  -8.118
  442   1HB   HIS  57          2HB       HIS  57   8.444   9.320  -6.468
  443   2HB   HIS  57          1HB       HIS  57   8.005   7.644  -6.147
  444    HD1  HIS  57           HD1      HIS  57   9.747   6.148  -5.022
  445    HD2  HIS  57           HD2      HIS  57  11.231   9.923  -5.980
  446    HE1  HIS  57           HE1      HIS  57  12.007   6.338  -3.893
  447    H    VAL  58           H        VAL  58   8.065   5.831  -6.970
  448    HA   VAL  58           HA       VAL  58   5.658   5.702  -8.614
  449    HB   VAL  58           HB       VAL  58   7.313   4.804 -10.193
  450   1HG1  VAL  58          2HG1      VAL  58   8.109   3.282  -7.770
  451   2HG1  VAL  58          1HG1      VAL  58   8.188   2.422  -9.311
  452   3HG1  VAL  58          3HG1      VAL  58   9.103   3.915  -9.084
  453   1HG2  VAL  58          3HG2      VAL  58   5.559   2.659  -8.962
  454   2HG2  VAL  58          2HG2      VAL  58   5.075   3.800 -10.216
  455   3HG2  VAL  58          1HG2      VAL  58   6.296   2.573 -10.562
  456    H    LYS  59           H        LYS  59   4.318   3.817  -7.982
  457    HA   LYS  59           HA       LYS  59   5.101   2.510  -5.434
  458   1HB   LYS  59          2HB       LYS  59   2.960   4.526  -5.806
  459   2HB   LYS  59          1HB       LYS  59   2.478   3.071  -4.934
  460   1HG   LYS  59          2HG       LYS  59   3.835   3.534  -3.146
  461   2HG   LYS  59          1HG       LYS  59   5.087   4.260  -4.153
  462   1HD   LYS  59          2HD       LYS  59   2.827   5.935  -4.402
  463   2HD   LYS  59          1HD       LYS  59   2.964   5.560  -2.684
  464   1HE   LYS  59          2HE       LYS  59   5.307   6.271  -2.686
  465   2HE   LYS  59          1HE       LYS  59   5.236   6.570  -4.422
  466   1HZ   LYS  59          2HZ       LYS  59   3.151   7.891  -2.959
  467   2HZ   LYS  59          1HZ       LYS  59   4.703   8.389  -2.484
  468   3HZ   LYS  59          3HZ       LYS  59   4.234   8.517  -4.109
  469    H    HIS  60           H        HIS  60   2.724   1.172  -4.952
  470    HA   HIS  60           HA       HIS  60   1.767   0.039  -7.481
  471   1HB   HIS  60          2HB       HIS  60   2.995  -1.943  -5.613
  472   2HB   HIS  60          1HB       HIS  60   2.692  -2.082  -7.341
  473    HD1  HIS  60           HD1      HIS  60   4.432  -1.060  -8.958
  474    HD2  HIS  60           HD2      HIS  60   5.416  -0.570  -4.936
  475    HE1  HIS  60           HE1      HIS  60   6.838  -0.269  -8.900
  476    H    TYR  61           H        TYR  61  -0.092  -1.141  -7.263
  477    HA   TYR  61           HA       TYR  61  -1.230  -1.338  -4.506
  478   1HB   TYR  61          2HB       TYR  61  -2.359  -0.211  -7.003
  479   2HB   TYR  61          1HB       TYR  61  -3.447  -1.296  -6.136
  480    HD1  TYR  61           HD1      TYR  61  -3.666  -0.890  -3.560
  481    HD2  TYR  61           HD2      TYR  61  -2.126   2.011  -6.327
  482    HE1  TYR  61           HE1      TYR  61  -4.132   0.916  -1.925
  483    HE2  TYR  61           HE2      TYR  61  -2.593   3.817  -4.695
  484    HH   TYR  61           HH       TYR  61  -3.472   4.329  -2.723
  485    H    LYS  62           H        LYS  62  -0.652  -3.470  -4.213
  486    HA   LYS  62           HA       LYS  62  -0.555  -5.547  -6.023
  487   1HB   LYS  62          2HB       LYS  62   0.198  -6.030  -3.851
  488   2HB   LYS  62          1HB       LYS  62  -1.296  -5.474  -3.103
  489   1HG   LYS  62          2HG       LYS  62  -1.374  -7.807  -4.990
  490   2HG   LYS  62          1HG       LYS  62  -0.816  -8.051  -3.333
  491   1HD   LYS  62          2HD       LYS  62  -3.143  -6.435  -3.180
  492   2HD   LYS  62          1HD       LYS  62  -3.516  -7.750  -4.292
  493   1HE   LYS  62          2HE       LYS  62  -3.758  -9.131  -2.531
  494   2HE   LYS  62          1HE       LYS  62  -2.059  -8.881  -2.130
  495   1HZ   LYS  62          2HZ       LYS  62  -3.601  -6.639  -1.354
  496   2HZ   LYS  62          1HZ       LYS  62  -4.258  -8.052  -0.680
  497   3HZ   LYS  62          3HZ       LYS  62  -2.634  -7.654  -0.396
  498    H    ILE  63           H        ILE  63  -2.009  -6.305  -7.400
  499    HA   ILE  63           HA       ILE  63  -4.886  -5.871  -6.953
  500    HB   ILE  63           HB       ILE  63  -3.134  -6.594  -9.246
  501   1HG1  ILE  63          2HG1      ILE  63  -5.596  -4.856  -8.974
  502   2HG1  ILE  63          1HG1      ILE  63  -3.941  -4.285  -8.758
  503   1HG2  ILE  63          1HG2      ILE  63  -4.826  -8.426  -9.210
  504   2HG2  ILE  63          3HG2      ILE  63  -6.107  -7.214  -9.185
  505   3HG2  ILE  63          2HG2      ILE  63  -5.049  -7.349 -10.589
  506   1HD1  ILE  63          3HD1      ILE  63  -4.146  -5.770 -11.213
  507   2HD1  ILE  63          2HD1      ILE  63  -5.381  -4.512 -11.177
  508   3HD1  ILE  63          1HD1      ILE  63  -3.682  -4.085 -10.979
  509    H    ARG  64           H        ARG  64  -6.192  -7.469  -6.182
  510    HA   ARG  64           HA       ARG  64  -5.147 -10.268  -6.220
  511   1HB   ARG  64          2HB       ARG  64  -5.803  -8.681  -3.968
  512   2HB   ARG  64          1HB       ARG  64  -7.121  -9.837  -4.152
  513   1HG   ARG  64          2HG       ARG  64  -5.179 -10.655  -2.739
  514   2HG   ARG  64          1HG       ARG  64  -5.600 -11.701  -4.095
  515   1HD   ARG  64          2HD       ARG  64  -3.656 -11.251  -5.214
  516   2HD   ARG  64          1HD       ARG  64  -3.620  -9.571  -4.680
  517    HE   ARG  64           HE       ARG  64  -1.983 -10.417  -3.196
  518   1HH1  ARG  64          2HH1      ARG  64  -3.143 -13.285  -4.043
  519   2HH1  ARG  64          1HH1      ARG  64  -3.353 -13.948  -2.457
  520   1HH2  ARG  64          1HH2      ARG  64  -2.941 -10.908  -0.843
  521   2HH2  ARG  64          2HH2      ARG  64  -3.238 -12.602  -0.644
  522    H    LYS  65           H        LYS  65  -6.426 -11.560  -7.445
  523    HA   LYS  65           HA       LYS  65  -9.190 -10.609  -8.005
  524   1HB   LYS  65          2HB       LYS  65  -7.856 -10.905 -10.008
  525   2HB   LYS  65          1HB       LYS  65  -7.384 -12.526  -9.505
  526   1HG   LYS  65          2HG       LYS  65  -9.886 -13.084  -9.490
  527   2HG   LYS  65          1HG       LYS  65 -10.124 -11.562 -10.349
  528   1HD   LYS  65          2HD       LYS  65  -9.772 -12.810 -12.218
  529   2HD   LYS  65          1HD       LYS  65  -8.069 -12.686 -11.779
  530   1HE   LYS  65          2HE       LYS  65  -8.307 -14.994 -11.976
  531   2HE   LYS  65          1HE       LYS  65  -8.627 -14.771 -10.256
  532   1HZ   LYS  65          2HZ       LYS  65 -11.016 -14.631 -10.821
  533   2HZ   LYS  65          1HZ       LYS  65 -10.634 -15.035 -12.427
  534   3HZ   LYS  65          3HZ       LYS  65 -10.329 -16.142 -11.178
  535    H    LEU  66           H        LEU  66 -10.919 -11.898  -7.553
  536    HA   LEU  66           HA       LEU  66 -10.461 -14.111  -5.695
  537   1HB   LEU  66          2HB       LEU  66 -12.969 -12.879  -6.857
  538   2HB   LEU  66          1HB       LEU  66 -12.998 -14.251  -5.753
  539    HG   LEU  66           HG       LEU  66 -13.289 -12.387  -4.342
  540   1HD1  LEU  66          2HD1      LEU  66 -11.147 -13.961  -3.965
  541   2HD1  LEU  66          1HD1      LEU  66 -10.316 -12.414  -4.149
  542   3HD1  LEU  66          3HD1      LEU  66 -11.526 -12.621  -2.882
  543   1HD2  LEU  66          2HD2      LEU  66 -12.743 -10.685  -6.058
  544   2HD2  LEU  66          1HD2      LEU  66 -11.967 -10.331  -4.515
  545   3HD2  LEU  66          3HD2      LEU  66 -11.028 -11.028  -5.834
  546    H    ASP  67           H        ASP  67 -10.928 -16.290  -6.097
  547    HA   ASP  67           HA       ASP  67 -10.651 -17.152  -8.852
  548   1HB   ASP  67          2HB       ASP  67 -10.711 -18.373  -6.202
  549   2HB   ASP  67          1HB       ASP  67 -11.602 -19.328  -7.384
  550    H    ASN  68           H        ASN  68 -13.220 -16.236  -6.806
  551    HA   ASN  68           HA       ASN  68 -15.310 -17.710  -8.252
  552   1HB   ASN  68          2HB       ASN  68 -15.512 -15.395  -6.297
  553   2HB   ASN  68          1HB       ASN  68 -16.852 -16.405  -6.845
  554   1HD2  ASN  68          2HD2      ASN  68 -14.714 -17.638  -3.711
  555   2HD2  ASN  68          1HD2      ASN  68 -14.704 -16.046  -4.302
  556    H    GLY  69           H        GLY  69 -13.455 -14.918  -8.718
  557   1HA   GLY  69          2HA       GLY  69 -13.603 -13.745 -10.857
  558   2HA   GLY  69          1HA       GLY  69 -15.342 -13.995 -10.796
  559    H    GLY  70           H        GLY  70 -12.685 -12.152  -9.401
  560   1HA   GLY  70          2HA       GLY  70 -14.372  -9.872  -8.990
  561   2HA   GLY  70          1HA       GLY  70 -13.960 -10.644  -7.469
  562    H    TYR  71           H        TYR  71 -12.635  -8.928 -10.258
  563    HA   TYR  71           HA       TYR  71  -9.893  -8.987  -9.246
  564   1HB   TYR  71          2HB       TYR  71 -11.345  -7.666 -11.503
  565   2HB   TYR  71          1HB       TYR  71  -9.850  -6.911 -10.952
  566    HD1  TYR  71           HD1      TYR  71  -7.795  -8.498 -10.642
  567    HD2  TYR  71           HD2      TYR  71 -11.253  -9.470 -12.991
  568    HE1  TYR  71           HE1      TYR  71  -6.473 -10.185 -11.890
  569    HE2  TYR  71           HE2      TYR  71  -9.937 -11.161 -14.237
  570    HH   TYR  71           HH       TYR  71  -7.908 -12.526 -13.893
  571    H    TYR  72           H        TYR  72  -9.300  -7.792  -7.476
  572    HA   TYR  72           HA       TYR  72 -10.464  -5.077  -7.160
  573   1HB   TYR  72          2HB       TYR  72 -11.306  -5.491  -4.957
  574   2HB   TYR  72          1HB       TYR  72 -11.918  -6.799  -5.972
  575    HD1  TYR  72           HD1      TYR  72 -10.795  -9.055  -5.908
  576    HD2  TYR  72           HD2      TYR  72  -9.757  -5.920  -3.176
  577    HE1  TYR  72           HE1      TYR  72  -9.651 -10.699  -4.472
  578    HE2  TYR  72           HE2      TYR  72  -8.615  -7.554  -1.725
  579    HH   TYR  72           HH       TYR  72  -8.345 -10.979  -2.676
  580    H    ILE  73           H        ILE  73  -8.762  -3.720  -6.644
  581    HA   ILE  73           HA       ILE  73  -6.271  -4.857  -5.559
  582    HB   ILE  73           HB       ILE  73  -7.146  -2.050  -6.307
  583   1HG1  ILE  73          2HG1      ILE  73  -4.991  -3.960  -7.225
  584   2HG1  ILE  73          1HG1      ILE  73  -6.389  -3.402  -8.146
  585   1HG2  ILE  73          2HG2      ILE  73  -5.773  -2.113  -4.137
  586   2HG2  ILE  73          1HG2      ILE  73  -4.447  -2.706  -5.139
  587   3HG2  ILE  73          3HG2      ILE  73  -5.149  -1.119  -5.452
  588   1HD1  ILE  73          2HD1      ILE  73  -5.125  -1.050  -7.339
  589   2HD1  ILE  73          1HD1      ILE  73  -3.796  -2.125  -7.772
  590   3HD1  ILE  73          3HD1      ILE  73  -5.059  -1.766  -8.949
  591    H    THR  74           H        THR  74  -9.178  -3.328  -4.535
  592    HA   THR  74           HA       THR  74  -8.364  -3.673  -1.705
  593    HB   THR  74           HB       THR  74  -8.366  -1.421  -1.471
  594    HG1  THR  74           HG1      THR  74 -10.397  -0.577  -1.103
  595   1HG2  THR  74          2HG2      THR  74  -8.247  -1.109  -3.928
  596   2HG2  THR  74          1HG2      THR  74 -10.007  -1.195  -4.008
  597   3HG2  THR  74          3HG2      THR  74  -9.227   0.140  -3.160
  598    H    THR  75           H        THR  75 -10.006  -4.537  -0.466
  599    HA   THR  75           HA       THR  75 -12.043  -6.007  -1.814
  600    HB   THR  75           HB       THR  75 -12.886  -6.532   0.431
  601    HG1  THR  75           HG1      THR  75 -11.642  -5.461   2.169
  602   1HG2  THR  75          3HG2      THR  75 -10.232  -6.867  -0.545
  603   2HG2  THR  75          2HG2      THR  75 -10.135  -6.632   1.203
  604   3HG2  THR  75          1HG2      THR  75 -11.132  -7.928   0.541
  605    H    ARG  76           H        ARG  76 -11.978  -2.715  -1.125
  606    HA   ARG  76           HA       ARG  76 -14.775  -2.307  -0.540
  607   1HB   ARG  76          2HB       ARG  76 -12.432  -0.705  -0.726
  608   2HB   ARG  76          1HB       ARG  76 -13.623  -0.021  -1.833
  609   1HG   ARG  76          2HG       ARG  76 -15.308  -0.198   0.074
  610   2HG   ARG  76          1HG       ARG  76 -13.940  -0.551   1.130
  611   1HD   ARG  76          2HD       ARG  76 -14.418   1.842   1.208
  612   2HD   ARG  76          1HD       ARG  76 -12.874   1.585   0.396
  613    HE   ARG  76           HE       ARG  76 -13.873   2.288  -1.652
  614   1HH1  ARG  76          1HH2      ARG  76 -16.383   0.919  -1.843
  615   2HH1  ARG  76          2HH2      ARG  76 -17.570   2.126  -1.480
  616   1HH2  ARG  76          2HH1      ARG  76 -15.302   4.287   0.007
  617   2HH2  ARG  76          1HH1      ARG  76 -16.958   4.034  -0.433
  618    H    ALA  77           H        ALA  77 -13.078  -3.086  -3.449
  619    HA   ALA  77           HA       ALA  77 -15.580  -2.934  -4.946
  620   1HB   ALA  77          2HB       ALA  77 -13.424  -0.888  -5.337
  621   2HB   ALA  77          1HB       ALA  77 -14.416  -1.389  -6.708
  622   3HB   ALA  77          3HB       ALA  77 -15.173  -0.665  -5.288
  623    H    GLN  78           H        GLN  78 -15.443  -4.866  -5.975
  624    HA   GLN  78           HA       GLN  78 -12.887  -5.627  -7.281
  625   1HB   GLN  78          2HB       GLN  78 -15.163  -7.523  -6.776
  626   2HB   GLN  78          1HB       GLN  78 -13.443  -7.862  -6.914
  627   1HG   GLN  78          2HG       GLN  78 -13.302  -6.305  -4.769
  628   2HG   GLN  78          1HG       GLN  78 -14.985  -6.793  -4.579
  629   1HE2  GLN  78          1HE2      GLN  78 -12.414  -7.575  -3.054
  630   2HE2  GLN  78          2HE2      GLN  78 -12.445  -9.272  -3.050
  631    H    PHE  79           H        PHE  79 -13.444  -7.111  -9.313
  632    HA   PHE  79           HA       PHE  79 -15.884  -6.163 -10.719
  633   1HB   PHE  79          2HB       PHE  79 -13.042  -5.707 -11.648
  634   2HB   PHE  79          1HB       PHE  79 -14.414  -5.671 -12.754
  635    HD1  PHE  79           HD1      PHE  79 -13.214  -4.230  -9.529
  636    HD2  PHE  79           HD2      PHE  79 -15.663  -3.701 -13.014
  637    HE1  PHE  79           HE1      PHE  79 -13.725  -1.925  -8.815
  638    HE2  PHE  79           HE2      PHE  79 -16.171  -1.379 -12.304
  639    HZ   PHE  79           HZ       PHE  79 -15.201  -0.487 -10.202
  640    H    GLU  80           H        GLU  80 -15.259  -7.206 -13.226
  641    HA   GLU  80           HA       GLU  80 -15.104 -10.099 -12.550
  642   1HB   GLU  80          2HB       GLU  80 -16.299 -10.504 -14.610
  643   2HB   GLU  80          1HB       GLU  80 -17.135  -9.207 -13.759
  644   1HG   GLU  80          2HG       GLU  80 -15.675  -7.598 -15.140
  645   2HG   GLU  80          1HG       GLU  80 -15.306  -8.997 -16.150
  646    H    THR  81           H        THR  81 -13.552  -7.536 -14.331
  647    HA   THR  81           HA       THR  81 -11.382  -9.445 -15.044
  648    HB   THR  81           HB       THR  81 -12.395  -9.409 -17.149
  649    HG1  THR  81           HG1      THR  81 -11.233  -6.987 -17.679
  650   1HG2  THR  81          3HG2      THR  81 -14.058  -7.599 -16.222
  651   2HG2  THR  81          2HG2      THR  81 -12.953  -6.480 -17.014
  652   3HG2  THR  81          1HG2      THR  81 -13.780  -7.722 -17.957
  653    H    LEU  82           H        LEU  82  -9.485  -8.075 -16.001
  654    HA   LEU  82           HA       LEU  82  -8.912  -5.977 -14.052
  655   1HB   LEU  82          2HB       LEU  82  -7.376  -7.427 -16.168
  656   2HB   LEU  82          1HB       LEU  82  -6.783  -5.845 -15.660
  657    HG   LEU  82           HG       LEU  82  -7.562  -7.866 -13.578
  658   1HD1  LEU  82          1HD1      LEU  82  -5.935  -8.823 -15.382
  659   2HD1  LEU  82          3HD1      LEU  82  -4.753  -7.734 -14.653
  660   3HD1  LEU  82          2HD1      LEU  82  -5.512  -8.994 -13.677
  661   1HD2  LEU  82          3HD2      LEU  82  -6.161  -5.303 -13.755
  662   2HD2  LEU  82          2HD2      LEU  82  -6.889  -6.089 -12.353
  663   3HD2  LEU  82          1HD2      LEU  82  -5.250  -6.512 -12.850
  664    H    GLN  83           H        GLN  83  -9.550  -6.255 -17.511
  665    HA   GLN  83           HA       GLN  83  -9.118  -3.501 -18.151
  666   1HB   GLN  83          2HB       GLN  83  -9.313  -5.338 -19.843
  667   2HB   GLN  83          1HB       GLN  83 -11.036  -5.439 -19.478
  668   1HG   GLN  83          2HG       GLN  83 -11.267  -3.031 -20.098
  669   2HG   GLN  83          1HG       GLN  83  -9.566  -3.018 -20.564
  670   1HE2  GLN  83          1HE2      GLN  83 -12.162  -5.466 -21.121
  671   2HE2  GLN  83          2HE2      GLN  83 -11.973  -5.496 -22.808
  672    H    GLN  84           H        GLN  84 -11.654  -5.194 -16.523
  673    HA   GLN  84           HA       GLN  84 -13.663  -3.113 -16.933
  674   1HB   GLN  84          2HB       GLN  84 -13.522  -5.716 -15.500
  675   2HB   GLN  84          1HB       GLN  84 -14.741  -4.555 -14.998
  676   1HG   GLN  84          2HG       GLN  84 -15.339  -6.269 -16.880
  677   2HG   GLN  84          1HG       GLN  84 -15.830  -4.598 -17.057
  678   1HE2  GLN  84          2HE2      GLN  84 -13.934  -6.068 -20.104
  679   2HE2  GLN  84          1HE2      GLN  84 -15.017  -6.852 -19.059
  680    H    LEU  85           H        LEU  85 -11.378  -4.034 -14.392
  681    HA   LEU  85           HA       LEU  85 -12.461  -2.047 -12.512
  682   1HB   LEU  85          2HB       LEU  85 -10.835  -2.767 -11.012
  683   2HB   LEU  85          1HB       LEU  85 -10.995  -4.204 -12.021
  684    HG   LEU  85           HG       LEU  85  -9.143  -2.652 -13.388
  685   1HD1  LEU  85          3HD1      LEU  85  -9.090  -2.034 -10.510
  686   2HD1  LEU  85          2HD1      LEU  85  -7.537  -2.569 -11.153
  687   3HD1  LEU  85          1HD1      LEU  85  -8.351  -1.171 -11.859
  688   1HD2  LEU  85          2HD2      LEU  85  -9.373  -5.189 -12.348
  689   2HD2  LEU  85          1HD2      LEU  85  -7.989  -4.574 -13.252
  690   3HD2  LEU  85          3HD2      LEU  85  -7.974  -4.542 -11.489
  691    H    VAL  86           H        VAL  86 -10.147  -2.094 -15.075
  692    HA   VAL  86           HA       VAL  86  -9.004   0.495 -14.347
  693    HB   VAL  86           HB       VAL  86  -7.891   0.334 -16.578
  694   1HG1  VAL  86          2HG1      VAL  86  -7.500  -1.322 -14.331
  695   2HG1  VAL  86          1HG1      VAL  86  -7.358  -2.385 -15.732
  696   3HG1  VAL  86          3HG1      VAL  86  -6.326  -0.960 -15.597
  697   1HG2  VAL  86          3HG2      VAL  86  -9.786  -0.806 -17.709
  698   2HG2  VAL  86          2HG2      VAL  86  -8.256  -1.648 -17.958
  699   3HG2  VAL  86          1HG2      VAL  86  -9.423  -2.267 -16.792
  700    H    GLN  87           H        GLN  87 -11.557  -0.886 -16.179
  701    HA   GLN  87           HA       GLN  87 -12.222   1.354 -17.833
  702   1HB   GLN  87          2HB       GLN  87 -13.010  -1.003 -18.170
  703   2HB   GLN  87          1HB       GLN  87 -14.043  -0.810 -16.763
  704   1HG   GLN  87          2HG       GLN  87 -15.359   0.849 -17.804
  705   2HG   GLN  87          1HG       GLN  87 -14.164   1.127 -19.070
  706   1HE2  GLN  87          2HE2      GLN  87 -17.064  -1.321 -20.001
  707   2HE2  GLN  87          1HE2      GLN  87 -17.142   0.022 -18.965
  708    H    HIS  88           H        HIS  88 -13.341   0.190 -14.699
  709    HA   HIS  88           HA       HIS  88 -15.181   2.410 -14.341
  710   1HB   HIS  88          2HB       HIS  88 -15.264  -0.034 -13.377
  711   2HB   HIS  88          1HB       HIS  88 -14.242   0.644 -12.117
  712    HD1  HIS  88           HD1      HIS  88 -17.736   0.532 -13.311
  713    HD2  HIS  88           HD2      HIS  88 -15.507   2.850 -10.659
  714    HE1  HIS  88           HE1      HIS  88 -19.406   1.819 -11.907
  715    H    TYR  89           H        TYR  89 -12.004   1.449 -13.304
  716    HA   TYR  89           HA       TYR  89 -11.658   3.581 -11.394
  717   1HB   TYR  89          2HB       TYR  89  -9.749   1.690 -12.761
  718   2HB   TYR  89          1HB       TYR  89  -9.228   2.877 -11.572
  719    HD1  TYR  89           HD1      TYR  89 -12.518   1.232 -11.326
  720    HD2  TYR  89           HD2      TYR  89  -8.440   1.189  -9.991
  721    HE1  TYR  89           HE1      TYR  89 -13.138  -0.290  -9.516
  722    HE2  TYR  89           HE2      TYR  89  -9.066  -0.362  -8.162
  723    HH   TYR  89           HH       TYR  89 -10.836  -1.986  -7.655
  724    H    SER  90           H        SER  90 -11.462   3.353 -14.810
  725    HA   SER  90           HA       SER  90  -9.592   5.517 -15.215
  726   1HB   SER  90          2HB       SER  90 -11.115   3.684 -16.879
  727   2HB   SER  90          1HB       SER  90 -11.204   5.329 -17.497
  728    HG   SER  90           HG       SER  90  -9.211   5.187 -18.083
  729    H    GLU  91           H        GLU  91 -13.009   5.142 -14.763
  730    HA   GLU  91           HA       GLU  91 -13.556   7.962 -15.473
  731   1HB   GLU  91          2HB       GLU  91 -15.348   5.726 -14.471
  732   2HB   GLU  91          1HB       GLU  91 -15.914   7.351 -14.856
  733   1HG   GLU  91          2HG       GLU  91 -14.321   6.385 -17.041
  734   2HG   GLU  91          1HG       GLU  91 -15.536   5.170 -16.643
  735    H    ARG  92           H        ARG  92 -12.746   6.015 -12.769
  736    HA   ARG  92           HA       ARG  92 -12.870   8.381 -11.016
  737   1HB   ARG  92          2HB       ARG  92 -14.215   5.921  -9.956
  738   2HB   ARG  92          1HB       ARG  92 -14.438   7.605  -9.481
  739   1HG   ARG  92          2HG       ARG  92 -15.581   8.061 -11.618
  740   2HG   ARG  92          1HG       ARG  92 -15.345   6.384 -12.108
  741   1HD   ARG  92          2HD       ARG  92 -17.369   6.008 -11.155
  742   2HD   ARG  92          1HD       ARG  92 -16.512   6.119  -9.618
  743    HE   ARG  92           HE       ARG  92 -17.519   8.229  -9.268
  744   1HH1  ARG  92          1HH2      ARG  92 -16.948   9.960 -11.362
  745   2HH1  ARG  92          2HH2      ARG  92 -18.374  10.030 -12.343
  746   1HH2  ARG  92          2HH1      ARG  92 -19.737   7.121 -11.041
  747   2HH2  ARG  92          1HH1      ARG  92 -19.952   8.424 -12.161
  748    H    ALA  93           H        ALA  93 -11.561   8.051  -9.084
  749    HA   ALA  93           HA       ALA  93  -9.277   6.415  -9.474
  750   1HB   ALA  93          3HB       ALA  93  -9.383   8.352  -7.892
  751   2HB   ALA  93          2HB       ALA  93 -10.386   7.377  -6.818
  752   3HB   ALA  93          1HB       ALA  93  -8.720   6.898  -7.143
  753    H    ALA  94           H        ALA  94 -12.135   5.887  -7.435
  754    HA   ALA  94           HA       ALA  94 -13.242   3.794  -7.107
  755   1HB   ALA  94          2HB       ALA  94 -11.626   2.902  -8.982
  756   2HB   ALA  94          1HB       ALA  94 -10.696   2.286  -7.615
  757   3HB   ALA  94          3HB       ALA  94 -12.366   1.766  -7.852
  758    H    GLY  95           H        GLY  95 -10.417   5.087  -5.764
  759   1HA   GLY  95          2HA       GLY  95 -10.809   4.973  -3.167
  760   2HA   GLY  95          1HA       GLY  95 -10.552   3.252  -3.430
  761    H    LEU  96           H        LEU  96  -8.497   3.656  -5.496
  762    HA   LEU  96           HA       LEU  96  -6.247   4.002  -3.683
  763   1HB   LEU  96          2HB       LEU  96  -4.881   3.235  -5.449
  764   2HB   LEU  96          1HB       LEU  96  -6.387   2.341  -5.623
  765    HG   LEU  96           HG       LEU  96  -5.616   4.828  -7.178
  766   1HD1  LEU  96          1HD1      LEU  96  -5.819   1.904  -7.926
  767   2HD1  LEU  96          3HD1      LEU  96  -5.557   3.214  -9.080
  768   3HD1  LEU  96          2HD1      LEU  96  -4.338   2.861  -7.852
  769   1HD2  LEU  96          2HD2      LEU  96  -8.062   3.059  -7.209
  770   2HD2  LEU  96          1HD2      LEU  96  -7.994   4.804  -6.961
  771   3HD2  LEU  96          3HD2      LEU  96  -7.639   4.125  -8.550
  772    H    SER  97           H        SER  97  -4.331   5.352  -4.485
  773    HA   SER  97           HA       SER  97  -4.718   8.030  -4.197
  774   1HB   SER  97          2HB       SER  97  -2.716   6.573  -5.912
  775   2HB   SER  97          1HB       SER  97  -2.679   8.328  -5.751
  776    HG   SER  97           HG       SER  97  -2.240   8.152  -3.642
  777    H    SER  98           H        SER  98  -4.762   6.412  -7.386
  778    HA   SER  98           HA       SER  98  -6.685   8.447  -8.308
  779   1HB   SER  98          2HB       SER  98  -5.339   9.590  -9.744
  780   2HB   SER  98          1HB       SER  98  -4.051   9.034  -8.674
  781    HG   SER  98           HG       SER  98  -4.077   7.094 -10.099
  782    H    ARG  99           H        ARG  99  -6.856   8.024 -10.896
  783    HA   ARG  99           HA       ARG  99  -7.981   5.379 -11.142
  784   1HB   ARG  99          2HB       ARG  99  -7.366   7.451 -13.269
  785   2HB   ARG  99          1HB       ARG  99  -8.413   6.050 -13.479
  786   1HG   ARG  99          2HG       ARG  99  -9.811   6.925 -11.560
  787   2HG   ARG  99          1HG       ARG  99  -8.837   8.394 -11.604
  788   1HD   ARG  99          2HD       ARG  99  -9.596   7.912 -14.274
  789   2HD   ARG  99          1HD       ARG  99 -11.046   7.624 -13.311
  790    HE   ARG  99           HE       ARG  99  -9.515  10.188 -13.342
  791   1HH1  ARG  99          2HH1      ARG  99 -11.001   9.891 -10.824
  792   2HH1  ARG  99          1HH1      ARG  99 -12.563  10.534 -11.208
  793   1HH2  ARG  99          1HH2      ARG  99 -12.096  10.331 -14.638
  794   2HH2  ARG  99          2HH2      ARG  99 -13.183  10.783 -13.367
  795    H    LEU 100           H        LEU 100  -7.248   4.551 -13.696
  796    HA   LEU 100           HA       LEU 100  -4.700   3.263 -13.136
  797   1HB   LEU 100          2HB       LEU 100  -5.635   3.209 -15.948
  798   2HB   LEU 100          1HB       LEU 100  -5.109   1.888 -14.917
  799    HG   LEU 100           HG       LEU 100  -7.350   1.382 -15.189
  800   1HD1  LEU 100          1HD1      LEU 100  -6.652   2.390 -12.676
  801   2HD1  LEU 100          3HD1      LEU 100  -8.231   3.090 -13.035
  802   3HD1  LEU 100          2HD1      LEU 100  -8.020   1.335 -13.048
  803   1HD2  LEU 100          2HD2      LEU 100  -7.536   4.225 -15.739
  804   2HD2  LEU 100          1HD2      LEU 100  -8.547   2.903 -16.321
  805   3HD2  LEU 100          3HD2      LEU 100  -8.893   3.659 -14.767
  806    H    VAL 101           H        VAL 101  -3.558   3.365 -15.822
  807    HA   VAL 101           HA       VAL 101  -1.940   5.715 -15.524
  808    HB   VAL 101           HB       VAL 101  -1.031   5.071 -17.736
  809   1HG1  VAL 101          3HG1      VAL 101  -0.335   3.902 -15.625
  810   2HG1  VAL 101          2HG1      VAL 101  -1.533   2.657 -15.976
  811   3HG1  VAL 101          1HG1      VAL 101  -0.171   2.903 -17.069
  812   1HG2  VAL 101          1HG2      VAL 101  -3.442   3.266 -17.690
  813   2HG2  VAL 101          3HG2      VAL 101  -2.920   4.363 -18.967
  814   3HG2  VAL 101          2HG2      VAL 101  -2.027   2.872 -18.667
  815    H    VAL 102           H        VAL 102  -2.863   7.698 -15.752
  816    HA   VAL 102           HA       VAL 102  -5.072   8.195 -17.563
  817    HB   VAL 102           HB       VAL 102  -3.399  10.435 -16.504
  818   1HG1  VAL 102          3HG1      VAL 102  -5.489  10.817 -17.792
  819   2HG1  VAL 102          2HG1      VAL 102  -6.382   9.896 -16.581
  820   3HG1  VAL 102          1HG1      VAL 102  -5.613  11.421 -16.139
  821   1HG2  VAL 102          3HG2      VAL 102  -4.828   8.369 -14.871
  822   2HG2  VAL 102          2HG2      VAL 102  -3.335   9.237 -14.514
  823   3HG2  VAL 102          1HG2      VAL 102  -4.890  10.051 -14.348
  824    HA   PRO 103           HA       PRO 103  -1.694  10.337 -20.174
  825   1HB   PRO 103          2HB       PRO 103   0.926   9.873 -19.487
  826   2HB   PRO 103          1HB       PRO 103  -0.025  11.230 -18.864
  827   1HG   PRO 103          2HG       PRO 103   0.806   8.720 -17.483
  828   2HG   PRO 103          1HG       PRO 103   0.417  10.301 -16.791
  829   1HD   PRO 103          2HD       PRO 103  -1.276   8.018 -16.852
  830   2HD   PRO 103          1HD       PRO 103  -1.752   9.666 -16.402
  831    H    SER 104           H        SER 104  -0.955   7.137 -18.881
  832    HA   SER 104           HA       SER 104  -0.397   5.129 -19.960
  833   1HB   SER 104          2HB       SER 104  -2.342   6.442 -21.538
  834   2HB   SER 104          1HB       SER 104  -1.122   5.843 -22.662
  835    HG   SER 104           HG       SER 104  -2.912   4.473 -21.101
  836    H    HIS 105           H        HIS 105   0.826   4.353 -22.119
  837    HA   HIS 105           HA       HIS 105   3.448   5.364 -22.022
  838   1HB   HIS 105          2HB       HIS 105   3.739   4.248 -24.265
  839   2HB   HIS 105          1HB       HIS 105   3.013   3.211 -23.036
  840    HD1  HIS 105           HD1      HIS 105   2.412   4.613 -26.369
  841    HD2  HIS 105           HD2      HIS 105   0.066   3.042 -23.302
  842    HE1  HIS 105           HE1      HIS 105   0.153   4.092 -27.389
  843    H    LYS 106           HN       LYS 106   0.819   6.209 -24.278
  844    HA   LYS 106           HA       LYS 106   2.082   7.881 -26.061
  845   1HB   LYS 106          2HB       LYS 106  -0.592   7.633 -25.009
  846   2HB   LYS 106          1HB       LYS 106  -0.201   9.337 -25.248
  847   1HG   LYS 106          2HG       LYS 106  -0.055   9.121 -27.522
  848   2HG   LYS 106          1HG       LYS 106   0.631   7.498 -27.425
  849   1HD   LYS 106          2HD       LYS 106  -1.401   6.641 -27.879
  850   2HD   LYS 106          1HD       LYS 106  -2.012   7.351 -26.385
  851   1HE   LYS 106          2HE       LYS 106  -2.644   9.374 -27.499
  852   2HE   LYS 106          1HE       LYS 106  -1.755   8.928 -28.955
  853   1HZ   LYS 106          1HZ       LYS 106  -3.496   6.849 -28.464
  854   2HZ   LYS 106          3HZ       LYS 106  -4.405   8.257 -28.208
  855   3HZ   LYS 106          2HZ       LYS 106  -3.616   8.016 -29.693
  856   1H    GLU 201          3HT       GLU 201  10.469  -6.574   2.568
  857   2H    GLU 201          2HT       GLU 201  11.564  -6.731   1.278
  858   3H    GLU 201          1HT       GLU 201  11.686  -5.413   2.344
  859    HA   GLU 201           HA       GLU 201  10.649  -4.426   0.570
  860   1HB   GLU 201          2HB       GLU 201   9.070  -5.547  -0.868
  861   2HB   GLU 201          1HB       GLU 201  10.427  -6.647  -0.626
  862   1HG   GLU 201          2HG       GLU 201   9.161  -7.793   1.173
  863   2HG   GLU 201          1HG       GLU 201   7.794  -6.718   0.877
  864    HA   PRO 202           HA       PRO 202   7.407  -3.007   3.178
  865   1HB   PRO 202          2HB       PRO 202   6.301  -1.179   1.447
  866   2HB   PRO 202          1HB       PRO 202   7.825  -0.911   2.310
  867   1HG   PRO 202          2HG       PRO 202   7.387  -1.572  -0.565
  868   2HG   PRO 202          1HG       PRO 202   8.734  -0.709   0.195
  869   1HD   PRO 202          2HD       PRO 202   8.764  -3.410  -0.652
  870   2HD   PRO 202          1HD       PRO 202   9.968  -2.630   0.396
  871    H    GLN 203           H        GLN 203   4.875  -2.355   2.720
  872    HA   GLN 203           HA       GLN 203   3.711  -4.790   1.456
  873   1HB   GLN 203          2HB       GLN 203   3.116  -3.263   3.837
  874   2HB   GLN 203          1HB       GLN 203   1.697  -3.324   2.790
  875   1HG   GLN 203          2HG       GLN 203   1.888  -5.773   2.651
  876   2HG   GLN 203          1HG       GLN 203   3.323  -5.726   3.675
  877   1HE2  GLN 203          2HE2      GLN 203  -0.052  -6.146   5.576
  878   2HE2  GLN 203          1HE2      GLN 203   0.362  -6.755   4.047
  879   1HN   PTR 204          1HN       PTR 204   1.397  -4.276   0.515
  880    HA   PTR 204           HA       PTR 204   1.801  -2.135  -1.485
  881   1HB   PTR 204          1HB       PTR 204  -0.410  -3.164  -2.384
  882    HD1  PTR 204           HD1      PTR 204   1.156  -2.742  -4.245
  883    HD2  PTR 204           HD2      PTR 204   1.729  -6.008  -1.509
  884    HE1  PTR 204           HE1      PTR 204   2.788  -3.775  -5.809
  885    HE2  PTR 204           HE2      PTR 204   3.360  -7.033  -3.071
  886    H    GLU 205           H        GLU 205   0.588  -0.265  -1.534
  887    HA   GLU 205           HA       GLU 205  -0.727   0.676   0.785
  888   1HB   GLU 205          2HB       GLU 205  -1.048   1.519  -2.112
  889   2HB   GLU 205          1HB       GLU 205  -1.709   2.417  -0.744
  890   1HG   GLU 205          2HG       GLU 205   1.038   1.834  -0.189
  891   2HG   GLU 205          1HG       GLU 205   0.935   2.539  -1.802
  892    H    GLU 206           H        GLU 206  -2.796   0.426   1.547
  893    HA   GLU 206           HA       GLU 206  -4.713  -1.044  -0.220
  894   1HB   GLU 206          2HB       GLU 206  -4.596  -1.125   2.808
  895   2HB   GLU 206          1HB       GLU 206  -5.614  -2.113   1.760
  896   1HG   GLU 206          2HG       GLU 206  -3.825  -3.410   1.014
  897   2HG   GLU 206          1HG       GLU 206  -2.636  -2.161   1.386
  898    H    ILE 207           H        ILE 207  -6.364   0.259  -0.817
  899    HA   ILE 207           HA       ILE 207  -6.928   2.835  -0.025
  900    HB   ILE 207           HB       ILE 207  -8.769   0.613  -0.910
  901   1HG1  ILE 207          2HG1      ILE 207  -8.920   2.276  -2.882
  902   2HG1  ILE 207          1HG1      ILE 207  -7.541   3.086  -2.138
  903   1HG2  ILE 207          1HG2      ILE 207  -9.509   3.505  -0.356
  904   2HG2  ILE 207          3HG2      ILE 207 -10.535   2.340  -1.193
  905   3HG2  ILE 207          2HG2      ILE 207 -10.124   2.093   0.505
  906   1HD1  ILE 207          3HD1      ILE 207  -7.313   0.141  -2.426
  907   2HD1  ILE 207          2HD1      ILE 207  -7.278   1.070  -3.926
  908   3HD1  ILE 207          1HD1      ILE 207  -6.094   1.393  -2.660
  909    HA   PRO 208           HA       PRO 208  -7.995   1.867   4.266
  910   1HB   PRO 208          2HB       PRO 208  -7.312   4.360   5.200
  911   2HB   PRO 208          1HB       PRO 208  -6.142   3.050   4.962
  912   1HG   PRO 208          2HG       PRO 208  -6.581   5.495   3.314
  913   2HG   PRO 208          1HG       PRO 208  -5.114   4.522   3.510
  914   1HD   PRO 208          2HD       PRO 208  -6.883   4.437   1.298
  915   2HD   PRO 208          1HD       PRO 208  -5.601   3.263   1.658
  916    H    ILE 209           H        ILE 209  -9.219   3.668   5.866
  917    HA   ILE 209           HA       ILE 209 -11.041   5.500   4.693
  918    HB   ILE 209           HB       ILE 209 -11.867   3.333   3.637
  919   1HG1  ILE 209          2HG1      ILE 209 -13.888   4.635   5.478
  920   2HG1  ILE 209          1HG1      ILE 209 -13.243   5.449   4.051
  921   1HG2  ILE 209          2HG2      ILE 209 -12.602   2.809   6.532
  922   2HG2  ILE 209          1HG2      ILE 209 -13.266   1.913   5.165
  923   3HG2  ILE 209          3HG2      ILE 209 -11.540   1.833   5.517
  924   1HD1  ILE 209          1HD1      ILE 209 -14.358   2.675   3.779
  925   2HD1  ILE 209          3HD1      ILE 209 -15.464   4.047   3.859
  926   3HD1  ILE 209          2HD1      ILE 209 -14.259   3.959   2.574
  927    H    TYR 210           H        TYR 210 -10.392   3.151   7.230
  928    HA   TYR 210           HA       TYR 210 -12.204   4.006   9.209
  929   1HB   TYR 210          2HB       TYR 210  -9.558   2.673   9.188
  930   2HB   TYR 210          1HB       TYR 210  -9.991   3.470  10.700
  931    HD1  TYR 210           HD1      TYR 210 -12.182   2.895  11.820
  932    HD2  TYR 210           HD2      TYR 210 -10.618   0.650   8.508
  933    HE1  TYR 210           HE1      TYR 210 -13.700   1.014  12.377
  934    HE2  TYR 210           HE2      TYR 210 -12.135  -1.230   9.065
  935    HH   TYR 210           HH       TYR 210 -13.351  -2.089  11.026
  936    H    LEU 211           HN       LEU 211 -10.925   5.061  11.358
  937    HA   LEU 211           HA       LEU 211 -10.128   7.765  10.368
  938   1HB   LEU 211          2HB       LEU 211 -11.771   6.799  12.633
  939   2HB   LEU 211          1HB       LEU 211 -10.670   8.123  13.019
  940    HG   LEU 211           HG       LEU 211 -12.142   8.428  10.473
  941   1HD1  LEU 211          3HD1      LEU 211 -13.759   7.371  12.221
  942   2HD1  LEU 211          2HD1      LEU 211 -13.650   8.932  13.033
  943   3HD1  LEU 211          1HD1      LEU 211 -14.273   8.836  11.385
  944   1HD2  LEU 211          2HD2      LEU 211 -11.118  10.061  12.740
  945   2HD2  LEU 211          1HD2      LEU 211 -11.040  10.371  11.005
  946   3HD2  LEU 211          3HD2      LEU 211 -12.531  10.690  11.892
   
  No H/Q in entry =         946
  Start of MODEL   16
    1   1H    SER   1          2HT       SER   1  -8.505 -10.197 -25.077
    2   2H    SER   1          1HT       SER   1  -7.504 -11.300 -25.892
    3   3H    SER   1          3HT       SER   1  -8.098 -11.677 -24.349
    4    HA   SER   1           HA       SER   1  -6.185 -10.906 -23.552
    5   1HB   SER   1          2HB       SER   1  -5.508 -10.928 -26.103
    6   2HB   SER   1          1HB       SER   1  -5.636  -9.176 -25.944
    7    HG   SER   1           HG       SER   1  -4.162 -10.777 -24.140
    8    H    ILE   2           H        ILE   2  -6.240  -9.376 -21.979
    9    HA   ILE   2           HA       ILE   2  -8.093  -7.290 -21.819
   10    HB   ILE   2           HB       ILE   2  -6.459  -6.242 -20.171
   11   1HG1  ILE   2          2HG1      ILE   2  -4.832  -8.678 -20.974
   12   2HG1  ILE   2          1HG1      ILE   2  -4.387  -6.998 -21.270
   13   1HG2  ILE   2          1HG2      ILE   2  -8.065  -8.476 -19.972
   14   2HG2  ILE   2          3HG2      ILE   2  -6.514  -9.073 -19.379
   15   3HG2  ILE   2          2HG2      ILE   2  -7.272  -7.677 -18.614
   16   1HD1  ILE   2          2HD1      ILE   2  -4.372  -6.581 -18.829
   17   2HD1  ILE   2          1HD1      ILE   2  -4.792  -8.270 -18.544
   18   3HD1  ILE   2          3HD1      ILE   2  -3.237  -7.857 -19.267
   19    H    GLN   3           H        GLN   3  -7.225  -4.849 -21.582
   20    HA   GLN   3           HA       GLN   3  -6.817  -3.821 -24.156
   21   1HB   GLN   3          2HB       GLN   3  -7.278  -2.686 -21.757
   22   2HB   GLN   3          1HB       GLN   3  -5.560  -2.319 -21.914
   23   1HG   GLN   3          2HG       GLN   3  -6.396  -0.501 -23.051
   24   2HG   GLN   3          1HG       GLN   3  -6.356  -1.645 -24.393
   25   1HE2  GLN   3          2HE2      GLN   3  -9.803  -0.094 -24.067
   26   2HE2  GLN   3          1HE2      GLN   3  -8.250   0.583 -24.168
   27    H    ALA   4           H        ALA   4  -4.513  -5.296 -22.038
   28    HA   ALA   4           HA       ALA   4  -2.213  -5.663 -22.257
   29   1HB   ALA   4          2HB       ALA   4  -3.366  -6.316 -24.594
   30   2HB   ALA   4          1HB       ALA   4  -2.309  -5.021 -25.156
   31   3HB   ALA   4          3HB       ALA   4  -1.624  -6.423 -24.336
   32    H    GLU   5           H        GLU   5  -3.355  -2.800 -22.064
   33    HA   GLU   5           HA       GLU   5  -0.910  -1.403 -21.917
   34   1HB   GLU   5          2HB       GLU   5  -1.135   0.069 -23.957
   35   2HB   GLU   5          1HB       GLU   5  -0.698  -1.602 -24.314
   36   1HG   GLU   5          2HG       GLU   5  -2.681  -2.028 -25.354
   37   2HG   GLU   5          1HG       GLU   5  -3.605  -1.076 -24.191
   38    H    GLU   6           H        GLU   6  -1.478   1.162 -22.289
   39    HA   GLU   6           HA       GLU   6  -2.748   2.975 -21.525
   40   1HB   GLU   6          2HB       GLU   6  -4.782   0.981 -22.356
   41   2HB   GLU   6          1HB       GLU   6  -5.340   2.235 -21.249
   42   1HG   GLU   6          2HG       GLU   6  -4.560   3.979 -22.748
   43   2HG   GLU   6          1HG       GLU   6  -3.816   2.785 -23.812
   44    H    TRP   7           H        TRP   7  -2.005   0.380 -19.798
   45    HA   TRP   7           HA       TRP   7  -2.148   1.438 -17.248
   46   1HB   TRP   7          2HB       TRP   7  -4.212   0.321 -16.306
   47   2HB   TRP   7          1HB       TRP   7  -4.549   1.668 -17.389
   48    HD1  TRP   7           HD1      TRP   7  -5.547   1.113 -19.776
   49    HE1  TRP   7           HE1      TRP   7  -6.678  -0.991 -20.740
   50    HE3  TRP   7           HE3      TRP   7  -4.192  -2.305 -16.238
   51    HZ2  TRP   7           HZ2      TRP   7  -6.962  -3.763 -20.096
   52    HZ3  TRP   7           HZ3      TRP   7  -4.900  -4.670 -16.442
   53    HH2  TRP   7           HH2      TRP   7  -6.282  -5.404 -18.365
   54    H    TYR   8           H        TYR   8  -1.495  -1.101 -19.253
   55    HA   TYR   8           HA       TYR   8  -0.665  -2.768 -16.982
   56   1HB   TYR   8          2HB       TYR   8  -2.626  -3.892 -17.215
   57   2HB   TYR   8          1HB       TYR   8  -2.857  -3.375 -18.877
   58    HD1  TYR   8           HD1      TYR   8  -1.637  -4.530 -20.727
   59    HD2  TYR   8           HD2      TYR   8  -1.586  -5.972 -16.680
   60    HE1  TYR   8           HE1      TYR   8  -0.868  -6.747 -21.529
   61    HE2  TYR   8           HE2      TYR   8  -0.803  -8.179 -17.482
   62    HH   TYR   8           HH       TYR   8   0.472  -8.718 -20.465
   63    H    PHE   9           H        PHE   9   1.277  -3.649 -17.331
   64    HA   PHE   9           HA       PHE   9   2.480  -3.379 -20.026
   65   1HB   PHE   9          2HB       PHE   9   3.578  -3.694 -17.238
   66   2HB   PHE   9          1HB       PHE   9   4.596  -4.024 -18.638
   67    HD1  PHE   9           HD1      PHE   9   1.927  -1.553 -18.966
   68    HD2  PHE   9           HD2      PHE   9   6.077  -2.095 -17.976
   69    HE1  PHE   9           HE1      PHE   9   2.315   0.877 -19.247
   70    HE2  PHE   9           HE2      PHE   9   6.459   0.334 -18.261
   71    HZ   PHE   9           HZ       PHE   9   4.580   1.822 -18.895
   72    H    GLY  10           H        GLY  10   2.005  -5.822 -17.468
   73   1HA   GLY  10          2HA       GLY  10   1.290  -8.027 -18.776
   74   2HA   GLY  10          1HA       GLY  10   2.957  -7.922 -19.323
   75    H    LYS  11           H        LYS  11   4.288  -9.141 -18.152
   76    HA   LYS  11           HA       LYS  11   3.575  -9.791 -15.337
   77   1HB   LYS  11          2HB       LYS  11   5.655 -11.151 -17.064
   78   2HB   LYS  11          1HB       LYS  11   4.901 -11.768 -15.595
   79   1HG   LYS  11          2HG       LYS  11   3.032 -12.459 -16.702
   80   2HG   LYS  11          1HG       LYS  11   2.999 -11.025 -17.730
   81   1HD   LYS  11          2HD       LYS  11   3.684 -12.435 -19.377
   82   2HD   LYS  11          1HD       LYS  11   5.268 -12.316 -18.612
   83   1HE   LYS  11          2HE       LYS  11   5.180 -14.527 -18.194
   84   2HE   LYS  11          1HE       LYS  11   3.811 -14.232 -17.123
   85   1HZ   LYS  11          1HZ       LYS  11   3.602 -14.614 -20.060
   86   2HZ   LYS  11          3HZ       LYS  11   3.319 -15.829 -18.910
   87   3HZ   LYS  11          2HZ       LYS  11   2.314 -14.460 -18.962
   88    H    LEU  12           H        LEU  12   4.382  -7.502 -14.994
   89    HA   LEU  12           HA       LEU  12   7.357  -7.364 -14.960
   90   1HB   LEU  12          2HB       LEU  12   5.940  -5.563 -16.093
   91   2HB   LEU  12          1HB       LEU  12   5.425  -5.092 -14.474
   92    HG   LEU  12           HG       LEU  12   7.682  -4.587 -13.820
   93   1HD1  LEU  12          1HD1      LEU  12   8.303  -6.299 -16.128
   94   2HD1  LEU  12          3HD1      LEU  12   9.294  -4.842 -16.049
   95   3HD1  LEU  12          2HD1      LEU  12   9.266  -5.960 -14.685
   96   1HD2  LEU  12          1HD2      LEU  12   6.517  -3.431 -16.246
   97   2HD2  LEU  12          3HD2      LEU  12   7.202  -2.627 -14.832
   98   3HD2  LEU  12          2HD2      LEU  12   8.260  -3.186 -16.129
   99    H    GLY  13           H        GLY  13   8.267  -6.122 -13.028
  100   1HA   GLY  13          2HA       GLY  13   6.862  -7.039 -10.553
  101   2HA   GLY  13          1HA       GLY  13   8.615  -6.939 -10.705
  102    H    ARG  14           H        ARG  14   8.503  -5.549  -8.771
  103    HA   ARG  14           HA       ARG  14   7.273  -2.884  -9.118
  104   1HB   ARG  14          2HB       ARG  14   7.905  -2.526  -6.800
  105   2HB   ARG  14          1HB       ARG  14   7.153  -4.112  -6.944
  106   1HG   ARG  14          2HG       ARG  14  10.059  -4.148  -7.385
  107   2HG   ARG  14          1HG       ARG  14   9.600  -3.624  -5.766
  108   1HD   ARG  14          2HD       ARG  14   7.979  -5.690  -5.861
  109   2HD   ARG  14          1HD       ARG  14   9.065  -6.248  -7.132
  110    HE   ARG  14           HE       ARG  14  10.862  -6.331  -5.490
  111   1HH1  ARG  14          1HH2      ARG  14  10.790  -4.599  -3.424
  112   2HH1  ARG  14          2HH2      ARG  14   9.852  -5.311  -2.154
  113   1HH2  ARG  14          2HH1      ARG  14   8.334  -7.643  -4.222
  114   2HH2  ARG  14          1HH1      ARG  14   8.461  -7.034  -2.606
  115    H    LYS  15           H        LYS  15  10.367  -4.386  -9.440
  116    HA   LYS  15           HA       LYS  15  11.912  -1.978  -9.077
  117   1HB   LYS  15          2HB       LYS  15  12.469  -4.785  -9.913
  118   2HB   LYS  15          1HB       LYS  15  13.640  -3.547 -10.366
  119   1HG   LYS  15          2HG       LYS  15  13.488  -2.801  -7.883
  120   2HG   LYS  15          1HG       LYS  15  12.760  -4.383  -7.605
  121   1HD   LYS  15          2HD       LYS  15  15.006  -4.875  -9.226
  122   2HD   LYS  15          1HD       LYS  15  15.549  -3.704  -8.024
  123   1HE   LYS  15          2HE       LYS  15  15.040  -5.127  -6.225
  124   2HE   LYS  15          1HE       LYS  15  13.921  -6.095  -7.185
  125   1HZ   LYS  15          3HZ       LYS  15  16.365  -6.263  -8.454
  126   2HZ   LYS  15          2HZ       LYS  15  16.703  -6.448  -6.798
  127   3HZ   LYS  15          1HZ       LYS  15  15.589  -7.479  -7.561
  128    H    ASP  16           H        ASP  16  10.611  -3.775 -11.830
  129    HA   ASP  16           HA       ASP  16  11.878  -2.041 -13.746
  130   1HB   ASP  16          2HB       ASP  16  11.036  -4.516 -13.980
  131   2HB   ASP  16          1HB       ASP  16   9.510  -3.732 -14.356
  132    H    ALA  17           H        ALA  17   8.692  -2.405 -12.295
  133    HA   ALA  17           HA       ALA  17   7.301  -0.515 -13.888
  134   1HB   ALA  17          3HB       ALA  17   6.491  -2.165 -11.970
  135   2HB   ALA  17          2HB       ALA  17   6.678  -0.721 -10.973
  136   3HB   ALA  17          1HB       ALA  17   5.579  -0.704 -12.353
  137    H    GLU  18           H        GLU  18   9.008  -0.066 -10.798
  138    HA   GLU  18           HA       GLU  18   8.562   2.739 -10.593
  139   1HB   GLU  18          2HB       GLU  18  10.650   2.728  -9.178
  140   2HB   GLU  18          1HB       GLU  18   9.450   1.530  -8.692
  141   1HG   GLU  18          2HG       GLU  18  11.299   0.159  -8.748
  142   2HG   GLU  18          1HG       GLU  18  10.829   0.035 -10.443
  143    H    ARG  19           H        ARG  19  11.256   0.920 -12.087
  144    HA   ARG  19           HA       ARG  19  12.473   3.385 -13.095
  145   1HB   ARG  19          2HB       ARG  19  13.350   0.764 -12.670
  146   2HB   ARG  19          1HB       ARG  19  13.337   0.943 -14.424
  147   1HG   ARG  19          2HG       ARG  19  15.440   1.797 -13.932
  148   2HG   ARG  19          1HG       ARG  19  14.475   3.271 -13.865
  149   1HD   ARG  19          2HD       ARG  19  14.374   3.213 -11.481
  150   2HD   ARG  19          1HD       ARG  19  14.973   1.555 -11.426
  151    HE   ARG  19           HE       ARG  19  17.183   2.382 -11.744
  152   1HH1  ARG  19          2HH1      ARG  19  14.837   4.732 -12.624
  153   2HH1  ARG  19          1HH1      ARG  19  15.918   6.075 -12.461
  154   1HH2  ARG  19          1HH2      ARG  19  18.570   4.144 -11.339
  155   2HH2  ARG  19          2HH2      ARG  19  18.031   5.742 -11.733
  156    H    GLN  20           H        GLN  20   9.803   1.606 -14.026
  157    HA   GLN  20           HA       GLN  20  10.205   1.907 -16.930
  158   1HB   GLN  20          2HB       GLN  20   8.121   0.676 -15.170
  159   2HB   GLN  20          1HB       GLN  20   7.633   1.188 -16.786
  160   1HG   GLN  20          2HG       GLN  20  10.103  -0.491 -16.338
  161   2HG   GLN  20          1HG       GLN  20   8.510  -1.222 -16.542
  162   1HE2  GLN  20          2HE2      GLN  20   8.390  -0.611 -20.028
  163   2HE2  GLN  20          1HE2      GLN  20   7.567  -1.194 -18.663
  164    H    LEU  21           H        LEU  21   8.633   3.557 -14.281
  165    HA   LEU  21           HA       LEU  21   7.267   5.408 -16.149
  166   1HB   LEU  21          2HB       LEU  21   7.170   4.937 -13.180
  167   2HB   LEU  21          1HB       LEU  21   6.595   6.465 -13.845
  168    HG   LEU  21           HG       LEU  21   4.951   5.361 -15.197
  169   1HD1  LEU  21          3HD1      LEU  21   6.588   2.928 -14.544
  170   2HD1  LEU  21          2HD1      LEU  21   4.879   2.739 -14.935
  171   3HD1  LEU  21          1HD1      LEU  21   5.975   3.472 -16.105
  172   1HD2  LEU  21          3HD2      LEU  21   5.181   4.514 -12.346
  173   2HD2  LEU  21          2HD2      LEU  21   3.921   5.461 -13.138
  174   3HD2  LEU  21          1HD2      LEU  21   3.959   3.709 -13.331
  175    H    LEU  22           H        LEU  22   9.775   5.399 -13.635
  176    HA   LEU  22           HA       LEU  22  10.408   8.197 -13.860
  177   1HB   LEU  22          2HB       LEU  22  12.206   5.914 -12.985
  178   2HB   LEU  22          1HB       LEU  22  12.471   7.626 -12.662
  179    HG   LEU  22           HG       LEU  22  10.319   5.822 -11.556
  180   1HD1  LEU  22          2HD1      LEU  22  12.740   7.129 -10.596
  181   2HD1  LEU  22          1HD1      LEU  22  11.338   7.546  -9.610
  182   3HD1  LEU  22          3HD1      LEU  22  11.784   5.854  -9.839
  183   1HD2  LEU  22          2HD2      LEU  22  10.303   8.800 -11.929
  184   2HD2  LEU  22          1HD2      LEU  22   8.979   7.646 -12.098
  185   3HD2  LEU  22          3HD2      LEU  22   9.550   8.103 -10.494
  186    H    SER  23           H        SER  23  11.827   5.272 -15.359
  187    HA   SER  23           HA       SER  23  13.457   7.036 -17.111
  188   1HB   SER  23          2HB       SER  23  14.899   5.358 -16.502
  189   2HB   SER  23          1HB       SER  23  13.599   4.195 -16.241
  190    HG   SER  23           HG       SER  23  15.142   4.527 -18.392
  191    H    PHE  24           H        PHE  24  11.471   7.754 -18.262
  192    HA   PHE  24           HA       PHE  24  11.028   6.154 -20.644
  193   1HB   PHE  24          2HB       PHE  24   9.389   5.488 -18.531
  194   2HB   PHE  24          1HB       PHE  24   8.422   6.686 -19.392
  195    HD1  PHE  24           HD1      PHE  24  10.125   3.416 -19.656
  196    HD2  PHE  24           HD2      PHE  24   7.587   6.266 -21.628
  197    HE1  PHE  24           HE1      PHE  24   9.566   1.725 -21.382
  198    HE2  PHE  24           HE2      PHE  24   7.028   4.574 -23.353
  199    HZ   PHE  24           HZ       PHE  24   8.018   2.304 -23.230
  200    H    GLY  25           H        GLY  25   8.892   8.442 -18.950
  201   1HA   GLY  25          2HA       GLY  25   9.606  10.883 -19.922
  202   2HA   GLY  25          1HA       GLY  25   8.850  10.151 -21.338
  203    H    ASN  26           H        ASN  26   7.068   8.608 -19.338
  204    HA   ASN  26           HA       ASN  26   4.836  10.409 -19.461
  205   1HB   ASN  26          2HB       ASN  26   5.131   7.979 -17.674
  206   2HB   ASN  26          1HB       ASN  26   3.626   8.712 -18.227
  207   1HD2  ASN  26          2HD2      ASN  26   4.656   5.781 -20.441
  208   2HD2  ASN  26          1HD2      ASN  26   4.552   5.930 -18.753
  209    HA   PRO  27           HA       PRO  27   5.797  12.696 -15.774
  210   1HB   PRO  27          2HB       PRO  27   3.499  14.205 -15.775
  211   2HB   PRO  27          1HB       PRO  27   4.884  14.530 -16.829
  212   1HG   PRO  27          2HG       PRO  27   2.237  13.323 -17.505
  213   2HG   PRO  27          1HG       PRO  27   3.357  14.219 -18.543
  214   1HD   PRO  27          2HD       PRO  27   3.030  11.399 -18.472
  215   2HD   PRO  27          1HD       PRO  27   4.345  12.280 -19.275
  216    H    ARG  28           H        ARG  28   4.488  13.267 -13.676
  217    HA   ARG  28           HA       ARG  28   3.734  11.011 -12.272
  218   1HB   ARG  28          2HB       ARG  28   2.362  13.690 -11.925
  219   2HB   ARG  28          1HB       ARG  28   2.620  12.454 -10.693
  220   1HG   ARG  28          2HG       ARG  28   4.467  13.686 -10.179
  221   2HG   ARG  28          1HG       ARG  28   5.177  12.863 -11.567
  222   1HD   ARG  28          2HD       ARG  28   3.937  14.865 -12.865
  223   2HD   ARG  28          1HD       ARG  28   4.204  15.668 -11.318
  224    HE   ARG  28           HE       ARG  28   6.669  14.574 -11.880
  225   1HH1  ARG  28          2HH1      ARG  28   4.541  16.949 -13.116
  226   2HH1  ARG  28          1HH1      ARG  28   5.677  17.581 -14.260
  227   1HH2  ARG  28          1HH2      ARG  28   8.100  15.200 -13.570
  228   2HH2  ARG  28          2HH2      ARG  28   7.692  16.591 -14.517
  229    H    GLY  29           H        GLY  29   1.481  10.372 -11.513
  230   1HA   GLY  29          2HA       GLY  29  -0.788   9.864 -11.948
  231   2HA   GLY  29          1HA       GLY  29  -0.743  10.983 -13.310
  232    H    THR  30           H        THR  30   1.807   8.676 -13.214
  233    HA   THR  30           HA       THR  30   0.629   7.327 -15.580
  234    HB   THR  30           HB       THR  30   3.332   6.658 -14.455
  235    HG1  THR  30           HG1      THR  30   2.764   8.912 -16.074
  236   1HG2  THR  30          1HG2      THR  30   2.061   6.826 -17.192
  237   2HG2  THR  30          3HG2      THR  30   3.799   6.627 -16.965
  238   3HG2  THR  30          2HG2      THR  30   2.686   5.395 -16.373
  239    H    PHE  31           H        PHE  31  -0.959   5.990 -14.559
  240    HA   PHE  31           HA       PHE  31   0.074   4.021 -12.590
  241   1HB   PHE  31          2HB       PHE  31  -2.806   4.109 -13.363
  242   2HB   PHE  31          1HB       PHE  31  -2.079   3.777 -11.794
  243    HD1  PHE  31           HD1      PHE  31  -2.865   6.476 -14.232
  244    HD2  PHE  31           HD2      PHE  31  -1.664   5.520 -10.221
  245    HE1  PHE  31           HE1      PHE  31  -3.219   8.837 -13.563
  246    HE2  PHE  31           HE2      PHE  31  -2.013   7.882  -9.553
  247    HZ   PHE  31           HZ       PHE  31  -2.793   9.541 -11.224
  248    H    LEU  32           H        LEU  32   0.903   2.229 -13.584
  249    HA   LEU  32           HA       LEU  32  -0.623   1.119 -15.901
  250   1HB   LEU  32          2HB       LEU  32   1.364   0.363 -16.852
  251   2HB   LEU  32          1HB       LEU  32   1.920   1.841 -16.073
  252    HG   LEU  32           HG       LEU  32   2.153  -0.977 -14.974
  253   1HD1  LEU  32          2HD1      LEU  32   4.036   0.985 -16.242
  254   2HD1  LEU  32          1HD1      LEU  32   4.650  -0.106 -14.998
  255   3HD1  LEU  32          3HD1      LEU  32   3.922  -0.760 -16.466
  256   1HD2  LEU  32          1HD2      LEU  32   2.687   1.734 -13.764
  257   2HD2  LEU  32          3HD2      LEU  32   1.777   0.387 -13.080
  258   3HD2  LEU  32          2HD2      LEU  32   3.534   0.294 -13.203
  259    H    ILE  33           H        ILE  33   0.092  -1.464 -15.934
  260    HA   ILE  33           HA       ILE  33  -0.432  -2.464 -13.166
  261    HB   ILE  33           HB       ILE  33  -1.842  -3.120 -15.737
  262   1HG1  ILE  33          2HG1      ILE  33  -2.630  -2.581 -12.873
  263   2HG1  ILE  33          1HG1      ILE  33  -2.969  -1.590 -14.291
  264   1HG2  ILE  33          1HG2      ILE  33  -0.944  -5.285 -14.915
  265   2HG2  ILE  33          3HG2      ILE  33  -1.697  -4.976 -13.349
  266   3HG2  ILE  33          2HG2      ILE  33  -2.701  -5.199 -14.779
  267   1HD1  ILE  33          1HD1      ILE  33  -3.996  -4.164 -14.865
  268   2HD1  ILE  33          3HD1      ILE  33  -4.500  -3.789 -13.218
  269   3HD1  ILE  33          2HD1      ILE  33  -4.915  -2.695 -14.537
  270    H    ARG  34           H        ARG  34   0.120  -4.900 -13.051
  271    HA   ARG  34           HA       ARG  34   1.915  -6.106 -14.915
  272   1HB   ARG  34          2HB       ARG  34   3.975  -5.830 -13.304
  273   2HB   ARG  34          1HB       ARG  34   3.610  -4.553 -14.465
  274   1HG   ARG  34          2HG       ARG  34   2.255  -3.418 -12.659
  275   2HG   ARG  34          1HG       ARG  34   2.877  -4.618 -11.525
  276   1HD   ARG  34          2HD       ARG  34   5.165  -3.734 -12.821
  277   2HD   ARG  34          1HD       ARG  34   4.204  -2.264 -12.659
  278    HE   ARG  34           HE       ARG  34   4.966  -2.324 -10.431
  279   1HH1  ARG  34          2HH1      ARG  34   4.989  -5.503 -11.645
  280   2HH1  ARG  34          1HH1      ARG  34   4.851  -6.261 -10.094
  281   1HH2  ARG  34          1HH2      ARG  34   4.424  -3.280  -8.378
  282   2HH2  ARG  34          2HH2      ARG  34   4.532  -5.003  -8.245
  283    H    GLU  35           H        GLU  35   2.831  -8.124 -14.010
  284    HA   GLU  35           HA       GLU  35   1.026  -9.262 -12.032
  285   1HB   GLU  35          2HB       GLU  35   1.830 -11.304 -12.725
  286   2HB   GLU  35          1HB       GLU  35   2.277 -10.347 -14.126
  287   1HG   GLU  35          2HG       GLU  35   4.552 -10.124 -13.330
  288   2HG   GLU  35          1HG       GLU  35   4.134 -10.866 -11.785
  289    H    SER  36           H        SER  36   1.376  -9.448  -9.856
  290    HA   SER  36           HA       SER  36   3.801  -8.303  -8.701
  291   1HB   SER  36          2HB       SER  36   1.433  -9.682  -7.397
  292   2HB   SER  36          1HB       SER  36   2.691  -8.789  -6.555
  293    HG   SER  36           HG       SER  36   1.415  -7.158  -6.871
  294    H    GLU  37           H        GLU  37   5.595  -9.504  -8.305
  295    HA   GLU  37           HA       GLU  37   5.421 -12.451  -8.400
  296   1HB   GLU  37          2HB       GLU  37   7.771 -10.583  -8.008
  297   2HB   GLU  37          1HB       GLU  37   7.890 -12.332  -8.175
  298   1HG   GLU  37          2HG       GLU  37   6.513 -11.924 -10.384
  299   2HG   GLU  37          1HG       GLU  37   7.135 -10.280 -10.236
  300    H    THR  38           H        THR  38   4.530 -10.431  -6.149
  301    HA   THR  38           HA       THR  38   6.121 -11.244  -3.855
  302    HB   THR  38           HB       THR  38   4.692  -9.086  -4.186
  303    HG1  THR  38           HG1      THR  38   4.371  -9.023  -1.925
  304   1HG2  THR  38          2HG2      THR  38   2.595 -11.022  -3.170
  305   2HG2  THR  38          1HG2      THR  38   2.408  -9.272  -3.257
  306   3HG2  THR  38          3HG2      THR  38   2.585 -10.214  -4.737
  307    H    THR  39           H        THR  39   2.949 -12.062  -5.189
  308    HA   THR  39           HA       THR  39   2.811 -14.328  -3.236
  309    HB   THR  39           HB       THR  39   0.885 -12.634  -3.502
  310    HG1  THR  39           HG1      THR  39   0.627 -14.628  -2.474
  311   1HG2  THR  39          3HG2      THR  39   1.173 -13.332  -6.181
  312   2HG2  THR  39          2HG2      THR  39  -0.276 -14.199  -5.670
  313   3HG2  THR  39          1HG2      THR  39  -0.180 -12.450  -5.476
  314    H    LYS  40           H        LYS  40   1.293 -16.161  -4.511
  315    HA   LYS  40           HA       LYS  40   2.982 -17.644  -6.113
  316   1HB   LYS  40          2HB       LYS  40   0.035 -17.523  -6.732
  317   2HB   LYS  40          1HB       LYS  40   1.103 -18.926  -6.767
  318   1HG   LYS  40          2HG       LYS  40   1.405 -18.487  -4.229
  319   2HG   LYS  40          1HG       LYS  40  -0.031 -17.475  -4.380
  320   1HD   LYS  40          2HD       LYS  40  -1.389 -19.278  -4.485
  321   2HD   LYS  40          1HD       LYS  40  -0.379 -20.046  -5.712
  322   1HE   LYS  40          2HE       LYS  40   1.245 -20.486  -3.688
  323   2HE   LYS  40          1HE       LYS  40  -0.209 -20.248  -2.718
  324   1HZ   LYS  40          1HZ       LYS  40  -0.032 -22.138  -4.999
  325   2HZ   LYS  40          3HZ       LYS  40   0.202 -22.587  -3.380
  326   3HZ   LYS  40          2HZ       LYS  40  -1.306 -21.989  -3.884
  327    H    GLY  41           H        GLY  41   0.861 -15.016  -7.054
  328   1HA   GLY  41          2HA       GLY  41   2.287 -13.929  -9.106
  329   2HA   GLY  41          1HA       GLY  41   1.467 -15.279  -9.899
  330    H    ALA  42           H        ALA  42   0.811 -12.491  -7.804
  331    HA   ALA  42           HA       ALA  42  -2.007 -12.388  -8.683
  332   1HB   ALA  42          2HB       ALA  42  -0.310 -10.992  -6.635
  333   2HB   ALA  42          1HB       ALA  42  -1.802 -10.223  -7.174
  334   3HB   ALA  42          3HB       ALA  42  -1.855 -11.817  -6.420
  335    H    TYR  43           H        TYR  43  -2.366  -9.614  -8.801
  336    HA   TYR  43           HA       TYR  43  -0.641  -8.932 -11.128
  337   1HB   TYR  43          2HB       TYR  43  -3.507  -8.964 -10.868
  338   2HB   TYR  43          1HB       TYR  43  -2.954  -7.319 -11.200
  339    HD1  TYR  43           HD1      TYR  43  -0.757  -7.382 -12.880
  340    HD2  TYR  43           HD2      TYR  43  -4.013 -10.193 -12.779
  341    HE1  TYR  43           HE1      TYR  43  -0.275  -8.046 -15.232
  342    HE2  TYR  43           HE2      TYR  43  -3.522 -10.857 -15.116
  343    HH   TYR  43           HH       TYR  43  -2.355  -9.635 -17.164
  344    H    SER  44           H        SER  44  -1.138  -6.256 -11.366
  345    HA   SER  44           HA       SER  44  -0.907  -4.995  -8.731
  346   1HB   SER  44          2HB       SER  44   1.316  -5.809  -8.873
  347   2HB   SER  44          1HB       SER  44   1.437  -5.338 -10.569
  348    HG   SER  44           HG       SER  44   2.314  -3.617  -9.717
  349    H    LEU  45           H        LEU  45  -0.430  -2.687  -8.925
  350    HA   LEU  45           HA       LEU  45  -1.008  -1.468 -11.564
  351   1HB   LEU  45          2HB       LEU  45  -3.225  -1.663 -10.552
  352   2HB   LEU  45          1HB       LEU  45  -2.634  -0.934  -9.057
  353    HG   LEU  45           HG       LEU  45  -2.081   1.136 -10.301
  354   1HD1  LEU  45          2HD1      LEU  45  -2.349  -0.593 -12.535
  355   2HD1  LEU  45          1HD1      LEU  45  -3.619   0.623 -12.678
  356   3HD1  LEU  45          3HD1      LEU  45  -1.932   1.120 -12.545
  357   1HD2  LEU  45          3HD2      LEU  45  -4.736   0.043  -9.887
  358   2HD2  LEU  45          2HD2      LEU  45  -4.153   1.686  -9.621
  359   3HD2  LEU  45          1HD2      LEU  45  -4.729   1.202 -11.216
  360    H    SER  46           H        SER  46   1.157  -0.721 -11.442
  361    HA   SER  46           HA       SER  46   2.097   0.792  -9.140
  362   1HB   SER  46          2HB       SER  46   3.565   1.243 -11.617
  363   2HB   SER  46          1HB       SER  46   4.120   0.545 -10.099
  364    HG   SER  46           HG       SER  46   3.342  -1.428 -10.717
  365    H    ILE  47           H        ILE  47   2.701   3.068  -9.236
  366    HA   ILE  47           HA       ILE  47   1.284   4.643 -11.321
  367    HB   ILE  47           HB       ILE  47   0.092   5.965  -9.790
  368   1HG1  ILE  47          2HG1      ILE  47   1.776   4.792  -7.551
  369   2HG1  ILE  47          1HG1      ILE  47   2.044   6.375  -8.282
  370   1HG2  ILE  47          3HG2      ILE  47  -0.678   3.549  -9.922
  371   2HG2  ILE  47          2HG2      ILE  47   0.147   3.282  -8.387
  372   3HG2  ILE  47          1HG2      ILE  47  -1.197   4.420  -8.479
  373   1HD1  ILE  47          2HD1      ILE  47  -0.632   5.603  -7.112
  374   2HD1  ILE  47          1HD1      ILE  47   0.642   6.310  -6.119
  375   3HD1  ILE  47          3HD1      ILE  47  -0.023   7.218  -7.477
  376    H    ARG  48           H        ARG  48   2.308   6.601 -11.815
  377    HA   ARG  48           HA       ARG  48   5.052   6.891 -10.746
  378   1HB   ARG  48          2HB       ARG  48   4.958   7.022 -13.130
  379   2HB   ARG  48          1HB       ARG  48   3.576   8.113 -13.087
  380   1HG   ARG  48          2HG       ARG  48   5.494   9.466 -13.577
  381   2HG   ARG  48          1HG       ARG  48   5.081   9.785 -11.895
  382   1HD   ARG  48          2HD       ARG  48   6.973   8.776 -11.103
  383   2HD   ARG  48          1HD       ARG  48   6.957   7.534 -12.355
  384    HE   ARG  48           HE       ARG  48   8.552   8.875 -13.439
  385   1HH1  ARG  48          2HH1      ARG  48   6.843  10.790 -11.197
  386   2HH1  ARG  48          1HH1      ARG  48   7.252  12.298 -11.943
  387   1HH2  ARG  48          1HH2      ARG  48   8.839  10.831 -14.654
  388   2HH2  ARG  48          2HH2      ARG  48   8.381  12.322 -13.900
  389    H    ASP  49           H        ASP  49   5.610   8.544  -9.362
  390    HA   ASP  49           HA       ASP  49   3.872  10.905  -9.147
  391   1HB   ASP  49          2HB       ASP  49   3.588   8.677  -7.369
  392   2HB   ASP  49          1HB       ASP  49   4.267  10.029  -6.464
  393    H    TRP  50           H        TRP  50   5.165  12.645  -8.786
  394    HA   TRP  50           HA       TRP  50   7.907  12.148  -7.702
  395   1HB   TRP  50          2HB       TRP  50   8.167  13.081  -9.861
  396   2HB   TRP  50          1HB       TRP  50   6.797  14.167  -9.649
  397    HD1  TRP  50           HD1      TRP  50  10.489  14.054  -9.316
  398    HE1  TRP  50           HE1      TRP  50  11.340  16.208  -8.174
  399    HE3  TRP  50           HE3      TRP  50   6.088  15.916  -7.691
  400    HZ2  TRP  50           HZ2      TRP  50  10.249  18.463  -6.770
  401    HZ3  TRP  50           HZ3      TRP  50   5.981  18.070  -6.454
  402    HH2  TRP  50           HH2      TRP  50   8.061  19.346  -5.995
  403    H    ASP  51           H        ASP  51   8.751  13.860  -6.251
  404    HA   ASP  51           HA       ASP  51   6.647  15.493  -4.924
  405   1HB   ASP  51          2HB       ASP  51   7.841  13.113  -3.835
  406   2HB   ASP  51          1HB       ASP  51   8.340  14.504  -2.873
  407    H    ASP  52           H        ASP  52   7.575  17.219  -3.568
  408    HA   ASP  52           HA       ASP  52  10.025  18.300  -4.774
  409   1HB   ASP  52          2HB       ASP  52   9.465  20.339  -3.672
  410   2HB   ASP  52          1HB       ASP  52   7.927  19.653  -4.189
  411    H    MET  53           H        MET  53  10.499  15.930  -3.207
  412    HA   MET  53           HA       MET  53  12.524  16.997  -1.446
  413   1HB   MET  53          2HB       MET  53  11.575  15.551   0.518
  414   2HB   MET  53          1HB       MET  53  10.921  17.164   0.242
  415   1HG   MET  53          2HG       MET  53   8.878  16.241   0.025
  416   2HG   MET  53          1HG       MET  53   9.443  15.421  -1.430
  417   1HE   MET  53          1HE       MET  53  10.476  13.592  -1.685
  418   2HE   MET  53          3HE       MET  53  10.853  12.280  -0.560
  419   3HE   MET  53          2HE       MET  53   9.254  12.384  -1.291
  420    H    LYS  54           H        LYS  54  12.361  15.196  -3.767
  421    HA   LYS  54           HA       LYS  54  14.260  13.263  -3.001
  422   1HB   LYS  54          2HB       LYS  54  12.983  11.205  -2.947
  423   2HB   LYS  54          1HB       LYS  54  12.288  12.306  -1.759
  424   1HG   LYS  54          2HG       LYS  54  10.595  13.007  -3.453
  425   2HG   LYS  54          1HG       LYS  54  11.259  11.814  -4.569
  426   1HD   LYS  54          2HD       LYS  54  10.584  10.787  -1.873
  427   2HD   LYS  54          1HD       LYS  54   9.209  11.290  -2.856
  428   1HE   LYS  54          2HE       LYS  54   9.360   9.331  -3.959
  429   2HE   LYS  54          1HE       LYS  54  10.915   9.866  -4.595
  430   1HZ   LYS  54          1HZ       LYS  54  10.947   8.864  -1.874
  431   2HZ   LYS  54          3HZ       LYS  54  10.605   7.708  -3.067
  432   3HZ   LYS  54          2HZ       LYS  54  12.046   8.604  -3.144
  433    H    GLY  55           H        GLY  55  11.735  14.253  -5.219
  434   1HA   GLY  55          2HA       GLY  55  12.348  14.546  -7.575
  435   2HA   GLY  55          1HA       GLY  55  13.329  13.096  -7.416
  436    H    ASP  56           H        ASP  56  11.997  12.319  -9.304
  437    HA   ASP  56           HA       ASP  56   9.169  11.884  -8.943
  438   1HB   ASP  56          2HB       ASP  56  10.829  10.183 -10.781
  439   2HB   ASP  56          1HB       ASP  56   9.232  10.878 -11.042
  440    H    HIS  57           H        HIS  57   8.239   9.600  -8.912
  441    HA   HIS  57           HA       HIS  57   9.914   7.511  -7.740
  442   1HB   HIS  57          2HB       HIS  57   8.919   9.241  -5.913
  443   2HB   HIS  57          1HB       HIS  57   7.551   8.143  -6.051
  444    HD1  HIS  57           HD1      HIS  57   7.726   6.477  -4.206
  445    HD2  HIS  57           HD2      HIS  57  11.454   7.299  -5.880
  446    HE1  HIS  57           HE1      HIS  57   9.383   4.952  -3.046
  447    H    VAL  58           H        VAL  58   7.926   5.883  -6.779
  448    HA   VAL  58           HA       VAL  58   5.685   5.797  -8.631
  449    HB   VAL  58           HB       VAL  58   8.179   4.296  -9.131
  450   1HG1  VAL  58          3HG1      VAL  58   5.461   2.965  -9.166
  451   2HG1  VAL  58          2HG1      VAL  58   6.761   2.433 -10.233
  452   3HG1  VAL  58          1HG1      VAL  58   6.967   2.349  -8.483
  453   1HG2  VAL  58          1HG2      VAL  58   5.792   5.214 -10.721
  454   2HG2  VAL  58          3HG2      VAL  58   7.427   5.871 -10.745
  455   3HG2  VAL  58          2HG2      VAL  58   7.106   4.277 -11.434
  456    H    LYS  59           H        LYS  59   4.066   5.050  -7.388
  457    HA   LYS  59           HA       LYS  59   4.693   3.306  -5.064
  458   1HB   LYS  59          2HB       LYS  59   3.052   5.460  -5.227
  459   2HB   LYS  59          1HB       LYS  59   1.901   4.175  -5.595
  460   1HG   LYS  59          2HG       LYS  59   1.777   4.201  -3.274
  461   2HG   LYS  59          1HG       LYS  59   3.045   2.999  -3.514
  462   1HD   LYS  59          2HD       LYS  59   4.670   4.364  -2.679
  463   2HD   LYS  59          1HD       LYS  59   3.978   5.805  -3.422
  464   1HE   LYS  59          2HE       LYS  59   2.089   5.018  -1.509
  465   2HE   LYS  59          1HE       LYS  59   3.648   4.795  -0.714
  466   1HZ   LYS  59          1HZ       LYS  59   3.026   7.261  -2.217
  467   2HZ   LYS  59          3HZ       LYS  59   2.571   7.084  -0.593
  468   3HZ   LYS  59          2HZ       LYS  59   4.213   7.014  -1.027
  469    H    HIS  60           H        HIS  60   2.422   1.783  -4.817
  470    HA   HIS  60           HA       HIS  60   1.755   0.609  -7.411
  471   1HB   HIS  60          2HB       HIS  60   3.103  -1.219  -5.445
  472   2HB   HIS  60          1HB       HIS  60   2.752  -1.508  -7.144
  473    HD1  HIS  60           HD1      HIS  60   4.477  -0.793  -8.839
  474    HD2  HIS  60           HD2      HIS  60   5.293   0.696  -5.031
  475    HE1  HIS  60           HE1      HIS  60   6.782   0.248  -8.957
  476    H    TYR  61           H        TYR  61   0.060  -0.855  -7.333
  477    HA   TYR  61           HA       TYR  61  -1.272  -1.197  -4.681
  478   1HB   TYR  61          2HB       TYR  61  -2.449  -0.273  -7.306
  479   2HB   TYR  61          1HB       TYR  61  -3.454  -1.047  -6.082
  480    HD1  TYR  61           HD1      TYR  61  -3.574  -0.057  -3.766
  481    HD2  TYR  61           HD2      TYR  61  -1.723   1.985  -7.061
  482    HE1  TYR  61           HE1      TYR  61  -3.708   2.082  -2.516
  483    HE2  TYR  61           HE2      TYR  61  -1.859   4.123  -5.813
  484    HH   TYR  61           HH       TYR  61  -3.316   4.261  -2.557
  485    H    LYS  62           H        LYS  62  -0.611  -3.341  -4.487
  486    HA   LYS  62           HA       LYS  62  -0.476  -5.272  -6.534
  487   1HB   LYS  62          2HB       LYS  62   0.460  -5.551  -4.248
  488   2HB   LYS  62          1HB       LYS  62  -1.175  -5.744  -3.622
  489   1HG   LYS  62          2HG       LYS  62  -0.253  -7.478  -5.893
  490   2HG   LYS  62          1HG       LYS  62   0.246  -7.871  -4.248
  491   1HD   LYS  62          2HD       LYS  62  -2.342  -7.492  -3.751
  492   2HD   LYS  62          1HD       LYS  62  -2.490  -7.895  -5.462
  493   1HE   LYS  62          2HE       LYS  62  -2.345 -10.069  -4.880
  494   2HE   LYS  62          1HE       LYS  62  -0.672  -9.769  -4.412
  495   1HZ   LYS  62          2HZ       LYS  62  -1.439  -9.136  -2.209
  496   2HZ   LYS  62          1HZ       LYS  62  -3.048  -9.440  -2.661
  497   3HZ   LYS  62          3HZ       LYS  62  -1.934 -10.716  -2.588
  498    H    ILE  63           H        ILE  63  -2.081  -5.974  -7.819
  499    HA   ILE  63           HA       ILE  63  -4.886  -5.870  -6.850
  500    HB   ILE  63           HB       ILE  63  -3.620  -6.303  -9.561
  501   1HG1  ILE  63          2HG1      ILE  63  -5.679  -4.342  -9.524
  502   2HG1  ILE  63          1HG1      ILE  63  -4.681  -4.059  -8.097
  503   1HG2  ILE  63          2HG2      ILE  63  -6.520  -6.607  -8.729
  504   2HG2  ILE  63          1HG2      ILE  63  -6.002  -6.410 -10.403
  505   3HG2  ILE  63          3HG2      ILE  63  -5.493  -7.827  -9.483
  506   1HD1  ILE  63          1HD1      ILE  63  -3.041  -4.681 -10.406
  507   2HD1  ILE  63          3HD1      ILE  63  -4.092  -3.305 -10.735
  508   3HD1  ILE  63          2HD1      ILE  63  -2.992  -3.266  -9.356
  509    H    ARG  64           H        ARG  64  -6.270  -7.802  -7.293
  510    HA   ARG  64           HA       ARG  64  -4.916 -10.355  -7.729
  511   1HB   ARG  64          2HB       ARG  64  -6.388 -10.803  -5.331
  512   2HB   ARG  64          1HB       ARG  64  -4.668 -11.033  -5.608
  513   1HG   ARG  64          2HG       ARG  64  -4.164  -9.251  -4.332
  514   2HG   ARG  64          1HG       ARG  64  -5.263  -8.213  -5.233
  515   1HD   ARG  64          2HD       ARG  64  -6.718  -8.262  -3.542
  516   2HD   ARG  64          1HD       ARG  64  -6.836 -10.016  -3.699
  517    HE   ARG  64           HE       ARG  64  -4.690  -8.738  -2.049
  518   1HH1  ARG  64          1HH1      ARG  64  -5.789 -12.281  -1.143
  519   2HH1  ARG  64          2HH1      ARG  64  -5.116 -11.770  -2.656
  520   1HH2  ARG  64          1HH2      ARG  64  -6.467  -9.061  -0.053
  521   2HH2  ARG  64          2HH2      ARG  64  -6.553 -10.748   0.330
  522    H    LYS  65           H        LYS  65  -6.905 -12.036  -6.800
  523    HA   LYS  65           HA       LYS  65  -9.401 -10.994  -8.016
  524   1HB   LYS  65          2HB       LYS  65  -8.629 -12.106  -9.911
  525   2HB   LYS  65          1HB       LYS  65  -7.750 -13.306  -8.970
  526   1HG   LYS  65          2HG       LYS  65 -10.023 -14.236  -8.246
  527   2HG   LYS  65          1HG       LYS  65 -10.746 -13.182  -9.455
  528   1HD   LYS  65          2HD       LYS  65 -10.300 -14.721 -11.029
  529   2HD   LYS  65          1HD       LYS  65  -8.577 -14.512 -10.716
  530   1HE   LYS  65          2HE       LYS  65 -10.055 -16.162  -8.741
  531   2HE   LYS  65          1HE       LYS  65  -9.878 -16.865 -10.349
  532   1HZ   LYS  65          2HZ       LYS  65  -7.463 -16.291 -10.172
  533   2HZ   LYS  65          1HZ       LYS  65  -7.731 -15.934  -8.533
  534   3HZ   LYS  65          3HZ       LYS  65  -7.994 -17.507  -9.111
  535    H    LEU  66           H        LEU  66 -11.077 -11.422  -6.688
  536    HA   LEU  66           HA       LEU  66 -10.734 -13.369  -4.515
  537   1HB   LEU  66          2HB       LEU  66 -13.008 -11.546  -5.343
  538   2HB   LEU  66          1HB       LEU  66 -13.181 -12.732  -4.055
  539    HG   LEU  66           HG       LEU  66 -12.471 -11.075  -2.696
  540   1HD1  LEU  66          2HD1      LEU  66 -10.431 -12.536  -2.841
  541   2HD1  LEU  66          1HD1      LEU  66  -9.783 -11.430  -4.053
  542   3HD1  LEU  66          3HD1      LEU  66 -10.072 -10.865  -2.408
  543   1HD2  LEU  66          3HD2      LEU  66 -11.505  -9.806  -5.247
  544   2HD2  LEU  66          2HD2      LEU  66 -12.821  -9.294  -4.190
  545   3HD2  LEU  66          1HD2      LEU  66 -11.147  -9.088  -3.676
  546    H    ASP  67           H        ASP  67 -11.507 -15.447  -4.598
  547    HA   ASP  67           HA       ASP  67 -12.523 -16.482  -7.112
  548   1HB   ASP  67          2HB       ASP  67 -11.724 -17.528  -4.503
  549   2HB   ASP  67          1HB       ASP  67 -13.130 -18.362  -5.156
  550    H    ASN  68           H        ASN  68 -13.857 -14.973  -4.379
  551    HA   ASN  68           HA       ASN  68 -16.554 -16.080  -4.645
  552   1HB   ASN  68          2HB       ASN  68 -15.567 -13.665  -3.106
  553   2HB   ASN  68          1HB       ASN  68 -17.098 -14.513  -2.863
  554   1HD2  ASN  68          2HD2      ASN  68 -13.910 -15.790  -0.847
  555   2HD2  ASN  68          1HD2      ASN  68 -14.041 -14.257  -1.563
  556    H    GLY  69           H        GLY  69 -14.710 -13.786  -6.314
  557   1HA   GLY  69          2HA       GLY  69 -17.176 -12.708  -7.478
  558   2HA   GLY  69          1HA       GLY  69 -16.129 -11.530  -6.704
  559    H    GLY  70           H        GLY  70 -14.124 -11.041  -7.672
  560   1HA   GLY  70          2HA       GLY  70 -13.304 -12.389 -10.121
  561   2HA   GLY  70          1HA       GLY  70 -13.992 -10.805 -10.397
  562    H    TYR  71           H        TYR  71 -12.662  -9.081 -10.225
  563    HA   TYR  71           HA       TYR  71 -10.004  -9.590  -8.944
  564   1HB   TYR  71          2HB       TYR  71 -10.772  -7.895 -11.312
  565   2HB   TYR  71          1HB       TYR  71  -9.234  -7.692 -10.470
  566    HD1  TYR  71           HD1      TYR  71 -11.398 -10.336 -11.985
  567    HD2  TYR  71           HD2      TYR  71  -7.413  -9.040 -11.053
  568    HE1  TYR  71           HE1      TYR  71 -10.478 -12.263 -13.250
  569    HE2  TYR  71           HE2      TYR  71  -6.488 -10.967 -12.312
  570    HH   TYR  71           HH       TYR  71  -8.238 -12.770 -14.461
  571    H    TYR  72           H        TYR  72  -8.961  -7.506  -8.153
  572    HA   TYR  72           HA       TYR  72 -10.439  -5.165  -7.547
  573   1HB   TYR  72          2HB       TYR  72 -11.336  -5.520  -5.383
  574   2HB   TYR  72          1HB       TYR  72 -11.820  -6.951  -6.283
  575    HD1  TYR  72           HD1      TYR  72  -9.621  -8.716  -6.364
  576    HD2  TYR  72           HD2      TYR  72 -10.744  -6.050  -3.189
  577    HE1  TYR  72           HE1      TYR  72  -8.419 -10.140  -4.738
  578    HE2  TYR  72           HE2      TYR  72  -9.536  -7.467  -1.566
  579    HH   TYR  72           HH       TYR  72  -8.689  -9.634  -1.294
  580    H    ILE  73           H        ILE  73  -9.082  -3.709  -6.444
  581    HA   ILE  73           HA       ILE  73  -6.429  -4.801  -5.632
  582    HB   ILE  73           HB       ILE  73  -6.972  -1.852  -5.672
  583   1HG1  ILE  73          2HG1      ILE  73  -6.680  -3.576  -8.153
  584   2HG1  ILE  73          1HG1      ILE  73  -8.050  -2.545  -7.743
  585   1HG2  ILE  73          3HG2      ILE  73  -4.702  -3.743  -6.015
  586   2HG2  ILE  73          2HG2      ILE  73  -4.621  -2.239  -6.932
  587   3HG2  ILE  73          1HG2      ILE  73  -4.761  -2.193  -5.175
  588   1HD1  ILE  73          3HD1      ILE  73  -5.227  -1.508  -8.137
  589   2HD1  ILE  73          2HD1      ILE  73  -6.452  -1.518  -9.406
  590   3HD1  ILE  73          1HD1      ILE  73  -6.697  -0.550  -7.953
  591    H    THR  74           H        THR  74  -9.350  -3.324  -4.579
  592    HA   THR  74           HA       THR  74  -8.494  -3.635  -1.758
  593    HB   THR  74           HB       THR  74  -8.471  -1.359  -1.601
  594    HG1  THR  74           HG1      THR  74 -10.258  -0.919  -0.630
  595   1HG2  THR  74          2HG2      THR  74 -10.158  -1.366  -4.110
  596   2HG2  THR  74          1HG2      THR  74  -9.736   0.113  -3.246
  597   3HG2  THR  74          3HG2      THR  74  -8.467  -0.891  -3.950
  598    H    THR  75           H        THR  75 -10.285  -4.209  -0.388
  599    HA   THR  75           HA       THR  75 -12.256  -5.826  -1.723
  600    HB   THR  75           HB       THR  75 -13.259  -5.808   0.714
  601    HG1  THR  75           HG1      THR  75 -11.804  -5.118   2.219
  602   1HG2  THR  75          3HG2      THR  75 -11.194  -7.217  -0.661
  603   2HG2  THR  75          2HG2      THR  75 -10.715  -7.058   1.031
  604   3HG2  THR  75          1HG2      THR  75 -12.254  -7.813   0.617
  605    H    ARG  76           H        ARG  76 -12.226  -2.559  -1.650
  606    HA   ARG  76           HA       ARG  76 -15.126  -2.265  -1.135
  607   1HB   ARG  76          2HB       ARG  76 -12.819  -0.539  -0.917
  608   2HB   ARG  76          1HB       ARG  76 -14.021   0.196  -1.977
  609   1HG   ARG  76          2HG       ARG  76 -15.736  -0.445  -0.149
  610   2HG   ARG  76          1HG       ARG  76 -14.334  -0.677   0.896
  611   1HD   ARG  76          2HD       ARG  76 -15.180   1.605   1.155
  612   2HD   ARG  76          1HD       ARG  76 -13.601   1.648   0.369
  613    HE   ARG  76           HE       ARG  76 -15.583   1.554  -1.664
  614   1HH1  ARG  76          2HH1      ARG  76 -15.680   3.515   1.046
  615   2HH1  ARG  76          1HH1      ARG  76 -15.581   5.016   0.187
  616   1HH2  ARG  76          1HH2      ARG  76 -14.914   3.527  -2.872
  617   2HH2  ARG  76          2HH2      ARG  76 -15.147   5.023  -2.030
  618    H    ALA  77           H        ALA  77 -13.132  -3.050  -3.721
  619    HA   ALA  77           HA       ALA  77 -15.298  -2.418  -5.608
  620   1HB   ALA  77          2HB       ALA  77 -14.047  -0.304  -5.557
  621   2HB   ALA  77          1HB       ALA  77 -12.561  -1.169  -5.947
  622   3HB   ALA  77          3HB       ALA  77 -13.873  -1.095  -7.124
  623    H    GLN  78           H        GLN  78 -15.443  -4.480  -6.415
  624    HA   GLN  78           HA       GLN  78 -12.985  -5.707  -7.527
  625   1HB   GLN  78          2HB       GLN  78 -15.495  -7.109  -6.570
  626   2HB   GLN  78          1HB       GLN  78 -14.006  -7.866  -7.118
  627   1HG   GLN  78          2HG       GLN  78 -13.079  -7.667  -5.069
  628   2HG   GLN  78          1HG       GLN  78 -13.449  -5.945  -5.026
  629   1HE2  GLN  78          2HE2      GLN  78 -15.472  -7.120  -2.261
  630   2HE2  GLN  78          1HE2      GLN  78 -13.896  -6.606  -2.623
  631    H    PHE  79           H        PHE  79 -13.667  -7.292  -9.428
  632    HA   PHE  79           HA       PHE  79 -16.086  -6.441 -10.870
  633   1HB   PHE  79          2HB       PHE  79 -13.282  -5.872 -11.864
  634   2HB   PHE  79          1HB       PHE  79 -14.694  -5.897 -12.925
  635    HD1  PHE  79           HD1      PHE  79 -13.173  -4.255  -9.978
  636    HD2  PHE  79           HD2      PHE  79 -16.308  -4.124 -12.902
  637    HE1  PHE  79           HE1      PHE  79 -13.768  -1.982  -9.228
  638    HE2  PHE  79           HE2      PHE  79 -16.910  -1.835 -12.153
  639    HZ   PHE  79           HZ       PHE  79 -15.636  -0.761 -10.311
  640    H    GLU  80           H        GLU  80 -15.348  -7.568 -13.344
  641    HA   GLU  80           HA       GLU  80 -15.185 -10.397 -12.484
  642   1HB   GLU  80          2HB       GLU  80 -16.026 -10.857 -14.805
  643   2HB   GLU  80          1HB       GLU  80 -17.102  -9.838 -13.851
  644   1HG   GLU  80          2HG       GLU  80 -15.248  -8.112 -15.135
  645   2HG   GLU  80          1HG       GLU  80 -15.842  -9.236 -16.357
  646    H    THR  81           H        THR  81 -13.446  -8.037 -14.448
  647    HA   THR  81           HA       THR  81 -11.230 -10.003 -14.631
  648    HB   THR  81           HB       THR  81 -11.842 -10.462 -16.789
  649    HG1  THR  81           HG1      THR  81 -11.185  -7.984 -17.745
  650   1HG2  THR  81          2HG2      THR  81 -13.969  -9.068 -16.387
  651   2HG2  THR  81          1HG2      THR  81 -13.085  -7.761 -17.175
  652   3HG2  THR  81          3HG2      THR  81 -13.419  -9.252 -18.049
  653    H    LEU  82           H        LEU  82  -9.328  -8.744 -15.867
  654    HA   LEU  82           HA       LEU  82  -8.786  -6.414 -14.212
  655   1HB   LEU  82          2HB       LEU  82  -7.259  -7.972 -16.276
  656   2HB   LEU  82          1HB       LEU  82  -6.689  -6.371 -15.808
  657    HG   LEU  82           HG       LEU  82  -7.154  -8.740 -13.974
  658   1HD1  LEU  82          1HD1      LEU  82  -4.797  -7.448 -15.243
  659   2HD1  LEU  82          3HD1      LEU  82  -4.621  -7.902 -13.547
  660   3HD1  LEU  82          2HD1      LEU  82  -5.036  -9.125 -14.748
  661   1HD2  LEU  82          2HD2      LEU  82  -6.580  -5.830 -13.418
  662   2HD2  LEU  82          1HD2      LEU  82  -7.808  -6.864 -12.686
  663   3HD2  LEU  82          3HD2      LEU  82  -6.107  -7.092 -12.280
  664    H    GLN  83           H        GLN  83  -9.600  -7.065 -17.574
  665    HA   GLN  83           HA       GLN  83  -9.226  -4.333 -18.432
  666   1HB   GLN  83          2HB       GLN  83  -9.317  -6.482 -19.887
  667   2HB   GLN  83          1HB       GLN  83 -11.069  -6.302 -19.777
  668   1HG   GLN  83          2HG       GLN  83  -9.504  -3.871 -20.501
  669   2HG   GLN  83          1HG       GLN  83  -9.633  -5.133 -21.725
  670   1HE2  GLN  83          2HE2      GLN  83 -12.792  -3.856 -22.619
  671   2HE2  GLN  83          1HE2      GLN  83 -11.250  -4.354 -23.124
  672    H    GLN  84           H        GLN  84 -11.976  -6.271 -17.342
  673    HA   GLN  84           HA       GLN  84 -14.005  -4.326 -17.817
  674   1HB   GLN  84          2HB       GLN  84 -13.741  -6.664 -15.955
  675   2HB   GLN  84          1HB       GLN  84 -15.100  -5.564 -15.782
  676   1HG   GLN  84          2HG       GLN  84 -15.358  -7.654 -17.339
  677   2HG   GLN  84          1HG       GLN  84 -15.989  -6.105 -17.865
  678   1HE2  GLN  84          2HE2      GLN  84 -13.588  -7.896 -20.368
  679   2HE2  GLN  84          1HE2      GLN  84 -14.641  -8.624 -19.254
  680    H    LEU  85           H        LEU  85 -11.736  -4.771 -15.148
  681    HA   LEU  85           HA       LEU  85 -13.027  -2.681 -13.561
  682   1HB   LEU  85          2HB       LEU  85 -11.609  -3.263 -11.875
  683   2HB   LEU  85          1HB       LEU  85 -11.408  -4.715 -12.844
  684    HG   LEU  85           HG       LEU  85  -9.546  -2.971 -13.932
  685   1HD1  LEU  85          2HD1      LEU  85  -9.886  -2.503 -10.985
  686   2HD1  LEU  85          1HD1      LEU  85  -8.286  -2.399 -11.720
  687   3HD1  LEU  85          3HD1      LEU  85  -9.577  -1.326 -12.262
  688   1HD2  LEU  85          1HD2      LEU  85  -9.674  -5.472 -12.741
  689   2HD2  LEU  85          3HD2      LEU  85  -8.272  -4.759 -13.538
  690   3HD2  LEU  85          2HD2      LEU  85  -8.471  -4.597 -11.793
  691    H    VAL  86           H        VAL  86 -10.182  -2.826 -15.725
  692    HA   VAL  86           HA       VAL  86  -9.322  -0.192 -15.221
  693    HB   VAL  86           HB       VAL  86  -8.231  -0.233 -17.339
  694   1HG1  VAL  86          3HG1      VAL  86  -8.323  -2.594 -15.690
  695   2HG1  VAL  86          2HG1      VAL  86  -8.044  -3.057 -17.370
  696   3HG1  VAL  86          1HG1      VAL  86  -6.958  -1.919 -16.574
  697   1HG2  VAL  86          1HG2      VAL  86 -10.684  -1.446 -18.179
  698   2HG2  VAL  86          3HG2      VAL  86  -9.379  -0.815 -19.179
  699   3HG2  VAL  86          2HG2      VAL  86  -9.353  -2.496 -18.654
  700    H    GLN  87           H        GLN  87 -12.126  -1.457 -16.704
  701    HA   GLN  87           HA       GLN  87 -12.941   0.906 -18.137
  702   1HB   GLN  87          2HB       GLN  87 -13.706  -1.449 -18.599
  703   2HB   GLN  87          1HB       GLN  87 -14.669  -1.352 -17.133
  704   1HG   GLN  87          2HG       GLN  87 -16.035   0.363 -17.990
  705   2HG   GLN  87          1HG       GLN  87 -14.901   0.740 -19.288
  706   1HE2  GLN  87          1HE2      GLN  87 -15.683  -2.611 -18.468
  707   2HE2  GLN  87          2HE2      GLN  87 -16.571  -2.939 -19.877
  708    H    HIS  88           H        HIS  88 -13.875  -0.553 -15.042
  709    HA   HIS  88           HA       HIS  88 -15.780   1.494 -14.404
  710   1HB   HIS  88          2HB       HIS  88 -15.543  -0.933 -13.483
  711   2HB   HIS  88          1HB       HIS  88 -14.413  -0.206 -12.348
  712    HD1  HIS  88           HD1      HIS  88 -15.370   1.514 -10.633
  713    HD2  HIS  88           HD2      HIS  88 -18.265  -0.201 -13.095
  714    HE1  HIS  88           HE1      HIS  88 -17.614   2.098  -9.614
  715    H    TYR  89           H        TYR  89 -12.453   0.846 -13.430
  716    HA   TYR  89           HA       TYR  89 -12.284   3.086 -11.669
  717   1HB   TYR  89          2HB       TYR  89 -10.197   1.415 -13.045
  718   2HB   TYR  89          1HB       TYR  89  -9.791   2.695 -11.910
  719    HD1  TYR  89           HD1      TYR  89 -11.771  -0.436 -12.256
  720    HD2  TYR  89           HD2      TYR  89  -9.795   2.262  -9.575
  721    HE1  TYR  89           HE1      TYR  89 -12.108  -2.037 -10.423
  722    HE2  TYR  89           HE2      TYR  89 -10.134   0.652  -7.717
  723    HH   TYR  89           HH       TYR  89 -10.835  -2.488  -8.113
  724    H    SER  90           H        SER  90 -11.920   2.655 -15.081
  725    HA   SER  90           HA       SER  90 -10.341   4.860 -15.809
  726   1HB   SER  90          2HB       SER  90 -12.102   3.027 -17.110
  727   2HB   SER  90          1HB       SER  90 -12.521   4.655 -17.641
  728    HG   SER  90           HG       SER  90 -10.043   4.793 -17.772
  729    H    GLU  91           H        GLU  91 -13.494   4.667 -14.488
  730    HA   GLU  91           HA       GLU  91 -13.889   7.595 -14.949
  731   1HB   GLU  91          2HB       GLU  91 -16.037   5.626 -14.132
  732   2HB   GLU  91          1HB       GLU  91 -16.243   7.243 -14.807
  733   1HG   GLU  91          2HG       GLU  91 -14.859   6.200 -16.825
  734   2HG   GLU  91          1HG       GLU  91 -15.506   4.689 -16.186
  735    H    ARG  92           H        ARG  92 -13.200   5.148 -12.664
  736    HA   ARG  92           HA       ARG  92 -13.530   7.177 -10.492
  737   1HB   ARG  92          2HB       ARG  92 -14.327   4.323  -9.982
  738   2HB   ARG  92          1HB       ARG  92 -14.770   5.775  -9.085
  739   1HG   ARG  92          2HG       ARG  92 -15.947   6.512 -11.278
  740   2HG   ARG  92          1HG       ARG  92 -15.814   4.817 -11.747
  741   1HD   ARG  92          2HD       ARG  92 -17.106   4.105  -9.855
  742   2HD   ARG  92          1HD       ARG  92 -17.025   5.705  -9.118
  743    HE   ARG  92           HE       ARG  92 -18.754   4.934 -11.393
  744   1HH1  ARG  92          2HH1      ARG  92 -17.134   7.549  -9.912
  745   2HH1  ARG  92          1HH1      ARG  92 -18.492   8.622  -9.980
  746   1HH2  ARG  92          1HH2      ARG  92 -20.664   6.221 -11.222
  747   2HH2  ARG  92          2HH2      ARG  92 -20.491   7.870 -10.722
  748    H    ALA  93           H        ALA  93 -12.208   6.692  -8.582
  749    HA   ALA  93           HA       ALA  93  -9.739   5.245  -9.336
  750   1HB   ALA  93          2HB       ALA  93  -9.671   7.536  -8.253
  751   2HB   ALA  93          1HB       ALA  93 -10.304   6.789  -6.787
  752   3HB   ALA  93          3HB       ALA  93  -8.726   6.307  -7.412
  753    H    ALA  94           H        ALA  94 -12.236   5.237  -6.830
  754    HA   ALA  94           HA       ALA  94 -13.187   3.282  -5.833
  755   1HB   ALA  94          3HB       ALA  94 -11.872   1.897  -7.550
  756   2HB   ALA  94          2HB       ALA  94 -10.587   1.832  -6.342
  757   3HB   ALA  94          1HB       ALA  94 -12.170   1.141  -5.984
  758    H    GLY  95           H        GLY  95 -10.197   4.849  -5.258
  759   1HA   GLY  95          2HA       GLY  95 -10.311   5.521  -2.709
  760   2HA   GLY  95          1HA       GLY  95 -10.083   3.790  -2.486
  761    H    LEU  96           H        LEU  96  -8.320   3.799  -5.002
  762    HA   LEU  96           HA       LEU  96  -5.846   4.314  -3.556
  763   1HB   LEU  96          2HB       LEU  96  -4.748   3.251  -5.351
  764   2HB   LEU  96          1HB       LEU  96  -6.295   2.416  -5.242
  765    HG   LEU  96           HG       LEU  96  -5.572   4.625  -7.174
  766   1HD1  LEU  96          3HD1      LEU  96  -6.078   1.660  -7.451
  767   2HD1  LEU  96          2HD1      LEU  96  -6.060   2.760  -8.831
  768   3HD1  LEU  96          1HD1      LEU  96  -4.603   2.539  -7.860
  769   1HD2  LEU  96          1HD2      LEU  96  -8.162   3.134  -6.745
  770   2HD2  LEU  96          3HD2      LEU  96  -7.896   4.868  -6.559
  771   3HD2  LEU  96          2HD2      LEU  96  -7.819   4.132  -8.160
  772    H    SER  97           H        SER  97  -4.083   5.597  -4.658
  773    HA   SER  97           HA       SER  97  -4.557   8.284  -4.753
  774   1HB   SER  97          2HB       SER  97  -2.432   6.583  -5.560
  775   2HB   SER  97          1HB       SER  97  -2.686   7.750  -6.858
  776    HG   SER  97           HG       SER  97  -1.264   8.378  -5.041
  777    H    SER  98           H        SER  98  -4.718   6.163  -7.617
  778    HA   SER  98           HA       SER  98  -6.722   7.990  -8.781
  779   1HB   SER  98          2HB       SER  98  -4.070   8.402  -9.426
  780   2HB   SER  98          1HB       SER  98  -4.624   7.358 -10.734
  781    HG   SER  98           HG       SER  98  -4.978   9.602 -11.134
  782    H    ARG  99           H        ARG  99  -7.310   7.062 -11.087
  783    HA   ARG  99           HA       ARG  99  -8.030   4.272 -10.656
  784   1HB   ARG  99          2HB       ARG  99  -9.227   4.486 -12.779
  785   2HB   ARG  99          1HB       ARG  99  -9.560   5.886 -11.759
  786   1HG   ARG  99          2HG       ARG  99  -7.228   6.522 -13.226
  787   2HG   ARG  99          1HG       ARG  99  -8.352   5.804 -14.381
  788   1HD   ARG  99          2HD       ARG  99  -9.944   7.466 -14.074
  789   2HD   ARG  99          1HD       ARG  99  -9.401   7.826 -12.435
  790    HE   ARG  99           HE       ARG  99  -7.264   8.688 -13.819
  791   1HH1  ARG  99          2HH1      ARG  99 -10.148  10.061 -13.194
  792   2HH1  ARG  99          1HH1      ARG  99 -10.217  11.088 -14.587
  793   1HH2  ARG  99          1HH2      ARG  99  -7.548   9.550 -16.179
  794   2HH2  ARG  99          2HH2      ARG  99  -8.744  10.799 -16.277
  795    H    LEU 100           H        LEU 100  -7.751   3.928 -13.748
  796    HA   LEU 100           HA       LEU 100  -5.332   2.375 -13.626
  797   1HB   LEU 100          2HB       LEU 100  -6.427   3.241 -16.277
  798   2HB   LEU 100          1HB       LEU 100  -5.796   1.674 -15.791
  799    HG   LEU 100           HG       LEU 100  -8.045   1.162 -15.895
  800   1HD1  LEU 100          1HD1      LEU 100  -7.091   1.357 -13.343
  801   2HD1  LEU 100          3HD1      LEU 100  -8.544   2.351 -13.249
  802   3HD1  LEU 100          2HD1      LEU 100  -8.661   0.670 -13.765
  803   1HD2  LEU 100          2HD2      LEU 100  -8.287   4.026 -15.802
  804   2HD2  LEU 100          1HD2      LEU 100  -9.427   2.840 -16.435
  805   3HD2  LEU 100          3HD2      LEU 100  -9.480   3.292 -14.732
  806    H    VAL 101           H        VAL 101  -4.273   3.131 -16.270
  807    HA   VAL 101           HA       VAL 101  -2.296   5.008 -15.423
  808    HB   VAL 101           HB       VAL 101  -2.368   3.253 -17.425
  809   1HG1  VAL 101          2HG1      VAL 101  -4.149   4.773 -18.561
  810   2HG1  VAL 101          1HG1      VAL 101  -2.776   5.799 -18.978
  811   3HG1  VAL 101          3HG1      VAL 101  -2.838   4.131 -19.550
  812   1HG2  VAL 101          1HG2      VAL 101  -0.590   5.138 -16.541
  813   2HG2  VAL 101          3HG2      VAL 101  -0.267   3.991 -17.845
  814   3HG2  VAL 101          2HG2      VAL 101  -0.816   5.626 -18.222
  815    H    VAL 102           H        VAL 102  -2.069   6.834 -17.526
  816    HA   VAL 102           HA       VAL 102  -4.437   8.593 -17.037
  817    HB   VAL 102           HB       VAL 102  -2.097   9.254 -16.156
  818   1HG1  VAL 102          3HG1      VAL 102  -1.318   8.650 -18.714
  819   2HG1  VAL 102          2HG1      VAL 102  -1.473  10.405 -18.792
  820   3HG1  VAL 102          1HG1      VAL 102  -0.400   9.667 -17.605
  821   1HG2  VAL 102          3HG2      VAL 102  -4.105  10.782 -16.530
  822   2HG2  VAL 102          2HG2      VAL 102  -2.527  11.568 -16.538
  823   3HG2  VAL 102          1HG2      VAL 102  -3.353  11.235 -18.060
  824    HA   PRO 103           HA       PRO 103  -5.102   8.313 -21.387
  825   1HB   PRO 103          2HB       PRO 103  -6.785  10.478 -21.634
  826   2HB   PRO 103          1HB       PRO 103  -7.285   8.907 -20.987
  827   1HG   PRO 103          2HG       PRO 103  -6.711  11.459 -19.532
  828   2HG   PRO 103          1HG       PRO 103  -7.814  10.145 -19.093
  829   1HD   PRO 103          2HD       PRO 103  -5.261  10.577 -17.988
  830   2HD   PRO 103          1HD       PRO 103  -6.189   9.069 -17.869
  831    H    SER 104           H        SER 104  -3.818  11.175 -19.859
  832    HA   SER 104           HA       SER 104  -2.745  12.051 -22.509
  833   1HB   SER 104          2HB       SER 104  -4.362  13.621 -21.239
  834   2HB   SER 104          1HB       SER 104  -3.031  13.856 -20.105
  835    HG   SER 104           HG       SER 104  -3.153  15.372 -21.907
  836    H    HIS 105           H        HIS 105  -1.384  10.069 -21.189
  837    HA   HIS 105           HA       HIS 105   0.535  10.848 -19.264
  838   1HB   HIS 105          2HB       HIS 105   1.819   8.928 -19.973
  839   2HB   HIS 105          1HB       HIS 105   0.113   8.500 -20.093
  840    HD1  HIS 105           HD1      HIS 105   2.998   7.951 -21.939
  841    HD2  HIS 105           HD2      HIS 105  -0.722   9.502 -23.005
  842    HE1  HIS 105           HE1      HIS 105   2.799   7.676 -24.449
  843    H    LYS 106           HN       LYS 106   0.356  11.548 -22.679
  844    HA   LYS 106           HA       LYS 106   2.203  13.658 -22.591
  845   1HB   LYS 106          2HB       LYS 106   3.627  11.374 -22.292
  846   2HB   LYS 106          1HB       LYS 106   3.593  11.480 -24.051
  847   1HG   LYS 106          2HG       LYS 106   4.122  14.094 -23.026
  848   2HG   LYS 106          1HG       LYS 106   5.215  12.966 -22.224
  849   1HD   LYS 106          2HD       LYS 106   6.140  12.227 -24.271
  850   2HD   LYS 106          1HD       LYS 106   4.796  12.877 -25.211
  851   1HE   LYS 106          2HE       LYS 106   5.636  15.165 -24.102
  852   2HE   LYS 106          1HE       LYS 106   7.163  14.284 -24.056
  853   1HZ   LYS 106          3HZ       LYS 106   5.493  14.494 -26.494
  854   2HZ   LYS 106          2HZ       LYS 106   6.736  15.593 -26.129
  855   3HZ   LYS 106          1HZ       LYS 106   7.096  13.951 -26.377
  856   1H    GLU 201          2HT       GLU 201   5.653  -9.859   5.094
  857   2H    GLU 201          1HT       GLU 201   7.123  -9.429   4.358
  858   3H    GLU 201          3HT       GLU 201   7.058  -9.684   6.033
  859    HA   GLU 201           HA       GLU 201   5.675  -7.763   6.343
  860   1HB   GLU 201          2HB       GLU 201   7.945  -7.004   4.492
  861   2HB   GLU 201          1HB       GLU 201   7.309  -6.085   5.857
  862   1HG   GLU 201          2HG       GLU 201   8.080  -7.842   7.406
  863   2HG   GLU 201          1HG       GLU 201   8.713  -8.767   6.044
  864    HA   PRO 202           HA       PRO 202   3.167  -6.506   2.965
  865   1HB   PRO 202          2HB       PRO 202   2.478  -4.001   3.865
  866   2HB   PRO 202          1HB       PRO 202   1.805  -5.499   4.530
  867   1HG   PRO 202          2HG       PRO 202   3.839  -3.669   5.714
  868   2HG   PRO 202          1HG       PRO 202   2.706  -4.761   6.526
  869   1HD   PRO 202          2HD       PRO 202   5.463  -5.250   6.099
  870   2HD   PRO 202          1HD       PRO 202   4.254  -6.451   6.605
  871    H    GLN 203           H        GLN 203   3.116  -4.975   1.157
  872    HA   GLN 203           HA       GLN 203   5.195  -2.911   0.991
  873   1HB   GLN 203          2HB       GLN 203   5.768  -5.541   0.088
  874   2HB   GLN 203          1HB       GLN 203   5.519  -4.552  -1.351
  875   1HG   GLN 203          2HG       GLN 203   7.091  -3.176   0.697
  876   2HG   GLN 203          1HG       GLN 203   7.856  -4.665   0.140
  877   1HE2  GLN 203          2HE2      GLN 203   7.929  -1.441  -2.246
  878   2HE2  GLN 203          1HE2      GLN 203   7.453  -1.378  -0.617
  879   1HN   PTR 204          1HN       PTR 204   2.246  -3.122   0.782
  880    HA   PTR 204           HA       PTR 204   1.982  -1.711  -1.806
  881   1HB   PTR 204          1HB       PTR 204  -0.201  -3.083  -2.161
  882    HD1  PTR 204           HD1      PTR 204   1.169  -2.312  -4.202
  883    HD2  PTR 204           HD2      PTR 204   2.149  -5.781  -1.864
  884    HE1  PTR 204           HE1      PTR 204   2.545  -3.187  -6.073
  885    HE2  PTR 204           HE2      PTR 204   3.524  -6.653  -3.732
  886    H    GLU 205           H        GLU 205   0.466  -0.065  -1.676
  887    HA   GLU 205           HA       GLU 205  -0.591   0.563   0.969
  888   1HB   GLU 205          2HB       GLU 205  -0.962   1.905  -1.726
  889   2HB   GLU 205          1HB       GLU 205  -1.556   2.557  -0.197
  890   1HG   GLU 205          2HG       GLU 205   1.327   1.777  -0.367
  891   2HG   GLU 205          1HG       GLU 205   0.821   3.271  -1.158
  892    H    GLU 206           H        GLU 206  -2.386  -0.476   1.693
  893    HA   GLU 206           HA       GLU 206  -4.434  -1.341  -0.282
  894   1HB   GLU 206          2HB       GLU 206  -4.534  -1.961   2.660
  895   2HB   GLU 206          1HB       GLU 206  -5.154  -2.906   1.306
  896   1HG   GLU 206          2HG       GLU 206  -2.877  -3.444   0.595
  897   2HG   GLU 206          1HG       GLU 206  -2.215  -2.434   1.879
  898    H    ILE 207           H        ILE 207  -6.208  -0.079  -0.549
  899    HA   ILE 207           HA       ILE 207  -6.693   2.323   0.811
  900    HB   ILE 207           HB       ILE 207  -8.522   0.479  -0.723
  901   1HG1  ILE 207          2HG1      ILE 207  -8.494   2.825  -2.031
  902   2HG1  ILE 207          1HG1      ILE 207  -6.943   2.958  -1.201
  903   1HG2  ILE 207          3HG2      ILE 207  -9.245   2.698   1.070
  904   2HG2  ILE 207          2HG2      ILE 207  -9.861   2.880  -0.572
  905   3HG2  ILE 207          1HG2      ILE 207 -10.266   1.443   0.367
  906   1HD1  ILE 207          2HD1      ILE 207  -7.592   0.376  -2.562
  907   2HD1  ILE 207          1HD1      ILE 207  -7.130   1.751  -3.565
  908   3HD1  ILE 207          3HD1      ILE 207  -6.028   1.154  -2.325
  909    HA   PRO 208           HA       PRO 208  -9.592  -0.017   3.804
  910   1HB   PRO 208          2HB       PRO 208  -9.417  -2.757   3.859
  911   2HB   PRO 208          1HB       PRO 208 -10.551  -1.871   2.824
  912   1HG   PRO 208          2HG       PRO 208  -8.038  -3.282   2.072
  913   2HG   PRO 208          1HG       PRO 208  -9.466  -2.932   1.085
  914   1HD   PRO 208          2HD       PRO 208  -7.011  -1.521   1.028
  915   2HD   PRO 208          1HD       PRO 208  -8.534  -1.008   0.277
  916    H    ILE 209           H        ILE 209  -9.035  -0.422   5.997
  917    HA   ILE 209           HA       ILE 209  -6.383  -1.639   6.550
  918    HB   ILE 209           HB       ILE 209  -7.141   0.959   7.879
  919   1HG1  ILE 209          2HG1      ILE 209  -5.354   0.761   5.446
  920   2HG1  ILE 209          1HG1      ILE 209  -7.070   1.142   5.313
  921   1HG2  ILE 209          2HG2      ILE 209  -4.503  -0.435   7.327
  922   2HG2  ILE 209          1HG2      ILE 209  -4.697   1.074   8.219
  923   3HG2  ILE 209          3HG2      ILE 209  -5.355  -0.427   8.870
  924   1HD1  ILE 209          1HD1      ILE 209  -6.721   3.040   6.909
  925   2HD1  ILE 209          3HD1      ILE 209  -4.991   2.699   6.875
  926   3HD1  ILE 209          2HD1      ILE 209  -5.815   3.224   5.407
  927    H    TYR 210           H        TYR 210  -9.508  -1.865   7.066
  928    HA   TYR 210           HA       TYR 210  -9.617  -1.906   9.985
  929   1HB   TYR 210          2HB       TYR 210 -11.659  -3.289   8.294
  930   2HB   TYR 210          1HB       TYR 210 -11.878  -2.283   9.720
  931    HD1  TYR 210           HD1      TYR 210 -10.581   0.194   9.197
  932    HD2  TYR 210           HD2      TYR 210 -12.720  -2.324   6.452
  933    HE1  TYR 210           HE1      TYR 210 -11.043   2.159   7.755
  934    HE2  TYR 210           HE2      TYR 210 -13.183  -0.359   5.010
  935    HH   TYR 210           HH       TYR 210 -12.050   2.898   5.926
  936    H    LEU 211           HN       LEU 211 -10.873  -4.203  10.663
  937    HA   LEU 211           HA       LEU 211  -8.725  -6.179  10.428
  938   1HB   LEU 211          2HB       LEU 211 -11.309  -5.992  11.953
  939   2HB   LEU 211          1HB       LEU 211 -10.493  -7.549  11.805
  940    HG   LEU 211           HG       LEU 211  -8.467  -5.705  12.447
  941   1HD1  LEU 211          3HD1      LEU 211 -10.789  -4.486  13.197
  942   2HD1  LEU 211          2HD1      LEU 211 -10.426  -5.420  14.648
  943   3HD1  LEU 211          1HD1      LEU 211  -9.251  -4.258  14.030
  944   1HD2  LEU 211          3HD2      LEU 211  -9.379  -8.191  13.255
  945   2HD2  LEU 211          2HD2      LEU 211  -8.000  -7.337  13.947
  946   3HD2  LEU 211          1HD2      LEU 211  -9.588  -7.208  14.704
   
  No H/Q in entry =         946
  Start of MODEL   17
    1   1H    SER   1          3HT       SER   1  -7.805  -9.878 -26.436
    2   2H    SER   1          2HT       SER   1  -7.144 -11.420 -26.164
    3   3H    SER   1          1HT       SER   1  -8.344 -10.812 -25.127
    4    HA   SER   1           HA       SER   1  -6.182 -10.664 -24.076
    5   1HB   SER   1          2HB       SER   1  -5.304 -10.133 -26.641
    6   2HB   SER   1          1HB       SER   1  -5.217  -8.548 -25.872
    7    HG   SER   1           HG       SER   1  -4.273 -10.780 -24.481
    8    H    ILE   2           H        ILE   2  -5.789  -8.870 -22.638
    9    HA   ILE   2           HA       ILE   2  -8.017  -6.930 -22.626
   10    HB   ILE   2           HB       ILE   2  -6.884  -6.290 -20.376
   11   1HG1  ILE   2          2HG1      ILE   2  -5.611  -9.007 -20.799
   12   2HG1  ILE   2          1HG1      ILE   2  -4.736  -7.492 -21.020
   13   1HG2  ILE   2          1HG2      ILE   2  -8.099  -9.018 -20.890
   14   2HG2  ILE   2          3HG2      ILE   2  -7.891  -8.321 -19.284
   15   3HG2  ILE   2          2HG2      ILE   2  -8.956  -7.540 -20.453
   16   1HD1  ILE   2          3HD1      ILE   2  -6.197  -8.218 -18.466
   17   2HD1  ILE   2          2HD1      ILE   2  -4.481  -8.533 -18.722
   18   3HD1  ILE   2          1HD1      ILE   2  -5.082  -6.875 -18.713
   19    H    GLN   3           H        GLN   3  -6.946  -4.719 -21.436
   20    HA   GLN   3           HA       GLN   3  -5.372  -3.573 -23.644
   21   1HB   GLN   3          2HB       GLN   3  -7.311  -2.555 -21.950
   22   2HB   GLN   3          1HB       GLN   3  -5.820  -1.866 -21.302
   23   1HG   GLN   3          2HG       GLN   3  -5.288  -1.351 -23.820
   24   2HG   GLN   3          1HG       GLN   3  -7.029  -1.536 -24.036
   25   1HE2  GLN   3          2HE2      GLN   3  -5.644   1.595 -21.747
   26   2HE2  GLN   3          1HE2      GLN   3  -4.669   0.219 -21.944
   27    H    ALA   4           H        ALA   4  -3.707  -5.363 -22.615
   28    HA   ALA   4           HA       ALA   4  -2.186  -4.410 -20.342
   29   1HB   ALA   4          1HB       ALA   4  -2.333  -6.820 -21.296
   30   2HB   ALA   4          3HB       ALA   4  -1.108  -6.280 -22.445
   31   3HB   ALA   4          2HB       ALA   4  -0.767  -6.254 -20.716
   32    H    GLU   5           H        GLU   5  -1.356  -2.345 -20.673
   33    HA   GLU   5           HA       GLU   5   1.040  -1.980 -22.093
   34   1HB   GLU   5          2HB       GLU   5  -0.034  -0.415 -23.933
   35   2HB   GLU   5          1HB       GLU   5   0.109  -2.150 -24.215
   36   1HG   GLU   5          2HG       GLU   5  -2.169  -2.534 -23.787
   37   2HG   GLU   5          1HG       GLU   5  -2.353  -1.022 -22.898
   38    H    GLU   6           H        GLU   6  -2.006  -0.401 -21.164
   39    HA   GLU   6           HA       GLU   6  -0.453   2.033 -20.429
   40   1HB   GLU   6          2HB       GLU   6  -3.451   1.635 -20.619
   41   2HB   GLU   6          1HB       GLU   6  -2.627   3.165 -20.314
   42   1HG   GLU   6          2HG       GLU   6  -1.376   2.224 -22.603
   43   2HG   GLU   6          1HG       GLU   6  -3.058   1.751 -22.846
   44    H    TRP   7           H        TRP   7  -3.324   0.430 -19.058
   45    HA   TRP   7           HA       TRP   7  -2.342   1.073 -16.355
   46   1HB   TRP   7          2HB       TRP   7  -4.604   0.079 -15.698
   47   2HB   TRP   7          1HB       TRP   7  -4.663   1.549 -16.668
   48    HD1  TRP   7           HD1      TRP   7  -5.811   1.426 -18.973
   49    HE1  TRP   7           HE1      TRP   7  -6.931  -0.457 -20.334
   50    HE3  TRP   7           HE3      TRP   7  -4.424  -2.618 -16.184
   51    HZ2  TRP   7           HZ2      TRP   7  -7.201  -3.305 -20.246
   52    HZ3  TRP   7           HZ3      TRP   7  -5.124  -4.902 -16.843
   53    HH2  TRP   7           HH2      TRP   7  -6.509  -5.251 -18.869
   54    H    TYR   8           H        TYR   8  -1.691  -1.311 -18.463
   55    HA   TYR   8           HA       TYR   8  -1.005  -3.223 -16.352
   56   1HB   TYR   8          2HB       TYR   8  -3.139  -4.064 -16.662
   57   2HB   TYR   8          1HB       TYR   8  -3.157  -3.702 -18.385
   58    HD1  TYR   8           HD1      TYR   8  -0.456  -5.411 -16.467
   59    HD2  TYR   8           HD2      TYR   8  -3.651  -5.827 -19.305
   60    HE1  TYR   8           HE1      TYR   8   0.263  -7.733 -16.947
   61    HE2  TYR   8           HE2      TYR   8  -2.921  -8.143 -19.795
   62    HH   TYR   8           HH       TYR   8  -0.833  -9.485 -19.623
   63    H    PHE   9           H        PHE   9   1.105  -2.958 -16.923
   64    HA   PHE   9           HA       PHE   9   2.091  -2.945 -19.614
   65   1HB   PHE   9          2HB       PHE   9   3.294  -3.183 -16.884
   66   2HB   PHE   9          1HB       PHE   9   4.301  -3.527 -18.289
   67    HD1  PHE   9           HD1      PHE   9   1.465  -1.160 -18.400
   68    HD2  PHE   9           HD2      PHE   9   5.733  -1.552 -18.003
   69    HE1  PHE   9           HE1      PHE   9   1.731   1.275 -18.788
   70    HE2  PHE   9           HE2      PHE   9   5.990   0.883 -18.391
   71    HZ   PHE   9           HZ       PHE   9   3.990   2.296 -18.784
   72    H    GLY  10           H        GLY  10   1.642  -5.556 -17.260
   73   1HA   GLY  10          2HA       GLY  10   1.249  -7.721 -18.752
   74   2HA   GLY  10          1HA       GLY  10   2.931  -7.435 -19.168
   75    H    LYS  11           H        LYS  11   3.934  -9.118 -18.148
   76    HA   LYS  11           HA       LYS  11   3.431  -9.444 -15.231
   77   1HB   LYS  11          2HB       LYS  11   4.845 -11.503 -16.907
   78   2HB   LYS  11          1HB       LYS  11   3.927 -11.728 -15.418
   79   1HG   LYS  11          2HG       LYS  11   2.183 -12.329 -16.723
   80   2HG   LYS  11          1HG       LYS  11   2.077 -10.636 -17.203
   81   1HD   LYS  11          2HD       LYS  11   4.119 -11.526 -18.800
   82   2HD   LYS  11          1HD       LYS  11   3.096 -12.961 -18.709
   83   1HE   LYS  11          2HE       LYS  11   1.377 -10.719 -19.055
   84   2HE   LYS  11          1HE       LYS  11   2.677 -10.566 -20.237
   85   1HZ   LYS  11          1HZ       LYS  11   2.257 -12.858 -20.918
   86   2HZ   LYS  11          3HZ       LYS  11   0.976 -12.963 -19.812
   87   3HZ   LYS  11          2HZ       LYS  11   0.878 -11.887 -21.122
   88    H    LEU  12           H        LEU  12   4.900  -7.502 -15.178
   89    HA   LEU  12           HA       LEU  12   7.758  -8.301 -15.506
   90   1HB   LEU  12          2HB       LEU  12   8.142  -6.249 -16.366
   91   2HB   LEU  12          1HB       LEU  12   6.397  -6.088 -16.475
   92    HG   LEU  12           HG       LEU  12   8.222  -5.038 -14.313
   93   1HD1  LEU  12          1HD1      LEU  12   6.286  -3.839 -16.301
   94   2HD1  LEU  12          3HD1      LEU  12   6.896  -2.927 -14.917
   95   3HD1  LEU  12          2HD1      LEU  12   8.014  -3.524 -16.148
   96   1HD2  LEU  12          1HD2      LEU  12   5.560  -6.002 -13.983
   97   2HD2  LEU  12          3HD2      LEU  12   6.608  -5.200 -12.808
   98   3HD2  LEU  12          2HD2      LEU  12   5.549  -4.241 -13.845
   99    H    GLY  13           H        GLY  13   9.014  -6.561 -13.805
  100   1HA   GLY  13          2HA       GLY  13   8.051  -7.538 -11.162
  101   2HA   GLY  13          1HA       GLY  13   9.698  -7.010 -11.509
  102    H    ARG  14           H        ARG  14   7.964  -6.023  -9.363
  103    HA   ARG  14           HA       ARG  14   6.781  -3.503  -9.992
  104   1HB   ARG  14          2HB       ARG  14   6.893  -3.047  -7.625
  105   2HB   ARG  14          1HB       ARG  14   6.561  -4.769  -7.811
  106   1HG   ARG  14          2HG       ARG  14   8.383  -5.188  -6.557
  107   2HG   ARG  14          1HG       ARG  14   9.368  -4.524  -7.860
  108   1HD   ARG  14          2HD       ARG  14   9.751  -2.589  -6.734
  109   2HD   ARG  14          1HD       ARG  14   8.078  -2.476  -6.186
  110    HE   ARG  14           HE       ARG  14   8.920  -4.426  -4.565
  111   1HH1  ARG  14          2HH1      ARG  14  10.022  -1.271  -5.267
  112   2HH1  ARG  14          1HH1      ARG  14  11.221  -1.250  -4.017
  113   1HH2  ARG  14          1HH2      ARG  14  10.699  -4.554  -3.099
  114   2HH2  ARG  14          2HH2      ARG  14  11.605  -3.110  -2.790
  115    H    LYS  15           H        LYS  15  10.064  -4.506  -9.695
  116    HA   LYS  15           HA       LYS  15  11.201  -1.901  -9.229
  117   1HB   LYS  15          2HB       LYS  15  12.362  -4.079  -8.710
  118   2HB   LYS  15          1HB       LYS  15  12.525  -4.335 -10.449
  119   1HG   LYS  15          2HG       LYS  15  14.139  -2.721 -10.670
  120   2HG   LYS  15          1HG       LYS  15  13.430  -1.697  -9.421
  121   1HD   LYS  15          2HD       LYS  15  15.634  -2.689  -8.751
  122   2HD   LYS  15          1HD       LYS  15  14.314  -3.139  -7.672
  123   1HE   LYS  15          2HE       LYS  15  14.132  -5.313  -8.643
  124   2HE   LYS  15          1HE       LYS  15  15.150  -4.863 -10.012
  125   1HZ   LYS  15          2HZ       LYS  15  16.661  -4.331  -7.785
  126   2HZ   LYS  15          1HZ       LYS  15  15.910  -5.815  -7.442
  127   3HZ   LYS  15          3HZ       LYS  15  16.848  -5.646  -8.845
  128    H    ASP  16           H        ASP  16  10.233  -3.811 -11.980
  129    HA   ASP  16           HA       ASP  16  11.567  -2.201 -13.942
  130   1HB   ASP  16          2HB       ASP  16  10.353  -4.660 -13.875
  131   2HB   ASP  16          1HB       ASP  16   9.171  -3.670 -14.685
  132    H    ALA  17           H        ALA  17   8.639  -2.085 -12.129
  133    HA   ALA  17           HA       ALA  17   7.200  -0.313 -13.929
  134   1HB   ALA  17          3HB       ALA  17   6.766  -1.061 -11.029
  135   2HB   ALA  17          2HB       ALA  17   5.669  -0.033 -11.953
  136   3HB   ALA  17          1HB       ALA  17   5.920  -1.713 -12.434
  137    H    GLU  18           H        GLU  18   9.280   0.063 -11.105
  138    HA   GLU  18           HA       GLU  18   8.804   2.933 -10.904
  139   1HB   GLU  18          2HB       GLU  18  10.785   2.887  -9.382
  140   2HB   GLU  18          1HB       GLU  18   9.581   1.677  -8.940
  141   1HG   GLU  18          2HG       GLU  18  10.868  -0.096  -9.757
  142   2HG   GLU  18          1HG       GLU  18  11.807   0.948 -10.824
  143    H    ARG  19           H        ARG  19  11.018   0.843 -12.610
  144    HA   ARG  19           HA       ARG  19  12.831   2.985 -13.403
  145   1HB   ARG  19          2HB       ARG  19  13.593   0.640 -13.266
  146   2HB   ARG  19          1HB       ARG  19  12.469   0.203 -14.553
  147   1HG   ARG  19          2HG       ARG  19  13.793   1.095 -16.177
  148   2HG   ARG  19          1HG       ARG  19  14.239   2.483 -15.184
  149   1HD   ARG  19          2HD       ARG  19  15.597   0.701 -13.807
  150   2HD   ARG  19          1HD       ARG  19  15.482  -0.251 -15.286
  151    HE   ARG  19           HE       ARG  19  16.386   2.148 -16.232
  152   1HH1  ARG  19          2HH1      ARG  19  17.500  -0.384 -14.250
  153   2HH1  ARG  19          1HH1      ARG  19  19.076   0.294 -14.005
  154   1HH2  ARG  19          1HH2      ARG  19  18.345   3.260 -15.647
  155   2HH2  ARG  19          2HH2      ARG  19  19.554   2.357 -14.797
  156    H    GLN  20           H        GLN  20  10.130   1.270 -14.926
  157    HA   GLN  20           HA       GLN  20  10.392   2.691 -17.448
  158   1HB   GLN  20          2HB       GLN  20   8.366   0.838 -16.229
  159   2HB   GLN  20          1HB       GLN  20   7.910   1.792 -17.642
  160   1HG   GLN  20          2HG       GLN  20  10.552   0.498 -17.856
  161   2HG   GLN  20          1HG       GLN  20   9.200  -0.630 -17.751
  162   1HE2  GLN  20          2HE2      GLN  20   9.840   0.695 -21.320
  163   2HE2  GLN  20          1HE2      GLN  20  10.956   0.226 -20.131
  164    H    LEU  21           H        LEU  21   7.933   2.816 -14.851
  165    HA   LEU  21           HA       LEU  21   6.514   5.054 -15.727
  166   1HB   LEU  21          2HB       LEU  21   7.224   4.240 -12.897
  167   2HB   LEU  21          1HB       LEU  21   6.013   5.452 -13.300
  168    HG   LEU  21           HG       LEU  21   5.969   2.496 -13.919
  169   1HD1  LEU  21          1HD1      LEU  21   4.468   4.409 -12.217
  170   2HD1  LEU  21          3HD1      LEU  21   3.504   3.178 -13.034
  171   3HD1  LEU  21          2HD1      LEU  21   4.814   2.700 -11.953
  172   1HD2  LEU  21          2HD2      LEU  21   4.460   4.758 -15.226
  173   2HD2  LEU  21          1HD2      LEU  21   5.306   3.414 -15.994
  174   3HD2  LEU  21          3HD2      LEU  21   3.785   3.130 -15.148
  175    H    LEU  22           H        LEU  22   9.142   5.190 -13.298
  176    HA   LEU  22           HA       LEU  22   9.440   8.002 -13.346
  177   1HB   LEU  22          2HB       LEU  22  11.585   5.906 -12.885
  178   2HB   LEU  22          1HB       LEU  22  11.701   7.605 -12.431
  179    HG   LEU  22           HG       LEU  22   9.843   5.498 -11.315
  180   1HD1  LEU  22          3HD1      LEU  22  12.310   6.483 -10.504
  181   2HD1  LEU  22          2HD1      LEU  22  11.164   7.400  -9.526
  182   3HD1  LEU  22          1HD1      LEU  22  11.153   5.637  -9.476
  183   1HD2  LEU  22          3HD2      LEU  22   9.482   8.439 -11.529
  184   2HD2  LEU  22          2HD2      LEU  22   8.273   7.162 -11.391
  185   3HD2  LEU  22          1HD2      LEU  22   9.137   7.720  -9.958
  186    H    SER  23           H        SER  23  10.930   5.512 -15.397
  187    HA   SER  23           HA       SER  23  12.828   7.008 -16.781
  188   1HB   SER  23          2HB       SER  23  12.837   4.887 -17.631
  189   2HB   SER  23          1HB       SER  23  11.091   4.702 -17.452
  190    HG   SER  23           HG       SER  23  12.431   6.216 -19.442
  191    H    PHE  24           H        PHE  24  12.763   8.637 -18.305
  192    HA   PHE  24           HA       PHE  24  10.675  10.437 -18.516
  193   1HB   PHE  24          2HB       PHE  24  12.877   9.676 -20.409
  194   2HB   PHE  24          1HB       PHE  24  11.644  10.817 -20.945
  195    HD1  PHE  24           HD1      PHE  24  13.793  10.157 -17.933
  196    HD2  PHE  24           HD2      PHE  24  12.010  13.078 -20.529
  197    HE1  PHE  24           HE1      PHE  24  14.919  11.968 -16.668
  198    HE2  PHE  24           HE2      PHE  24  13.136  14.890 -19.264
  199    HZ   PHE  24           HZ       PHE  24  14.591  14.335 -17.333
  200    H    GLY  25           H        GLY  25   8.685  10.438 -19.472
  201   1HA   GLY  25          2HA       GLY  25   7.896   9.317 -21.885
  202   2HA   GLY  25          1HA       GLY  25   7.700   8.009 -20.720
  203    H    ASN  26           H        ASN  26   6.173   8.303 -18.987
  204    HA   ASN  26           HA       ASN  26   4.121  10.387 -19.603
  205   1HB   ASN  26          2HB       ASN  26   2.688   8.774 -18.115
  206   2HB   ASN  26          1HB       ASN  26   3.027   8.323 -19.786
  207   1HD2  ASN  26          2HD2      ASN  26   5.073   5.561 -18.903
  208   2HD2  ASN  26          1HD2      ASN  26   4.519   6.555 -20.162
  209    HA   PRO  27           HA       PRO  27   4.969  12.210 -15.695
  210   1HB   PRO  27          2HB       PRO  27   2.605  13.583 -15.401
  211   2HB   PRO  27          1HB       PRO  27   3.902  14.087 -16.496
  212   1HG   PRO  27          2HG       PRO  27   1.279  12.805 -17.137
  213   2HG   PRO  27          1HG       PRO  27   2.279  13.869 -18.139
  214   1HD   PRO  27          2HD       PRO  27   2.105  11.046 -18.358
  215   2HD   PRO  27          1HD       PRO  27   3.329  12.079 -19.126
  216    H    ARG  28           H        ARG  28   3.199  12.761 -13.653
  217    HA   ARG  28           HA       ARG  28   2.821  10.188 -12.421
  218   1HB   ARG  28          2HB       ARG  28   1.663  11.496 -10.635
  219   2HB   ARG  28          1HB       ARG  28   3.232  12.175 -11.064
  220   1HG   ARG  28          2HG       ARG  28   1.504  13.415 -12.844
  221   2HG   ARG  28          1HG       ARG  28   0.557  13.335 -11.359
  222   1HD   ARG  28          2HD       ARG  28   2.103  14.614 -10.151
  223   2HD   ARG  28          1HD       ARG  28   3.423  14.244 -11.262
  224    HE   ARG  28           HE       ARG  28   2.294  15.771 -12.905
  225   1HH1  ARG  28          1HH2      ARG  28  -0.342  16.197 -11.793
  226   2HH1  ARG  28          2HH2      ARG  28  -0.183  17.658 -10.877
  227   1HH2  ARG  28          2HH1      ARG  28   3.280  17.521 -10.763
  228   2HH2  ARG  28          1HH1      ARG  28   1.868  18.408 -10.293
  229    H    GLY  29           H        GLY  29   0.618   9.491 -11.545
  230   1HA   GLY  29          2HA       GLY  29  -1.752   9.263 -11.812
  231   2HA   GLY  29          1HA       GLY  29  -1.672  10.324 -13.218
  232    H    THR  30           H        THR  30   0.817   8.193 -13.601
  233    HA   THR  30           HA       THR  30  -0.757   6.598 -15.531
  234    HB   THR  30           HB       THR  30   2.061   5.871 -15.217
  235    HG1  THR  30           HG1      THR  30   1.340   8.551 -15.795
  236   1HG2  THR  30          1HG2      THR  30   0.195   6.774 -17.394
  237   2HG2  THR  30          3HG2      THR  30   1.931   6.695 -17.694
  238   3HG2  THR  30          2HG2      THR  30   1.049   5.240 -17.231
  239    H    PHE  31           H        PHE  31  -1.975   5.245 -14.084
  240    HA   PHE  31           HA       PHE  31  -0.455   3.573 -12.185
  241   1HB   PHE  31          2HB       PHE  31  -3.420   3.549 -12.798
  242   2HB   PHE  31          1HB       PHE  31  -2.628   2.771 -11.434
  243    HD1  PHE  31           HD1      PHE  31  -0.785   5.667 -11.823
  244    HD2  PHE  31           HD2      PHE  31  -4.697   4.403 -10.581
  245    HE1  PHE  31           HE1      PHE  31  -1.038   7.746 -10.511
  246    HE2  PHE  31           HE2      PHE  31  -4.945   6.482  -9.261
  247    HZ   PHE  31           HZ       PHE  31  -3.119   8.157  -9.228
  248    H    LEU  32           H        LEU  32   0.746   2.249 -13.682
  249    HA   LEU  32           HA       LEU  32  -0.727   0.631 -15.633
  250   1HB   LEU  32          2HB       LEU  32   1.441  -0.296 -16.204
  251   2HB   LEU  32          1HB       LEU  32   1.617   1.450 -16.030
  252    HG   LEU  32           HG       LEU  32   2.196   0.868 -13.538
  253   1HD1  LEU  32          3HD1      LEU  32   2.261  -1.759 -14.943
  254   2HD1  LEU  32          2HD1      LEU  32   3.572  -1.426 -13.812
  255   3HD1  LEU  32          1HD1      LEU  32   1.898  -1.396 -13.257
  256   1HD2  LEU  32          3HD2      LEU  32   3.693   1.370 -15.835
  257   2HD2  LEU  32          2HD2      LEU  32   4.293   1.421 -14.179
  258   3HD2  LEU  32          1HD2      LEU  32   4.463  -0.052 -15.134
  259    H    ILE  33           H        ILE  33  -0.509  -1.780 -15.544
  260    HA   ILE  33           HA       ILE  33  -0.661  -2.747 -12.719
  261    HB   ILE  33           HB       ILE  33  -2.237  -3.490 -15.175
  262   1HG1  ILE  33          2HG1      ILE  33  -2.916  -3.051 -12.259
  263   2HG1  ILE  33          1HG1      ILE  33  -3.208  -1.919 -13.577
  264   1HG2  ILE  33          1HG2      ILE  33  -1.237  -5.612 -14.379
  265   2HG2  ILE  33          3HG2      ILE  33  -1.895  -5.294 -12.773
  266   3HG2  ILE  33          2HG2      ILE  33  -2.981  -5.562 -14.135
  267   1HD1  ILE  33          3HD1      ILE  33  -4.324  -4.697 -13.769
  268   2HD1  ILE  33          2HD1      ILE  33  -5.144  -3.510 -12.755
  269   3HD1  ILE  33          1HD1      ILE  33  -4.929  -3.200 -14.478
  270    H    ARG  34           H        ARG  34  -0.060  -5.206 -12.637
  271    HA   ARG  34           HA       ARG  34   1.640  -6.357 -14.612
  272   1HB   ARG  34          2HB       ARG  34   3.834  -5.992 -13.355
  273   2HB   ARG  34          1HB       ARG  34   3.214  -4.602 -14.244
  274   1HG   ARG  34          2HG       ARG  34   3.543  -3.529 -12.251
  275   2HG   ARG  34          1HG       ARG  34   1.980  -4.238 -11.849
  276   1HD   ARG  34          2HD       ARG  34   2.998  -6.062 -10.690
  277   2HD   ARG  34          1HD       ARG  34   4.591  -5.678 -11.342
  278    HE   ARG  34           HE       ARG  34   3.731  -3.412  -9.888
  279   1HH1  ARG  34          2HH1      ARG  34   4.852  -6.644  -9.528
  280   2HH1  ARG  34          1HH1      ARG  34   5.236  -6.469  -7.848
  281   1HH2  ARG  34          1HH2      ARG  34   4.071  -3.209  -7.649
  282   2HH2  ARG  34          2HH2      ARG  34   4.795  -4.524  -6.785
  283    H    GLU  35           H        GLU  35   2.189  -8.442 -14.025
  284    HA   GLU  35           HA       GLU  35   0.839  -9.773 -11.977
  285   1HB   GLU  35          2HB       GLU  35   3.155 -10.345 -13.717
  286   2HB   GLU  35          1HB       GLU  35   3.045 -11.331 -12.271
  287   1HG   GLU  35          2HG       GLU  35   0.643 -11.803 -12.872
  288   2HG   GLU  35          1HG       GLU  35   0.919 -10.954 -14.393
  289    H    SER  36           H        SER  36   1.132  -9.953  -9.786
  290    HA   SER  36           HA       SER  36   3.472  -8.625  -8.575
  291   1HB   SER  36          2HB       SER  36   0.954  -9.844  -7.407
  292   2HB   SER  36          1HB       SER  36   2.232  -9.115  -6.445
  293    HG   SER  36           HG       SER  36   1.069  -7.389  -6.783
  294    H    GLU  37           H        GLU  37   5.201  -9.793  -7.857
  295    HA   GLU  37           HA       GLU  37   5.065 -12.746  -7.966
  296   1HB   GLU  37          2HB       GLU  37   7.298 -10.771  -7.497
  297   2HB   GLU  37          1HB       GLU  37   7.524 -12.514  -7.367
  298   1HG   GLU  37          2HG       GLU  37   6.620 -12.726  -9.713
  299   2HG   GLU  37          1HG       GLU  37   6.637 -10.967  -9.820
  300    H    THR  38           H        THR  38   3.869 -10.828  -5.837
  301    HA   THR  38           HA       THR  38   5.264 -11.703  -3.392
  302    HB   THR  38           HB       THR  38   4.112  -9.406  -3.809
  303    HG1  THR  38           HG1      THR  38   3.566  -9.325  -1.603
  304   1HG2  THR  38          2HG2      THR  38   1.720 -11.134  -3.113
  305   2HG2  THR  38          1HG2      THR  38   1.720  -9.370  -3.133
  306   3HG2  THR  38          3HG2      THR  38   1.976 -10.270  -4.629
  307    H    THR  39           H        THR  39   2.221 -12.188  -5.075
  308    HA   THR  39           HA       THR  39   1.510 -14.366  -3.174
  309    HB   THR  39           HB       THR  39  -0.027 -12.657  -5.130
  310    HG1  THR  39           HG1      THR  39   0.056 -13.160  -2.393
  311   1HG2  THR  39          2HG2      THR  39  -0.985 -15.229  -3.857
  312   2HG2  THR  39          1HG2      THR  39  -2.002 -14.077  -4.720
  313   3HG2  THR  39          3HG2      THR  39  -0.737 -14.949  -5.577
  314    H    LYS  40           H        LYS  40   0.423 -16.308  -4.391
  315    HA   LYS  40           HA       LYS  40   2.183 -17.796  -5.850
  316   1HB   LYS  40          2HB       LYS  40  -0.702 -17.736  -6.708
  317   2HB   LYS  40          1HB       LYS  40   0.375 -19.128  -6.590
  318   1HG   LYS  40          2HG       LYS  40   0.461 -18.585  -4.064
  319   2HG   LYS  40          1HG       LYS  40  -0.950 -17.573  -4.373
  320   1HD   LYS  40          2HD       LYS  40  -1.655 -19.878  -5.671
  321   2HD   LYS  40          1HD       LYS  40  -0.716 -20.520  -4.323
  322   1HE   LYS  40          2HE       LYS  40  -2.101 -19.043  -2.794
  323   2HE   LYS  40          1HE       LYS  40  -3.136 -18.702  -4.181
  324   1HZ   LYS  40          2HZ       LYS  40  -2.604 -21.500  -3.815
  325   2HZ   LYS  40          1HZ       LYS  40  -3.412 -20.801  -2.493
  326   3HZ   LYS  40          3HZ       LYS  40  -4.083 -20.698  -4.047
  327    H    GLY  41           H        GLY  41   0.236 -15.165  -7.031
  328   1HA   GLY  41          2HA       GLY  41   1.806 -14.245  -9.054
  329   2HA   GLY  41          1HA       GLY  41   0.918 -15.563  -9.831
  330    H    ALA  42           H        ALA  42   0.141 -12.965  -7.520
  331    HA   ALA  42           HA       ALA  42  -2.532 -12.593  -8.636
  332   1HB   ALA  42          3HB       ALA  42  -1.474 -12.125  -6.192
  333   2HB   ALA  42          2HB       ALA  42  -1.285 -10.523  -6.909
  334   3HB   ALA  42          1HB       ALA  42  -2.888 -11.257  -6.797
  335    H    TYR  43           H        TYR  43  -2.580  -9.740  -8.484
  336    HA   TYR  43           HA       TYR  43  -0.752  -9.067 -10.736
  337   1HB   TYR  43          2HB       TYR  43  -3.622  -9.097 -10.769
  338   2HB   TYR  43          1HB       TYR  43  -3.063  -7.433 -10.959
  339    HD1  TYR  43           HD1      TYR  43  -0.615  -7.532 -12.341
  340    HD2  TYR  43           HD2      TYR  43  -4.049 -10.055 -12.872
  341    HE1  TYR  43           HE1      TYR  43   0.109  -8.033 -14.665
  342    HE2  TYR  43           HE2      TYR  43  -3.331 -10.553 -15.192
  343    HH   TYR  43           HH       TYR  43  -0.202  -9.628 -16.378
  344    H    SER  44           H        SER  44  -1.135  -6.389 -10.969
  345    HA   SER  44           HA       SER  44  -1.115  -5.139  -8.307
  346   1HB   SER  44          2HB       SER  44   1.110  -5.834  -8.210
  347   2HB   SER  44          1HB       SER  44   1.351  -5.579  -9.939
  348    HG   SER  44           HG       SER  44   1.546  -3.816  -7.855
  349    H    LEU  45           H        LEU  45  -0.497  -2.789  -8.537
  350    HA   LEU  45           HA       LEU  45  -1.170  -1.705 -11.232
  351   1HB   LEU  45          2HB       LEU  45  -2.994  -1.734  -9.114
  352   2HB   LEU  45          1HB       LEU  45  -2.338  -0.097  -9.123
  353    HG   LEU  45           HG       LEU  45  -3.729  -1.558 -11.357
  354   1HD1  LEU  45          1HD1      LEU  45  -4.192   0.818  -9.632
  355   2HD1  LEU  45          3HD1      LEU  45  -4.727   0.935 -11.308
  356   3HD1  LEU  45          2HD1      LEU  45  -5.353  -0.348 -10.270
  357   1HD2  LEU  45          2HD2      LEU  45  -1.601   0.478 -11.503
  358   2HD2  LEU  45          1HD2      LEU  45  -2.206  -0.602 -12.757
  359   3HD2  LEU  45          3HD2      LEU  45  -3.061   0.896 -12.399
  360    H    SER  46           H        SER  46   1.119  -1.208 -11.260
  361    HA   SER  46           HA       SER  46   2.360   0.457  -9.288
  362   1HB   SER  46          2HB       SER  46   3.327   0.779 -12.050
  363   2HB   SER  46          1HB       SER  46   4.204   0.282 -10.606
  364    HG   SER  46           HG       SER  46   3.988  -1.687 -11.239
  365    H    ILE  47           H        ILE  47   2.535   2.724  -9.208
  366    HA   ILE  47           HA       ILE  47   1.019   4.230 -11.287
  367    HB   ILE  47           HB       ILE  47  -0.072   5.577  -9.650
  368   1HG1  ILE  47          2HG1      ILE  47   1.638   4.163  -7.582
  369   2HG1  ILE  47          1HG1      ILE  47   1.823   5.838  -8.102
  370   1HG2  ILE  47          2HG2      ILE  47  -0.677   2.990  -9.949
  371   2HG2  ILE  47          1HG2      ILE  47  -0.260   2.957  -8.235
  372   3HG2  ILE  47          3HG2      ILE  47  -1.546   4.018  -8.809
  373   1HD1  ILE  47          3HD1      ILE  47  -0.468   6.333  -7.320
  374   2HD1  ILE  47          2HD1      ILE  47  -0.638   4.664  -6.777
  375   3HD1  ILE  47          1HD1      ILE  47   0.539   5.726  -6.004
  376    H    ARG  48           H        ARG  48   2.265   5.785 -12.175
  377    HA   ARG  48           HA       ARG  48   4.857   6.436 -10.961
  378   1HB   ARG  48          2HB       ARG  48   4.325   6.205 -13.492
  379   2HB   ARG  48          1HB       ARG  48   3.635   7.821 -13.353
  380   1HG   ARG  48          2HG       ARG  48   6.409   7.219 -12.333
  381   2HG   ARG  48          1HG       ARG  48   6.131   7.637 -14.023
  382   1HD   ARG  48          2HD       ARG  48   4.679   9.485 -12.388
  383   2HD   ARG  48          1HD       ARG  48   6.337   9.401 -11.793
  384    HE   ARG  48           HE       ARG  48   5.940   9.762 -14.712
  385   1HH1  ARG  48          1HH2      ARG  48   8.608  10.273 -13.913
  386   2HH1  ARG  48          2HH2      ARG  48   8.654  11.960 -13.524
  387   1HH2  ARG  48          2HH1      ARG  48   5.213  12.255 -13.217
  388   2HH2  ARG  48          1HH1      ARG  48   6.733  13.082 -13.131
  389    H    ASP  49           H        ASP  49   5.389   8.383 -10.007
  390    HA   ASP  49           HA       ASP  49   3.456  10.601  -9.989
  391   1HB   ASP  49          2HB       ASP  49   3.049   8.793  -8.064
  392   2HB   ASP  49          1HB       ASP  49   4.361   9.683  -7.292
  393    H    TRP  50           H        TRP  50   4.602  12.009  -7.870
  394    HA   TRP  50           HA       TRP  50   7.447  12.069  -7.828
  395   1HB   TRP  50          2HB       TRP  50   7.445  12.680 -10.112
  396   2HB   TRP  50          1HB       TRP  50   6.071  13.760  -9.916
  397    HD1  TRP  50           HD1      TRP  50   9.793  13.742  -9.846
  398    HE1  TRP  50           HE1      TRP  50  10.676  16.030  -9.041
  399    HE3  TRP  50           HE3      TRP  50   5.458  15.784  -8.220
  400    HZ2  TRP  50           HZ2      TRP  50   9.635  18.447  -7.903
  401    HZ3  TRP  50           HZ3      TRP  50   5.398  18.086  -7.288
  402    HH2  TRP  50           HH2      TRP  50   7.485  19.418  -7.129
  403    H    ASP  51           H        ASP  51   8.239  13.985  -6.687
  404    HA   ASP  51           HA       ASP  51   6.124  15.687  -5.466
  405   1HB   ASP  51          2HB       ASP  51   7.184  13.488  -4.144
  406   2HB   ASP  51          1HB       ASP  51   8.144  14.831  -3.526
  407    H    ASP  52           H        ASP  52   7.005  17.656  -4.491
  408    HA   ASP  52           HA       ASP  52   9.420  18.586  -5.902
  409   1HB   ASP  52          2HB       ASP  52   7.075  19.822  -5.256
  410   2HB   ASP  52          1HB       ASP  52   8.119  20.379  -3.948
  411    H    MET  53           H        MET  53  10.151  16.648  -4.057
  412    HA   MET  53           HA       MET  53  11.951  18.175  -2.395
  413   1HB   MET  53          2HB       MET  53  11.215  17.482  -0.240
  414   2HB   MET  53          1HB       MET  53   9.771  18.064  -1.067
  415   1HG   MET  53          2HG       MET  53  10.085  15.301  -1.712
  416   2HG   MET  53          1HG       MET  53  10.255  15.467   0.035
  417   1HE   MET  53          2HE       MET  53   8.403  16.594  -3.038
  418   2HE   MET  53          1HE       MET  53   6.804  17.102  -2.498
  419   3HE   MET  53          3HE       MET  53   8.225  18.083  -2.115
  420    H    LYS  54           H        LYS  54  11.794  15.907  -4.464
  421    HA   LYS  54           HA       LYS  54  14.049  14.468  -3.511
  422   1HB   LYS  54          2HB       LYS  54  12.934  12.215  -3.270
  423   2HB   LYS  54          1HB       LYS  54  12.558  13.362  -1.983
  424   1HG   LYS  54          2HG       LYS  54  10.443  13.938  -3.081
  425   2HG   LYS  54          1HG       LYS  54  10.825  12.859  -4.424
  426   1HD   LYS  54          2HD       LYS  54   9.707  11.277  -3.245
  427   2HD   LYS  54          1HD       LYS  54  11.143  11.218  -2.221
  428   1HE   LYS  54          2HE       LYS  54  10.196  12.772  -0.657
  429   2HE   LYS  54          1HE       LYS  54   8.871  13.164  -1.753
  430   1HZ   LYS  54          2HZ       LYS  54   9.108  10.358  -1.146
  431   2HZ   LYS  54          1HZ       LYS  54   8.759  11.321   0.209
  432   3HZ   LYS  54          3HZ       LYS  54   7.735  11.359  -1.144
  433    H    GLY  55           H        GLY  55  11.343  14.643  -5.765
  434   1HA   GLY  55          2HA       GLY  55  12.131  14.628  -8.162
  435   2HA   GLY  55          1HA       GLY  55  13.022  13.183  -7.707
  436    H    ASP  56           H        ASP  56  11.660  12.265  -9.528
  437    HA   ASP  56           HA       ASP  56   8.811  11.949  -9.057
  438   1HB   ASP  56          2HB       ASP  56   9.118  10.163 -10.900
  439   2HB   ASP  56          1HB       ASP  56   9.470  11.834 -11.332
  440    H    HIS  57           H        HIS  57   8.003   9.518  -9.105
  441    HA   HIS  57           HA       HIS  57   9.637   7.566  -7.724
  442   1HB   HIS  57          2HB       HIS  57   7.763   9.312  -6.208
  443   2HB   HIS  57          1HB       HIS  57   7.710   7.591  -5.831
  444    HD1  HIS  57           HD1      HIS  57   8.794   9.393  -3.661
  445    HD2  HIS  57           HD2      HIS  57  11.234   7.758  -6.619
  446    HE1  HIS  57           HE1      HIS  57  11.149   9.402  -2.731
  447    H    VAL  58           H        VAL  58   7.764   5.848  -6.810
  448    HA   VAL  58           HA       VAL  58   5.440   5.717  -8.551
  449    HB   VAL  58           HB       VAL  58   7.264   5.001 -10.086
  450   1HG1  VAL  58          2HG1      VAL  58   7.863   3.317  -7.740
  451   2HG1  VAL  58          1HG1      VAL  58   7.987   2.508  -9.307
  452   3HG1  VAL  58          3HG1      VAL  58   8.946   3.957  -8.980
  453   1HG2  VAL  58          3HG2      VAL  58   5.311   2.868  -9.190
  454   2HG2  VAL  58          2HG2      VAL  58   5.093   4.035 -10.495
  455   3HG2  VAL  58          1HG2      VAL  58   6.288   2.743 -10.655
  456    H    LYS  59           H        LYS  59   4.017   4.052  -7.883
  457    HA   LYS  59           HA       LYS  59   4.835   2.500  -5.467
  458   1HB   LYS  59          2HB       LYS  59   2.746   4.541  -5.727
  459   2HB   LYS  59          1HB       LYS  59   2.131   3.006  -5.115
  460   1HG   LYS  59          2HG       LYS  59   4.492   3.302  -3.713
  461   2HG   LYS  59          1HG       LYS  59   3.903   4.961  -3.822
  462   1HD   LYS  59          2HD       LYS  59   1.846   4.410  -2.761
  463   2HD   LYS  59          1HD       LYS  59   2.106   2.681  -2.983
  464   1HE   LYS  59          2HE       LYS  59   2.578   3.248  -0.663
  465   2HE   LYS  59          1HE       LYS  59   4.095   2.840  -1.465
  466   1HZ   LYS  59          1HZ       LYS  59   3.503   5.597  -1.766
  467   2HZ   LYS  59          3HZ       LYS  59   3.497   5.173  -0.124
  468   3HZ   LYS  59          2HZ       LYS  59   4.870   4.863  -1.075
  469    H    HIS  60           H        HIS  60   2.399   1.150  -5.142
  470    HA   HIS  60           HA       HIS  60   1.553   0.083  -7.730
  471   1HB   HIS  60          2HB       HIS  60   2.761  -1.978  -5.940
  472   2HB   HIS  60          1HB       HIS  60   2.533  -2.014  -7.684
  473    HD1  HIS  60           HD1      HIS  60   4.366  -0.991  -9.157
  474    HD2  HIS  60           HD2      HIS  60   5.097  -0.522  -5.079
  475    HE1  HIS  60           HE1      HIS  60   6.750  -0.160  -8.947
  476    H    TYR  61           H        TYR  61  -0.307  -1.167  -7.588
  477    HA   TYR  61           HA       TYR  61  -1.449  -1.448  -4.831
  478   1HB   TYR  61          2HB       TYR  61  -2.728  -0.587  -7.417
  479   2HB   TYR  61          1HB       TYR  61  -3.708  -1.387  -6.191
  480    HD1  TYR  61           HD1      TYR  61  -3.880  -0.392  -3.893
  481    HD2  TYR  61           HD2      TYR  61  -1.967   1.667  -7.142
  482    HE1  TYR  61           HE1      TYR  61  -4.040   1.740  -2.637
  483    HE2  TYR  61           HE2      TYR  61  -2.127   3.798  -5.886
  484    HH   TYR  61           HH       TYR  61  -3.116   4.815  -4.112
  485    H    LYS  62           H        LYS  62  -0.841  -3.593  -4.534
  486    HA   LYS  62           HA       LYS  62  -0.789  -5.647  -6.429
  487   1HB   LYS  62          2HB       LYS  62   0.010  -5.746  -4.030
  488   2HB   LYS  62          1HB       LYS  62  -1.660  -6.016  -3.550
  489   1HG   LYS  62          2HG       LYS  62  -0.715  -7.751  -5.740
  490   2HG   LYS  62          1HG       LYS  62   0.116  -7.995  -4.204
  491   1HD   LYS  62          2HD       LYS  62  -2.887  -7.806  -4.289
  492   2HD   LYS  62          1HD       LYS  62  -2.083  -9.330  -4.666
  493   1HE   LYS  62          2HE       LYS  62  -2.253  -9.613  -2.391
  494   2HE   LYS  62          1HE       LYS  62  -0.750  -8.689  -2.412
  495   1HZ   LYS  62          2HZ       LYS  62  -3.346  -7.300  -2.324
  496   2HZ   LYS  62          1HZ       LYS  62  -2.665  -7.923  -0.898
  497   3HZ   LYS  62          3HZ       LYS  62  -1.824  -6.760  -1.800
  498    H    ILE  63           H        ILE  63  -2.440  -6.045  -7.799
  499    HA   ILE  63           HA       ILE  63  -5.232  -5.772  -6.996
  500    HB   ILE  63           HB       ILE  63  -3.817  -6.624  -9.515
  501   1HG1  ILE  63          2HG1      ILE  63  -5.837  -4.626  -9.836
  502   2HG1  ILE  63          1HG1      ILE  63  -4.852  -4.199  -8.438
  503   1HG2  ILE  63          3HG2      ILE  63  -6.766  -6.820  -8.866
  504   2HG2  ILE  63          2HG2      ILE  63  -6.157  -6.746 -10.519
  505   3HG2  ILE  63          1HG2      ILE  63  -5.707  -8.094  -9.474
  506   1HD1  ILE  63          1HD1      ILE  63  -3.008  -5.088 -10.338
  507   2HD1  ILE  63          3HD1      ILE  63  -4.161  -4.122 -11.261
  508   3HD1  ILE  63          2HD1      ILE  63  -3.316  -3.412  -9.885
  509    H    ARG  64           H        ARG  64  -5.955  -7.341  -5.602
  510    HA   ARG  64           HA       ARG  64  -4.993 -10.103  -5.805
  511   1HB   ARG  64          2HB       ARG  64  -6.035  -8.587  -3.739
  512   2HB   ARG  64          1HB       ARG  64  -7.391  -9.623  -4.178
  513   1HG   ARG  64          2HG       ARG  64  -5.988 -10.716  -2.475
  514   2HG   ARG  64          1HG       ARG  64  -5.930 -11.610  -3.994
  515   1HD   ARG  64          2HD       ARG  64  -3.775 -10.773  -4.528
  516   2HD   ARG  64          1HD       ARG  64  -3.886  -9.493  -3.321
  517    HE   ARG  64           HE       ARG  64  -2.715 -11.938  -2.771
  518   1HH1  ARG  64          2HH1      ARG  64  -3.887  -9.544  -0.967
  519   2HH1  ARG  64          1HH1      ARG  64  -4.554 -10.504   0.312
  520   1HH2  ARG  64          1HH2      ARG  64  -4.267 -13.491  -1.425
  521   2HH2  ARG  64          2HH2      ARG  64  -4.769 -12.739   0.052
  522    H    LYS  65           H        LYS  65  -7.152 -11.705  -5.548
  523    HA   LYS  65           HA       LYS  65  -9.180 -10.881  -7.519
  524   1HB   LYS  65          2HB       LYS  65  -7.279 -11.833  -8.848
  525   2HB   LYS  65          1HB       LYS  65  -7.492 -13.354  -7.983
  526   1HG   LYS  65          2HG       LYS  65  -9.848 -13.447  -8.783
  527   2HG   LYS  65          1HG       LYS  65  -9.570 -11.970  -9.707
  528   1HD   LYS  65          2HD       LYS  65  -9.042 -13.455 -11.370
  529   2HD   LYS  65          1HD       LYS  65  -7.471 -13.453 -10.566
  530   1HE   LYS  65          2HE       LYS  65  -9.666 -15.358  -9.740
  531   2HE   LYS  65          1HE       LYS  65  -8.547 -15.751 -11.045
  532   1HZ   LYS  65          3HZ       LYS  65  -6.729 -15.197  -9.410
  533   2HZ   LYS  65          2HZ       LYS  65  -7.922 -15.223  -8.201
  534   3HZ   LYS  65          1HZ       LYS  65  -7.595 -16.624  -9.106
  535    H    LEU  66           H        LEU  66 -11.104 -11.683  -6.965
  536    HA   LEU  66           HA       LEU  66 -11.437 -13.355  -4.639
  537   1HB   LEU  66          2HB       LEU  66 -13.278 -12.374  -6.812
  538   2HB   LEU  66          1HB       LEU  66 -13.840 -13.562  -5.640
  539    HG   LEU  66           HG       LEU  66 -14.449 -11.443  -4.745
  540   1HD1  LEU  66          2HD1      LEU  66 -12.791 -13.128  -3.372
  541   2HD1  LEU  66          1HD1      LEU  66 -11.912 -11.603  -3.244
  542   3HD1  LEU  66          3HD1      LEU  66 -13.574 -11.715  -2.662
  543   1HD2  LEU  66          2HD2      LEU  66 -11.651 -10.618  -5.526
  544   2HD2  LEU  66          1HD2      LEU  66 -13.177  -9.937  -6.085
  545   3HD2  LEU  66          3HD2      LEU  66 -12.645  -9.664  -4.427
  546    H    ASP  67           H        ASP  67 -12.157 -15.539  -4.549
  547    HA   ASP  67           HA       ASP  67 -11.040 -17.239  -6.619
  548   1HB   ASP  67          2HB       ASP  67 -12.221 -17.556  -3.974
  549   2HB   ASP  67          1HB       ASP  67 -12.801 -18.789  -5.091
  550    H    ASN  68           H        ASN  68 -13.980 -15.608  -6.076
  551    HA   ASN  68           HA       ASN  68 -15.544 -17.363  -7.883
  552   1HB   ASN  68          2HB       ASN  68 -16.259 -14.773  -6.467
  553   2HB   ASN  68          1HB       ASN  68 -17.381 -15.759  -7.405
  554   1HD2  ASN  68          2HD2      ASN  68 -16.870 -16.674  -3.576
  555   2HD2  ASN  68          1HD2      ASN  68 -16.513 -15.166  -4.267
  556    H    GLY  69           H        GLY  69 -13.299 -14.941  -8.187
  557   1HA   GLY  69          2HA       GLY  69 -12.616 -14.076 -10.329
  558   2HA   GLY  69          1HA       GLY  69 -14.268 -14.286 -10.890
  559    H    GLY  70           H        GLY  70 -12.207 -12.288  -8.825
  560   1HA   GLY  70          2HA       GLY  70 -13.847  -9.976  -9.433
  561   2HA   GLY  70          1HA       GLY  70 -13.843 -10.429  -7.745
  562    H    TYR  71           H        TYR  71 -11.813  -9.213 -10.395
  563    HA   TYR  71           HA       TYR  71  -9.386  -9.087  -8.822
  564   1HB   TYR  71          2HB       TYR  71 -10.332  -7.752 -11.358
  565   2HB   TYR  71          1HB       TYR  71  -8.858  -7.190 -10.578
  566    HD1  TYR  71           HD1      TYR  71  -7.925  -9.919  -9.501
  567    HD2  TYR  71           HD2      TYR  71  -9.381  -8.664 -13.345
  568    HE1  TYR  71           HE1      TYR  71  -6.669 -11.760 -10.591
  569    HE2  TYR  71           HE2      TYR  71  -8.140 -10.500 -14.426
  570    HH   TYR  71           HH       TYR  71  -7.242 -12.786 -13.710
  571    H    TYR  72           H        TYR  72  -8.956  -7.652  -7.159
  572    HA   TYR  72           HA       TYR  72 -10.253  -4.975  -7.239
  573   1HB   TYR  72          2HB       TYR  72 -11.087  -5.157  -4.962
  574   2HB   TYR  72          1HB       TYR  72 -11.757  -6.472  -5.919
  575    HD1  TYR  72           HD1      TYR  72  -9.346  -5.586  -3.273
  576    HD2  TYR  72           HD2      TYR  72 -11.032  -8.769  -5.593
  577    HE1  TYR  72           HE1      TYR  72  -8.341  -7.223  -1.735
  578    HE2  TYR  72           HE2      TYR  72 -10.023 -10.428  -4.059
  579    HH   TYR  72           HH       TYR  72  -9.269 -10.356  -1.524
  580    H    ILE  73           H        ILE  73  -8.811  -3.413  -6.551
  581    HA   ILE  73           HA       ILE  73  -6.217  -4.269  -5.449
  582    HB   ILE  73           HB       ILE  73  -7.421  -1.593  -6.203
  583   1HG1  ILE  73          2HG1      ILE  73  -4.827  -2.937  -6.997
  584   2HG1  ILE  73          1HG1      ILE  73  -6.328  -3.068  -7.914
  585   1HG2  ILE  73          1HG2      ILE  73  -6.239  -1.271  -4.056
  586   2HG2  ILE  73          3HG2      ILE  73  -4.803  -2.029  -4.742
  587   3HG2  ILE  73          2HG2      ILE  73  -5.382  -0.492  -5.387
  588   1HD1  ILE  73          2HD1      ILE  73  -5.010  -0.429  -7.215
  589   2HD1  ILE  73          1HD1      ILE  73  -4.768  -1.268  -8.747
  590   3HD1  ILE  73          3HD1      ILE  73  -6.372  -0.682  -8.307
  591    H    THR  74           H        THR  74  -9.275  -3.008  -4.473
  592    HA   THR  74           HA       THR  74  -8.472  -3.259  -1.622
  593    HB   THR  74           HB       THR  74  -8.894  -1.050  -1.384
  594    HG1  THR  74           HG1      THR  74 -10.807  -1.034  -0.594
  595   1HG2  THR  74          2HG2      THR  74  -8.748  -0.883  -3.929
  596   2HG2  THR  74          1HG2      THR  74 -10.510  -0.960  -3.935
  597   3HG2  THR  74          3HG2      THR  74  -9.688   0.376  -3.128
  598    H    THR  75           H        THR  75  -9.984  -4.375  -0.398
  599    HA   THR  75           HA       THR  75 -11.713  -6.157  -1.817
  600    HB   THR  75           HB       THR  75 -12.403  -6.935   0.393
  601    HG1  THR  75           HG1      THR  75 -11.744  -5.776   2.210
  602   1HG2  THR  75          2HG2      THR  75  -9.733  -6.646  -0.581
  603   2HG2  THR  75          1HG2      THR  75  -9.693  -6.517   1.181
  604   3HG2  THR  75          3HG2      THR  75 -10.397  -7.944   0.417
  605    H    ARG  76           H        ARG  76 -12.250  -2.938  -1.245
  606    HA   ARG  76           HA       ARG  76 -15.102  -3.128  -0.627
  607   1HB   ARG  76          2HB       ARG  76 -13.436  -1.187  -0.053
  608   2HB   ARG  76          1HB       ARG  76 -13.766  -0.657  -1.702
  609   1HG   ARG  76          2HG       ARG  76 -16.162  -0.573  -1.233
  610   2HG   ARG  76          1HG       ARG  76 -15.894  -1.215   0.387
  611   1HD   ARG  76          2HD       ARG  76 -14.813   0.761   1.114
  612   2HD   ARG  76          1HD       ARG  76 -14.537   1.318  -0.537
  613    HE   ARG  76           HE       ARG  76 -17.329   1.115   0.488
  614   1HH1  ARG  76          2HH1      ARG  76 -16.352   2.318  -2.190
  615   2HH1  ARG  76          1HH1      ARG  76 -16.506   4.008  -1.845
  616   1HH2  ARG  76          1HH2      ARG  76 -16.798   3.554   1.580
  617   2HH2  ARG  76          2HH2      ARG  76 -16.759   4.708   0.289
  618    H    ALA  77           H        ALA  77 -13.170  -3.421  -3.441
  619    HA   ALA  77           HA       ALA  77 -15.592  -3.511  -5.095
  620   1HB   ALA  77          3HB       ALA  77 -13.572  -1.298  -5.354
  621   2HB   ALA  77          2HB       ALA  77 -14.482  -1.847  -6.763
  622   3HB   ALA  77          1HB       ALA  77 -15.331  -1.196  -5.360
  623    H    GLN  78           H        GLN  78 -15.305  -5.199  -6.435
  624    HA   GLN  78           HA       GLN  78 -12.560  -5.815  -7.421
  625   1HB   GLN  78          2HB       GLN  78 -13.896  -8.179  -7.717
  626   2HB   GLN  78          1HB       GLN  78 -12.904  -7.794  -6.316
  627   1HG   GLN  78          2HG       GLN  78 -15.833  -7.086  -6.448
  628   2HG   GLN  78          1HG       GLN  78 -15.271  -8.636  -5.826
  629   1HE2  GLN  78          2HE2      GLN  78 -13.373  -6.793  -3.164
  630   2HE2  GLN  78          1HE2      GLN  78 -12.930  -7.813  -4.445
  631    H    PHE  79           H        PHE  79 -12.894  -7.323  -9.517
  632    HA   PHE  79           HA       PHE  79 -15.203  -6.390 -11.129
  633   1HB   PHE  79          2HB       PHE  79 -12.301  -5.839 -11.787
  634   2HB   PHE  79          1HB       PHE  79 -13.585  -5.778 -12.996
  635    HD1  PHE  79           HD1      PHE  79 -12.632  -4.438  -9.648
  636    HD2  PHE  79           HD2      PHE  79 -14.873  -3.827 -13.256
  637    HE1  PHE  79           HE1      PHE  79 -13.226  -2.165  -8.887
  638    HE2  PHE  79           HE2      PHE  79 -15.470  -1.539 -12.497
  639    HZ   PHE  79           HZ       PHE  79 -14.647  -0.705 -10.310
  640    H    GLU  80           H        GLU  80 -14.534  -7.372 -13.565
  641    HA   GLU  80           HA       GLU  80 -14.177 -10.249 -12.948
  642   1HB   GLU  80          2HB       GLU  80 -15.059 -10.540 -15.295
  643   2HB   GLU  80          1HB       GLU  80 -16.176  -9.727 -14.201
  644   1HG   GLU  80          2HG       GLU  80 -14.482  -7.751 -15.387
  645   2HG   GLU  80          1HG       GLU  80 -15.140  -8.762 -16.672
  646    H    THR  81           H        THR  81 -12.646  -7.564 -14.519
  647    HA   THR  81           HA       THR  81 -10.321  -9.303 -15.124
  648    HB   THR  81           HB       THR  81 -11.041  -9.396 -17.309
  649    HG1  THR  81           HG1      THR  81 -10.471  -6.753 -17.768
  650   1HG2  THR  81          3HG2      THR  81 -13.185  -8.254 -16.635
  651   2HG2  THR  81          2HG2      THR  81 -12.389  -6.722 -16.995
  652   3HG2  THR  81          1HG2      THR  81 -12.644  -7.913 -18.275
  653    H    LEU  82           H        LEU  82  -8.549  -7.704 -16.117
  654    HA   LEU  82           HA       LEU  82  -8.224  -5.598 -14.107
  655   1HB   LEU  82          2HB       LEU  82  -6.391  -6.214 -16.431
  656   2HB   LEU  82          1HB       LEU  82  -5.980  -5.412 -14.913
  657    HG   LEU  82           HG       LEU  82  -7.184  -7.916 -14.272
  658   1HD1  LEU  82          2HD1      LEU  82  -5.431  -7.946 -16.659
  659   2HD1  LEU  82          1HD1      LEU  82  -5.057  -9.145 -15.418
  660   3HD1  LEU  82          3HD1      LEU  82  -6.666  -9.101 -16.141
  661   1HD2  LEU  82          1HD2      LEU  82  -5.129  -6.342 -13.380
  662   2HD2  LEU  82          3HD2      LEU  82  -5.441  -7.986 -12.822
  663   3HD2  LEU  82          2HD2      LEU  82  -4.251  -7.696 -14.091
  664    H    GLN  83           H        GLN  83  -8.873  -5.897 -17.543
  665    HA   GLN  83           HA       GLN  83  -8.613  -3.109 -18.180
  666   1HB   GLN  83          2HB       GLN  83  -8.747  -5.072 -19.820
  667   2HB   GLN  83          1HB       GLN  83 -10.487  -5.057 -19.531
  668   1HG   GLN  83          2HG       GLN  83  -9.462  -2.380 -20.058
  669   2HG   GLN  83          1HG       GLN  83  -9.109  -3.486 -21.386
  670   1HE2  GLN  83          2HE2      GLN  83 -12.631  -4.135 -22.023
  671   2HE2  GLN  83          1HE2      GLN  83 -11.139  -4.943 -21.982
  672    H    GLN  84           H        GLN  84 -11.086  -5.071 -16.709
  673    HA   GLN  84           HA       GLN  84 -13.239  -3.154 -17.032
  674   1HB   GLN  84          2HB       GLN  84 -12.842  -5.725 -15.583
  675   2HB   GLN  84          1HB       GLN  84 -14.181  -4.691 -15.103
  676   1HG   GLN  84          2HG       GLN  84 -14.599  -6.473 -16.960
  677   2HG   GLN  84          1HG       GLN  84 -15.232  -4.853 -17.184
  678   1HE2  GLN  84          2HE2      GLN  84 -13.109  -6.223 -20.140
  679   2HE2  GLN  84          1HE2      GLN  84 -14.118  -7.096 -19.092
  680    H    LEU  85           H        LEU  85 -11.277  -4.150 -14.222
  681    HA   LEU  85           HA       LEU  85 -12.410  -2.055 -12.526
  682   1HB   LEU  85          2HB       LEU  85 -10.959  -2.815 -10.845
  683   2HB   LEU  85          1HB       LEU  85 -11.212  -4.271 -11.806
  684    HG   LEU  85           HG       LEU  85  -9.093  -2.947 -13.065
  685   1HD1  LEU  85          2HD1      LEU  85  -9.056  -2.602 -10.088
  686   2HD1  LEU  85          1HD1      LEU  85  -7.538  -2.945 -10.920
  687   3HD1  LEU  85          3HD1      LEU  85  -8.474  -1.512 -11.347
  688   1HD2  LEU  85          3HD2      LEU  85  -9.457  -5.381 -12.720
  689   2HD2  LEU  85          2HD2      LEU  85  -7.814  -4.871 -12.336
  690   3HD2  LEU  85          1HD2      LEU  85  -8.964  -5.188 -11.037
  691    H    VAL  86           H        VAL  86  -9.848  -2.183 -14.834
  692    HA   VAL  86           HA       VAL  86  -8.709   0.288 -13.805
  693    HB   VAL  86           HB       VAL  86  -7.199   0.216 -15.730
  694   1HG1  VAL  86          2HG1      VAL  86  -7.619  -2.094 -13.952
  695   2HG1  VAL  86          1HG1      VAL  86  -6.681  -2.462 -15.398
  696   3HG1  VAL  86          3HG1      VAL  86  -6.142  -1.194 -14.296
  697   1HG2  VAL  86          2HG2      VAL  86  -9.273  -1.676 -16.707
  698   2HG2  VAL  86          1HG2      VAL  86  -8.309  -0.500 -17.602
  699   3HG2  VAL  86          3HG2      VAL  86  -7.599  -2.041 -17.125
  700    H    GLN  87           H        GLN  87 -11.165  -0.818 -15.877
  701    HA   GLN  87           HA       GLN  87 -11.469   1.535 -17.514
  702   1HB   GLN  87          2HB       GLN  87 -12.418  -0.698 -18.094
  703   2HB   GLN  87          1HB       GLN  87 -13.514  -0.556 -16.731
  704   1HG   GLN  87          2HG       GLN  87 -14.657   1.277 -17.692
  705   2HG   GLN  87          1HG       GLN  87 -13.380   1.563 -18.875
  706   1HE2  GLN  87          2HE2      GLN  87 -16.402  -0.796 -19.928
  707   2HE2  GLN  87          1HE2      GLN  87 -16.452   0.317 -18.648
  708    H    HIS  88           H        HIS  88 -12.885   0.287 -14.547
  709    HA   HIS  88           HA       HIS  88 -14.617   2.585 -14.158
  710   1HB   HIS  88          2HB       HIS  88 -14.836   0.088 -13.329
  711   2HB   HIS  88          1HB       HIS  88 -13.885   0.682 -11.976
  712    HD1  HIS  88           HD1      HIS  88 -17.148   1.386 -13.789
  713    HD2  HIS  88           HD2      HIS  88 -15.328   2.206 -10.128
  714    HE1  HIS  88           HE1      HIS  88 -18.911   2.489 -12.345
  715    H    TYR  89           H        TYR  89 -11.519   1.450 -13.115
  716    HA   TYR  89           HA       TYR  89 -11.144   3.431 -11.031
  717   1HB   TYR  89          2HB       TYR  89  -9.302   1.494 -12.427
  718   2HB   TYR  89          1HB       TYR  89  -8.743   2.600 -11.183
  719    HD1  TYR  89           HD1      TYR  89 -12.138   1.163 -11.109
  720    HD2  TYR  89           HD2      TYR  89  -8.126   0.825  -9.623
  721    HE1  TYR  89           HE1      TYR  89 -12.922  -0.384  -9.386
  722    HE2  TYR  89           HE2      TYR  89  -8.919  -0.737  -7.869
  723    HH   TYR  89           HH       TYR  89 -11.740  -1.016  -6.796
  724    H    SER  90           H        SER  90 -10.614   3.353 -14.466
  725    HA   SER  90           HA       SER  90  -8.818   5.632 -14.448
  726   1HB   SER  90          2HB       SER  90 -10.190   4.007 -16.556
  727   2HB   SER  90          1HB       SER  90  -9.526   5.584 -16.965
  728    HG   SER  90           HG       SER  90  -7.517   4.898 -16.244
  729    H    GLU  91           H        GLU  91 -12.238   5.005 -14.814
  730    HA   GLU  91           HA       GLU  91 -12.801   7.855 -15.377
  731   1HB   GLU  91          2HB       GLU  91 -14.707   5.524 -14.983
  732   2HB   GLU  91          1HB       GLU  91 -15.138   7.129 -15.571
  733   1HG   GLU  91          2HG       GLU  91 -12.985   6.253 -17.184
  734   2HG   GLU  91          1HG       GLU  91 -14.087   4.883 -17.050
  735    H    ARG  92           H        ARG  92 -12.296   5.843 -12.728
  736    HA   ARG  92           HA       ARG  92 -13.322   7.912 -10.889
  737   1HB   ARG  92          2HB       ARG  92 -14.072   5.124 -10.154
  738   2HB   ARG  92          1HB       ARG  92 -14.899   6.638  -9.796
  739   1HG   ARG  92          2HG       ARG  92 -15.630   6.786 -12.160
  740   2HG   ARG  92          1HG       ARG  92 -14.834   5.248 -12.493
  741   1HD   ARG  92          2HD       ARG  92 -16.907   4.401 -12.016
  742   2HD   ARG  92          1HD       ARG  92 -16.337   4.539 -10.353
  743    HE   ARG  92           HE       ARG  92 -18.327   6.281 -11.646
  744   1HH1  ARG  92          1HH2      ARG  92 -17.477   8.487 -10.501
  745   2HH1  ARG  92          2HH2      ARG  92 -17.668   8.366  -8.784
  746   1HH2  ARG  92          2HH1      ARG  92 -17.998   4.915  -8.797
  747   2HH2  ARG  92          1HH1      ARG  92 -17.963   6.344  -7.819
  748    H    ALA  93           H        ALA  93 -12.178   7.845  -8.884
  749    HA   ALA  93           HA       ALA  93  -9.568   6.736  -9.004
  750   1HB   ALA  93          1HB       ALA  93 -10.337   8.661  -7.530
  751   2HB   ALA  93          3HB       ALA  93 -11.006   7.443  -6.442
  752   3HB   ALA  93          2HB       ALA  93  -9.269   7.489  -6.752
  753    H    ALA  94           H        ALA  94 -12.412   5.627  -7.182
  754    HA   ALA  94           HA       ALA  94 -13.008   3.374  -6.725
  755   1HB   ALA  94          2HB       ALA  94 -11.015   2.934  -8.545
  756   2HB   ALA  94          1HB       ALA  94 -10.297   2.253  -7.086
  757   3HB   ALA  94          3HB       ALA  94 -11.850   1.654  -7.668
  758    H    GLY  95           H        GLY  95 -10.033   4.888  -5.628
  759   1HA   GLY  95          2HA       GLY  95 -10.127   5.251  -3.103
  760   2HA   GLY  95          1HA       GLY  95 -10.418   3.519  -3.007
  761    H    LEU  96           H        LEU  96  -8.321   3.762  -5.515
  762    HA   LEU  96           HA       LEU  96  -6.048   3.062  -3.771
  763   1HB   LEU  96          2HB       LEU  96  -4.937   2.649  -6.049
  764   2HB   LEU  96          1HB       LEU  96  -6.306   1.614  -5.641
  765    HG   LEU  96           HG       LEU  96  -7.038   4.138  -6.979
  766   1HD1  LEU  96          2HD1      LEU  96  -5.157   2.153  -8.200
  767   2HD1  LEU  96          1HD1      LEU  96  -6.393   2.893  -9.219
  768   3HD1  LEU  96          3HD1      LEU  96  -5.211   3.905  -8.392
  769   1HD2  LEU  96          3HD2      LEU  96  -8.541   2.170  -6.443
  770   2HD2  LEU  96          2HD2      LEU  96  -8.578   2.694  -8.126
  771   3HD2  LEU  96          1HD2      LEU  96  -7.663   1.258  -7.669
  772    H    SER  97           H        SER  97  -4.859   4.413  -6.625
  773    HA   SER  97           HA       SER  97  -3.910   6.776  -5.130
  774   1HB   SER  97          2HB       SER  97  -2.184   5.616  -6.327
  775   2HB   SER  97          1HB       SER  97  -3.150   5.565  -7.800
  776    HG   SER  97           HG       SER  97  -2.019   7.832  -6.538
  777    H    SER  98           H        SER  98  -6.291   5.867  -7.396
  778    HA   SER  98           HA       SER  98  -8.073   7.215  -8.168
  779   1HB   SER  98          2HB       SER  98  -7.312   8.841  -6.316
  780   2HB   SER  98          1HB       SER  98  -6.459   9.689  -7.605
  781    HG   SER  98           HG       SER  98  -8.888  10.073  -6.995
  782    H    ARG  99           H        ARG  99  -8.412   7.412 -10.302
  783    HA   ARG  99           HA       ARG  99  -8.048   7.842 -12.571
  784   1HB   ARG  99          2HB       ARG  99  -6.024   9.765 -11.399
  785   2HB   ARG  99          1HB       ARG  99  -6.457   9.705 -13.108
  786   1HG   ARG  99          2HG       ARG  99  -8.258  10.370 -10.767
  787   2HG   ARG  99          1HG       ARG  99  -7.826  11.412 -12.123
  788   1HD   ARG  99          2HD       ARG  99  -8.940   9.700 -13.640
  789   2HD   ARG  99          1HD       ARG  99  -9.560   8.929 -12.181
  790    HE   ARG  99           HE       ARG  99 -11.248  10.562 -12.331
  791   1HH1  ARG  99          2HH1      ARG  99  -9.206  12.462 -11.066
  792   2HH1  ARG  99          1HH1      ARG  99  -9.314  13.818 -12.138
  793   1HH2  ARG  99          1HH2      ARG  99 -10.950  12.051 -14.634
  794   2HH2  ARG  99          2HH2      ARG  99 -10.301  13.586 -14.158
  795    H    LEU 100           H        LEU 100  -7.236   5.906 -13.351
  796    HA   LEU 100           HA       LEU 100  -4.492   5.062 -12.829
  797   1HB   LEU 100          2HB       LEU 100  -5.879   3.943 -15.201
  798   2HB   LEU 100          1HB       LEU 100  -5.049   3.112 -13.887
  799    HG   LEU 100           HG       LEU 100  -7.843   4.257 -13.880
  800   1HD1  LEU 100          2HD1      LEU 100  -6.917   1.771 -14.552
  801   2HD1  LEU 100          1HD1      LEU 100  -7.304   1.569 -12.842
  802   3HD1  LEU 100          3HD1      LEU 100  -8.544   2.120 -13.966
  803   1HD2  LEU 100          1HD2      LEU 100  -6.133   4.439 -11.732
  804   2HD2  LEU 100          3HD2      LEU 100  -7.886   4.353 -11.623
  805   3HD2  LEU 100          2HD2      LEU 100  -6.920   2.892 -11.454
  806    H    VAL 101           H        VAL 101  -4.108   4.238 -15.754
  807    HA   VAL 101           HA       VAL 101  -2.325   6.243 -16.544
  808    HB   VAL 101           HB       VAL 101  -2.972   5.358 -18.950
  809   1HG1  VAL 101          3HG1      VAL 101  -1.158   4.622 -17.001
  810   2HG1  VAL 101          2HG1      VAL 101  -1.966   3.099 -17.372
  811   3HG1  VAL 101          1HG1      VAL 101  -1.173   4.013 -18.656
  812   1HG2  VAL 101          1HG2      VAL 101  -5.013   4.216 -17.430
  813   2HG2  VAL 101          3HG2      VAL 101  -4.556   3.757 -19.070
  814   3HG2  VAL 101          2HG2      VAL 101  -3.877   2.893 -17.691
  815    H    VAL 102           H        VAL 102  -3.198   8.320 -16.232
  816    HA   VAL 102           HA       VAL 102  -5.713   9.139 -17.392
  817    HB   VAL 102           HB       VAL 102  -3.551  11.122 -16.800
  818   1HG1  VAL 102          2HG1      VAL 102  -6.521  10.920 -16.731
  819   2HG1  VAL 102          1HG1      VAL 102  -5.764  11.952 -15.518
  820   3HG1  VAL 102          3HG1      VAL 102  -5.497  12.266 -17.232
  821   1HG2  VAL 102          2HG2      VAL 102  -4.883   9.275 -14.822
  822   2HG2  VAL 102          1HG2      VAL 102  -3.176   9.701 -14.949
  823   3HG2  VAL 102          3HG2      VAL 102  -4.336  10.882 -14.343
  824    HA   PRO 103           HA       PRO 103  -2.949  10.999 -20.814
  825   1HB   PRO 103          2HB       PRO 103  -0.316  10.211 -20.888
  826   2HB   PRO 103          1HB       PRO 103  -0.888  11.640 -20.012
  827   1HG   PRO 103          2HG       PRO 103  -0.019   8.995 -18.942
  828   2HG   PRO 103          1HG       PRO 103  -0.011  10.578 -18.153
  829   1HD   PRO 103          2HD       PRO 103  -1.917   8.506 -17.764
  830   2HD   PRO 103          1HD       PRO 103  -2.049  10.176 -17.183
  831    H    SER 104           H        SER 104  -1.151   9.761 -22.574
  832    HA   SER 104           HA       SER 104  -2.124   6.959 -22.844
  833   1HB   SER 104          2HB       SER 104  -2.383   7.487 -25.355
  834   2HB   SER 104          1HB       SER 104  -3.642   8.090 -24.276
  835    HG   SER 104           HG       SER 104  -3.013  10.071 -24.619
  836    H    HIS 105           H        HIS 105  -0.578   5.582 -23.706
  837    HA   HIS 105           HA       HIS 105   2.132   6.109 -23.557
  838   1HB   HIS 105          2HB       HIS 105   2.311   4.333 -25.477
  839   2HB   HIS 105          1HB       HIS 105   1.606   3.856 -23.932
  840    HD1  HIS 105           HD1      HIS 105  -0.436   2.491 -24.314
  841    HD2  HIS 105           HD2      HIS 105  -0.074   5.511 -27.165
  842    HE1  HIS 105           HE1      HIS 105  -2.470   2.308 -25.812
  843    H    LYS 106           HN       LYS 106  -0.068   7.081 -26.093
  844    HA   LYS 106           HA       LYS 106   1.530   7.569 -28.280
  845   1HB   LYS 106          2HB       LYS 106  -0.870   8.767 -27.164
  846   2HB   LYS 106          1HB       LYS 106   0.117   9.973 -27.990
  847   1HG   LYS 106          2HG       LYS 106   0.286   8.259 -29.908
  848   2HG   LYS 106          1HG       LYS 106  -1.040   7.415 -29.108
  849   1HD   LYS 106          2HD       LYS 106  -2.353   9.557 -29.171
  850   2HD   LYS 106          1HD       LYS 106  -1.055  10.272 -30.127
  851   1HE   LYS 106          2HE       LYS 106  -1.434   8.062 -31.588
  852   2HE   LYS 106          1HE       LYS 106  -3.051   8.186 -30.893
  853   1HZ   LYS 106          2HZ       LYS 106  -3.053  10.547 -31.635
  854   2HZ   LYS 106          1HZ       LYS 106  -1.611  10.236 -32.480
  855   3HZ   LYS 106          3HZ       LYS 106  -3.034   9.417 -32.903
  856   1H    GLU 201          2HT       GLU 201   7.543  -2.760   5.903
  857   2H    GLU 201          1HT       GLU 201   8.839  -3.683   6.501
  858   3H    GLU 201          3HT       GLU 201   9.144  -2.304   5.562
  859    HA   GLU 201           HA       GLU 201   9.485  -4.091   4.110
  860   1HB   GLU 201          2HB       GLU 201   7.282  -5.232   5.703
  861   2HB   GLU 201          1HB       GLU 201   7.187  -5.590   3.978
  862   1HG   GLU 201          2HG       GLU 201   9.697  -6.204   4.176
  863   2HG   GLU 201          1HG       GLU 201   9.400  -6.259   5.914
  864    HA   PRO 202           HA       PRO 202   7.097  -2.093   1.020
  865   1HB   PRO 202          2HB       PRO 202   7.067  -4.000  -0.960
  866   2HB   PRO 202          1HB       PRO 202   8.499  -3.042  -0.545
  867   1HG   PRO 202          2HG       PRO 202   7.910  -5.900   0.070
  868   2HG   PRO 202          1HG       PRO 202   9.475  -5.092  -0.114
  869   1HD   PRO 202          2HD       PRO 202   8.244  -5.782   2.341
  870   2HD   PRO 202          1HD       PRO 202   9.633  -4.692   2.138
  871    H    GLN 203           H        GLN 203   5.000  -2.025   2.075
  872    HA   GLN 203           HA       GLN 203   3.173  -4.299   1.468
  873   1HB   GLN 203          2HB       GLN 203   2.961  -1.977   3.403
  874   2HB   GLN 203          1HB       GLN 203   1.642  -3.107   3.096
  875   1HG   GLN 203          2HG       GLN 203   4.013  -4.632   3.565
  876   2HG   GLN 203          1HG       GLN 203   3.867  -3.439   4.856
  877   1HE2  GLN 203          2HE2      GLN 203   0.758  -6.106   4.392
  878   2HE2  GLN 203          1HE2      GLN 203   1.619  -5.602   3.019
  879   1HN   PTR 204          1HN       PTR 204   1.707  -4.058  -0.150
  880    HA   PTR 204           HA       PTR 204   1.617  -1.752  -1.815
  881   1HB   PTR 204          1HB       PTR 204  -0.533  -2.799  -2.680
  882    HD1  PTR 204           HD1      PTR 204   1.031  -2.613  -4.559
  883    HD2  PTR 204           HD2      PTR 204   1.472  -5.678  -1.580
  884    HE1  PTR 204           HE1      PTR 204   2.622  -3.823  -6.031
  885    HE2  PTR 204           HE2      PTR 204   3.065  -6.880  -3.048
  886    H    GLU 205           H        GLU 205  -0.089  -0.163  -2.044
  887    HA   GLU 205           HA       GLU 205  -1.081   0.822   0.494
  888   1HB   GLU 205          2HB       GLU 205  -1.540   1.653  -2.379
  889   2HB   GLU 205          1HB       GLU 205  -2.317   2.472  -1.023
  890   1HG   GLU 205          2HG       GLU 205   0.589   2.059  -0.703
  891   2HG   GLU 205          1HG       GLU 205   0.142   3.147  -2.017
  892    H    GLU 206           H        GLU 206  -2.912   0.142   1.493
  893    HA   GLU 206           HA       GLU 206  -4.995  -1.199  -0.182
  894   1HB   GLU 206          2HB       GLU 206  -3.886  -1.739   2.520
  895   2HB   GLU 206          1HB       GLU 206  -5.628  -1.948   2.342
  896   1HG   GLU 206          2HG       GLU 206  -5.041  -3.291   0.204
  897   2HG   GLU 206          1HG       GLU 206  -3.410  -3.362   0.870
  898    H    ILE 207           H        ILE 207  -7.261  -0.955   0.833
  899    HA   ILE 207           HA       ILE 207  -7.571   1.811   1.928
  900    HB   ILE 207           HB       ILE 207  -9.167   0.388  -0.213
  901   1HG1  ILE 207          2HG1      ILE 207  -8.721   2.981  -0.992
  902   2HG1  ILE 207          1HG1      ILE 207  -7.265   2.640  -0.057
  903   1HG2  ILE 207          1HG2      ILE 207  -9.897   2.767   1.504
  904   2HG2  ILE 207          3HG2      ILE 207 -10.618   2.502  -0.083
  905   3HG2  ILE 207          2HG2      ILE 207 -10.848   1.313   1.200
  906   1HD1  ILE 207          3HD1      ILE 207  -8.197   0.571  -2.003
  907   2HD1  ILE 207          2HD1      ILE 207  -7.412   2.014  -2.641
  908   3HD1  ILE 207          1HD1      ILE 207  -6.557   0.976  -1.500
  909    HA   PRO 208           HA       PRO 208  -9.593  -1.077   4.830
  910   1HB   PRO 208          2HB       PRO 208  -8.722   0.264   7.067
  911   2HB   PRO 208          1HB       PRO 208  -7.779  -0.996   6.250
  912   1HG   PRO 208          2HG       PRO 208  -7.382   1.960   6.227
  913   2HG   PRO 208          1HG       PRO 208  -6.195   0.667   5.990
  914   1HD   PRO 208          2HD       PRO 208  -7.370   2.232   3.944
  915   2HD   PRO 208          1HD       PRO 208  -6.445   0.734   3.712
  916    H    ILE 209           H        ILE 209 -10.830  -0.120   7.034
  917    HA   ILE 209           HA       ILE 209 -12.177   2.432   6.375
  918    HB   ILE 209           HB       ILE 209 -13.508   0.700   5.210
  919   1HG1  ILE 209          2HG1      ILE 209 -15.243   1.287   7.540
  920   2HG1  ILE 209          1HG1      ILE 209 -14.438   2.687   6.831
  921   1HG2  ILE 209          3HG2      ILE 209 -13.199  -0.619   7.851
  922   2HG2  ILE 209          2HG2      ILE 209 -14.787  -0.770   7.097
  923   3HG2  ILE 209          1HG2      ILE 209 -13.349  -1.334   6.245
  924   1HD1  ILE 209          1HD1      ILE 209 -15.597   0.814   4.866
  925   2HD1  ILE 209          3HD1      ILE 209 -16.779   1.627   5.893
  926   3HD1  ILE 209          2HD1      ILE 209 -15.660   2.576   4.915
  927    H    TYR 210           H        TYR 210 -10.506   0.912   8.551
  928    HA   TYR 210           HA       TYR 210 -12.244   0.930  10.881
  929   1HB   TYR 210          2HB       TYR 210  -9.268   1.127  11.129
  930   2HB   TYR 210          1HB       TYR 210 -10.407   0.137  12.036
  931    HD1  TYR 210           HD1      TYR 210 -11.827  -1.523  10.362
  932    HD2  TYR 210           HD2      TYR 210  -7.832  -0.067   9.745
  933    HE1  TYR 210           HE1      TYR 210 -11.356  -3.447   8.870
  934    HE2  TYR 210           HE2      TYR 210  -7.362  -1.992   8.253
  935    HH   TYR 210           HH       TYR 210  -9.100  -4.715   8.164
  936    H    LEU 211           HN       LEU 211 -10.965   2.290  12.834
  937    HA   LEU 211           HA       LEU 211 -10.567   5.066  11.829
  938   1HB   LEU 211          2HB       LEU 211 -12.941   4.223  13.017
  939   2HB   LEU 211          1HB       LEU 211 -12.056   4.976  14.343
  940    HG   LEU 211           HG       LEU 211 -12.678   6.228  11.652
  941   1HD1  LEU 211          1HD1      LEU 211 -13.614   6.774  14.483
  942   2HD1  LEU 211          3HD1      LEU 211 -13.900   7.869  13.130
  943   3HD1  LEU 211          2HD1      LEU 211 -14.601   6.251  13.119
  944   1HD2  LEU 211          2HD2      LEU 211 -10.391   6.731  12.797
  945   2HD2  LEU 211          1HD2      LEU 211 -11.389   8.093  12.287
  946   3HD2  LEU 211          3HD2      LEU 211 -11.357   7.608  13.982
   
  No H/Q in entry =         946
  Start of MODEL   18
    1   1H    SER   1          1HT       SER   1  -8.432  -8.936 -23.943
    2   2H    SER   1          3HT       SER   1  -9.952  -8.930 -23.191
    3   3H    SER   1          2HT       SER   1  -9.838  -9.162 -24.870
    4    HA   SER   1           HA       SER   1  -9.327  -6.966 -25.299
    5   1HB   SER   1          2HB       SER   1 -11.054  -6.723 -22.828
    6   2HB   SER   1          1HB       SER   1 -11.089  -5.721 -24.279
    7    HG   SER   1           HG       SER   1 -12.611  -7.711 -23.853
    8    H    ILE   2           H        ILE   2  -8.423  -8.015 -22.114
    9    HA   ILE   2           HA       ILE   2  -7.586  -5.728 -20.805
   10    HB   ILE   2           HB       ILE   2  -7.181  -7.790 -19.711
   11   1HG1  ILE   2          2HG1      ILE   2  -4.337  -7.502 -20.307
   12   2HG1  ILE   2          1HG1      ILE   2  -5.115  -5.944 -20.036
   13   1HG2  ILE   2          1HG2      ILE   2  -5.511  -8.542 -22.125
   14   2HG2  ILE   2          3HG2      ILE   2  -5.661  -9.517 -20.662
   15   3HG2  ILE   2          2HG2      ILE   2  -7.073  -9.227 -21.677
   16   1HD1  ILE   2          2HD1      ILE   2  -6.043  -7.919 -18.121
   17   2HD1  ILE   2          1HD1      ILE   2  -4.288  -7.769 -18.068
   18   3HD1  ILE   2          3HD1      ILE   2  -5.303  -6.348 -17.822
   19    H    GLN   3           H        GLN   3  -6.882  -4.038 -22.118
   20    HA   GLN   3           HA       GLN   3  -5.161  -4.125 -24.311
   21   1HB   GLN   3          2HB       GLN   3  -4.954  -1.936 -22.248
   22   2HB   GLN   3          1HB       GLN   3  -4.830  -1.811 -24.001
   23   1HG   GLN   3          2HG       GLN   3  -7.310  -2.767 -23.901
   24   2HG   GLN   3          1HG       GLN   3  -7.270  -2.053 -22.289
   25   1HE2  GLN   3          2HE2      GLN   3  -7.795   0.352 -25.444
   26   2HE2  GLN   3          1HE2      GLN   3  -7.946  -1.336 -25.519
   27    H    ALA   4           H        ALA   4  -4.345  -4.133 -20.878
   28    HA   ALA   4           HA       ALA   4  -2.247  -4.324 -19.811
   29   1HB   ALA   4          2HB       ALA   4  -2.835  -6.594 -21.050
   30   2HB   ALA   4          1HB       ALA   4  -1.420  -6.161 -22.009
   31   3HB   ALA   4          3HB       ALA   4  -1.273  -6.362 -20.265
   32    H    GLU   5           H        GLU   5  -1.840  -2.064 -20.705
   33    HA   GLU   5           HA       GLU   5   0.817  -2.006 -21.887
   34   1HB   GLU   5          2HB       GLU   5  -1.591  -1.156 -23.495
   35   2HB   GLU   5          1HB       GLU   5   0.000  -0.450 -23.787
   36   1HG   GLU   5          2HG       GLU   5   0.817  -2.924 -23.883
   37   2HG   GLU   5          1HG       GLU   5  -0.887  -3.309 -24.124
   38    H    GLU   6           H        GLU   6  -2.108  -0.101 -21.135
   39    HA   GLU   6           HA       GLU   6  -0.348   2.160 -20.332
   40   1HB   GLU   6          2HB       GLU   6  -3.366   2.142 -20.538
   41   2HB   GLU   6          1HB       GLU   6  -2.308   3.550 -20.441
   42   1HG   GLU   6          2HG       GLU   6  -1.223   2.583 -22.608
   43   2HG   GLU   6          1HG       GLU   6  -2.713   1.649 -22.741
   44    H    TRP   7           H        TRP   7  -3.207   0.418 -19.087
   45    HA   TRP   7           HA       TRP   7  -2.479   1.308 -16.357
   46   1HB   TRP   7          2HB       TRP   7  -4.718   0.188 -15.793
   47   2HB   TRP   7          1HB       TRP   7  -4.793   1.641 -16.789
   48    HD1  TRP   7           HD1      TRP   7  -5.710   1.423 -19.201
   49    HE1  TRP   7           HE1      TRP   7  -6.715  -0.522 -20.563
   50    HE3  TRP   7           HE3      TRP   7  -4.523  -2.495 -16.149
   51    HZ2  TRP   7           HZ2      TRP   7  -6.981  -3.365 -20.380
   52    HZ3  TRP   7           HZ3      TRP   7  -5.163  -4.808 -16.767
   53    HH2  TRP   7           HH2      TRP   7  -6.390  -5.247 -18.875
   54    H    TYR   8           H        TYR   8  -1.818  -1.251 -18.376
   55    HA   TYR   8           HA       TYR   8  -1.042  -2.948 -16.091
   56   1HB   TYR   8          2HB       TYR   8  -3.158  -3.900 -16.470
   57   2HB   TYR   8          1HB       TYR   8  -3.023  -3.740 -18.217
   58    HD1  TYR   8           HD1      TYR   8  -0.403  -5.006 -15.896
   59    HD2  TYR   8           HD2      TYR   8  -3.320  -6.007 -18.881
   60    HE1  TYR   8           HE1      TYR   8   0.505  -7.309 -16.021
   61    HE2  TYR   8           HE2      TYR   8  -2.408  -8.306 -19.008
   62    HH   TYR   8           HH       TYR   8  -0.131  -9.407 -18.502
   63    H    PHE   9           H        PHE   9   1.093  -2.652 -16.615
   64    HA   PHE   9           HA       PHE   9   2.193  -2.698 -19.236
   65   1HB   PHE   9          2HB       PHE   9   3.283  -2.996 -16.466
   66   2HB   PHE   9          1HB       PHE   9   4.331  -3.368 -17.835
   67    HD1  PHE   9           HD1      PHE   9   1.600  -0.902 -18.093
   68    HD2  PHE   9           HD2      PHE   9   5.814  -1.454 -17.438
   69    HE1  PHE   9           HE1      PHE   9   1.977   1.520 -18.460
   70    HE2  PHE   9           HE2      PHE   9   6.187   0.970 -17.807
   71    HZ   PHE   9           HZ       PHE   9   4.269   2.457 -18.318
   72    H    GLY  10           H        GLY  10   1.678  -5.326 -16.901
   73   1HA   GLY  10          2HA       GLY  10   1.215  -7.479 -18.341
   74   2HA   GLY  10          1HA       GLY  10   2.865  -7.202 -18.883
   75    H    LYS  11           H        LYS  11   3.488  -9.235 -17.945
   76    HA   LYS  11           HA       LYS  11   3.366  -9.435 -15.005
   77   1HB   LYS  11          2HB       LYS  11   4.511 -11.484 -16.910
   78   2HB   LYS  11          1HB       LYS  11   3.926 -11.739 -15.265
   79   1HG   LYS  11          2HG       LYS  11   1.800 -12.007 -15.981
   80   2HG   LYS  11          1HG       LYS  11   1.877 -10.537 -16.954
   81   1HD   LYS  11          2HD       LYS  11   3.255 -13.059 -17.866
   82   2HD   LYS  11          1HD       LYS  11   1.538 -12.812 -18.178
   83   1HE   LYS  11          2HE       LYS  11   2.190 -10.543 -19.165
   84   2HE   LYS  11          1HE       LYS  11   3.859 -11.111 -19.110
   85   1HZ   LYS  11          2HZ       LYS  11   3.079 -13.094 -20.388
   86   2HZ   LYS  11          1HZ       LYS  11   1.594 -12.298 -20.609
   87   3HZ   LYS  11          3HZ       LYS  11   3.016 -11.626 -21.242
   88    H    LEU  12           H        LEU  12   4.839  -7.549 -15.034
   89    HA   LEU  12           HA       LEU  12   7.670  -8.358 -15.520
   90   1HB   LEU  12          2HB       LEU  12   8.045  -6.283 -16.345
   91   2HB   LEU  12          1HB       LEU  12   6.297  -6.138 -16.424
   92    HG   LEU  12           HG       LEU  12   8.152  -5.086 -14.289
   93   1HD1  LEU  12          2HD1      LEU  12   6.076  -3.854 -16.121
   94   2HD1  LEU  12          1HD1      LEU  12   6.890  -2.970 -14.826
   95   3HD1  LEU  12          3HD1      LEU  12   7.822  -3.610 -16.183
   96   1HD2  LEU  12          3HD2      LEU  12   5.492  -6.087 -13.924
   97   2HD2  LEU  12          2HD2      LEU  12   6.586  -5.340 -12.748
   98   3HD2  LEU  12          1HD2      LEU  12   5.503  -4.331 -13.710
   99    H    GLY  13           H        GLY  13   8.991  -6.614 -13.857
  100   1HA   GLY  13          2HA       GLY  13   8.173  -7.651 -11.191
  101   2HA   GLY  13          1HA       GLY  13   9.782  -7.057 -11.600
  102    H    ARG  14           H        ARG  14   8.075  -6.172  -9.371
  103    HA   ARG  14           HA       ARG  14   6.812  -3.668  -9.930
  104   1HB   ARG  14          2HB       ARG  14   7.016  -3.240  -7.541
  105   2HB   ARG  14          1HB       ARG  14   6.616  -4.941  -7.775
  106   1HG   ARG  14          2HG       ARG  14   8.386  -5.231  -6.343
  107   2HG   ARG  14          1HG       ARG  14   9.306  -5.114  -7.843
  108   1HD   ARG  14          2HD       ARG  14  10.407  -3.415  -6.818
  109   2HD   ARG  14          1HD       ARG  14   8.961  -2.464  -7.158
  110    HE   ARG  14           HE       ARG  14   8.651  -3.928  -4.693
  111   1HH1  ARG  14          2HH1      ARG  14   8.376  -0.897  -5.727
  112   2HH1  ARG  14          1HH1      ARG  14   9.273  -0.122  -4.463
  113   1HH2  ARG  14          1HH2      ARG  14  10.606  -3.078  -3.234
  114   2HH2  ARG  14          2HH2      ARG  14  10.535  -1.357  -3.053
  115    H    LYS  15           H        LYS  15  10.104  -4.626  -9.741
  116    HA   LYS  15           HA       LYS  15  11.223  -2.013  -9.253
  117   1HB   LYS  15          2HB       LYS  15  12.478  -4.508 -10.424
  118   2HB   LYS  15          1HB       LYS  15  13.362  -3.084  -9.870
  119   1HG   LYS  15          2HG       LYS  15  12.112  -3.476  -7.615
  120   2HG   LYS  15          1HG       LYS  15  11.820  -5.097  -8.242
  121   1HD   LYS  15          2HD       LYS  15  14.095  -5.640  -8.267
  122   2HD   LYS  15          1HD       LYS  15  14.597  -3.951  -8.323
  123   1HE   LYS  15          2HE       LYS  15  13.033  -4.596  -5.929
  124   2HE   LYS  15          1HE       LYS  15  14.523  -5.531  -6.046
  125   1HZ   LYS  15          1HZ       LYS  15  15.213  -2.981  -6.784
  126   2HZ   LYS  15          3HZ       LYS  15  14.174  -2.769  -5.462
  127   3HZ   LYS  15          2HZ       LYS  15  15.561  -3.736  -5.303
  128    H    ASP  16           H        ASP  16  10.225  -3.895 -12.017
  129    HA   ASP  16           HA       ASP  16  11.569  -2.315 -13.986
  130   1HB   ASP  16          2HB       ASP  16  10.281  -4.715 -13.962
  131   2HB   ASP  16          1HB       ASP  16   9.065  -3.672 -14.654
  132    H    ALA  17           H        ALA  17   8.570  -2.178 -12.228
  133    HA   ALA  17           HA       ALA  17   7.243  -0.280 -13.935
  134   1HB   ALA  17          2HB       ALA  17   6.829  -0.974 -11.019
  135   2HB   ALA  17          1HB       ALA  17   5.749   0.058 -11.958
  136   3HB   ALA  17          3HB       ALA  17   5.947  -1.640 -12.395
  137    H    GLU  18           H        GLU  18   9.126   0.018 -10.938
  138    HA   GLU  18           HA       GLU  18   8.931   2.895 -10.826
  139   1HB   GLU  18          2HB       GLU  18  10.751   2.750  -9.192
  140   2HB   GLU  18          1HB       GLU  18   9.581   1.471  -8.875
  141   1HG   GLU  18          2HG       GLU  18  11.085  -0.154  -9.323
  142   2HG   GLU  18          1HG       GLU  18  11.642   0.659 -10.785
  143    H    ARG  19           H        ARG  19  10.846   0.682 -12.622
  144    HA   ARG  19           HA       ARG  19  12.878   2.693 -13.336
  145   1HB   ARG  19          2HB       ARG  19  13.104   0.048 -13.131
  146   2HB   ARG  19          1HB       ARG  19  12.597   0.111 -14.819
  147   1HG   ARG  19          2HG       ARG  19  14.971   0.236 -14.892
  148   2HG   ARG  19          1HG       ARG  19  14.424   1.896 -15.125
  149   1HD   ARG  19          2HD       ARG  19  14.958   2.503 -12.899
  150   2HD   ARG  19          1HD       ARG  19  15.060   0.821 -12.376
  151    HE   ARG  19           HE       ARG  19  17.035   1.161 -14.358
  152   1HH1  ARG  19          2HH1      ARG  19  16.301   3.278 -11.828
  153   2HH1  ARG  19          1HH1      ARG  19  17.879   3.236 -11.115
  154   1HH2  ARG  19          1HH2      ARG  19  19.044   0.720 -13.197
  155   2HH2  ARG  19          2HH2      ARG  19  19.431   1.788 -11.889
  156    H    GLN  20           H        GLN  20   9.879   1.441 -14.605
  157    HA   GLN  20           HA       GLN  20  10.361   2.529 -17.294
  158   1HB   GLN  20          2HB       GLN  20   7.963   1.230 -15.977
  159   2HB   GLN  20          1HB       GLN  20   7.930   1.856 -17.626
  160   1HG   GLN  20          2HG       GLN  20  10.258   0.151 -17.074
  161   2HG   GLN  20          1HG       GLN  20   8.718  -0.694 -16.912
  162   1HE2  GLN  20          1HE2      GLN  20  10.887  -0.731 -19.122
  163   2HE2  GLN  20          2HE2      GLN  20  10.011  -0.461 -20.551
  164    H    LEU  21           H        LEU  21   8.828   3.491 -14.305
  165    HA   LEU  21           HA       LEU  21   7.422   5.744 -15.564
  166   1HB   LEU  21          2HB       LEU  21   7.684   4.681 -12.765
  167   2HB   LEU  21          1HB       LEU  21   7.080   6.317 -13.028
  168    HG   LEU  21           HG       LEU  21   5.239   5.528 -14.336
  169   1HD1  LEU  21          1HD1      LEU  21   6.567   3.824 -15.599
  170   2HD1  LEU  21          3HD1      LEU  21   6.486   2.765 -14.192
  171   3HD1  LEU  21          2HD1      LEU  21   5.009   3.206 -15.049
  172   1HD2  LEU  21          3HD2      LEU  21   5.389   5.009 -11.733
  173   2HD2  LEU  21          2HD2      LEU  21   4.026   4.432 -12.692
  174   3HD2  LEU  21          1HD2      LEU  21   5.350   3.338 -12.296
  175    H    LEU  22           H        LEU  22  10.093   5.339 -13.235
  176    HA   LEU  22           HA       LEU  22  10.774   8.145 -13.235
  177   1HB   LEU  22          2HB       LEU  22  12.554   5.797 -12.521
  178   2HB   LEU  22          1HB       LEU  22  12.763   7.472 -12.013
  179    HG   LEU  22           HG       LEU  22  10.591   5.533 -11.195
  180   1HD1  LEU  22          1HD1      LEU  22  13.019   6.245 -10.059
  181   2HD1  LEU  22          3HD1      LEU  22  11.864   7.270  -9.208
  182   3HD1  LEU  22          2HD1      LEU  22  11.662   5.518  -9.200
  183   1HD2  LEU  22          2HD2      LEU  22   9.597   7.743 -11.838
  184   2HD2  LEU  22          1HD2      LEU  22   9.429   7.379 -10.120
  185   3HD2  LEU  22          3HD2      LEU  22  10.663   8.517 -10.664
  186    H    SER  23           H        SER  23  11.886   5.342 -15.108
  187    HA   SER  23           HA       SER  23  14.176   6.364 -16.324
  188   1HB   SER  23          2HB       SER  23  13.611   4.177 -16.969
  189   2HB   SER  23          1HB       SER  23  11.952   4.624 -17.368
  190    HG   SER  23           HG       SER  23  14.253   4.808 -18.869
  191    H    PHE  24           H        PHE  24  11.132   6.438 -18.170
  192    HA   PHE  24           HA       PHE  24  10.999   9.275 -18.469
  193   1HB   PHE  24          2HB       PHE  24  13.172   8.299 -19.818
  194   2HB   PHE  24          1HB       PHE  24  11.930   8.227 -21.069
  195    HD1  PHE  24           HD1      PHE  24  10.201  10.510 -20.288
  196    HD2  PHE  24           HD2      PHE  24  14.481  10.175 -20.418
  197    HE1  PHE  24           HE1      PHE  24  10.384  12.963 -20.610
  198    HE2  PHE  24           HE2      PHE  24  14.664  12.627 -20.741
  199    HZ   PHE  24           HZ       PHE  24  12.614  14.020 -20.837
  200    H    GLY  25           H        GLY  25   8.934   9.638 -19.127
  201   1HA   GLY  25          2HA       GLY  25   7.624   8.554 -21.342
  202   2HA   GLY  25          1HA       GLY  25   7.258   7.457 -20.013
  203    H    ASN  26           H        ASN  26   6.096   8.316 -18.174
  204    HA   ASN  26           HA       ASN  26   4.792  10.958 -18.672
  205   1HB   ASN  26          2HB       ASN  26   3.271   8.695 -17.410
  206   2HB   ASN  26          1HB       ASN  26   2.655  10.104 -18.274
  207   1HD2  ASN  26          2HD2      ASN  26   3.726   8.594 -21.504
  208   2HD2  ASN  26          1HD2      ASN  26   4.035  10.043 -20.676
  209    HA   PRO  27           HA       PRO  27   5.919  11.684 -14.480
  210   1HB   PRO  27          2HB       PRO  27   4.286  13.851 -14.041
  211   2HB   PRO  27          1HB       PRO  27   5.786  13.928 -14.979
  212   1HG   PRO  27          2HG       PRO  27   2.956  13.950 -15.936
  213   2HG   PRO  27          1HG       PRO  27   4.397  14.640 -16.695
  214   1HD   PRO  27          2HD       PRO  27   3.135  12.205 -17.417
  215   2HD   PRO  27          1HD       PRO  27   4.746  12.740 -17.940
  216    H    ARG  28           H        ARG  28   4.163  12.745 -12.525
  217    HA   ARG  28           HA       ARG  28   2.968  10.529 -11.368
  218   1HB   ARG  28          2HB       ARG  28   1.559  12.084 -10.088
  219   2HB   ARG  28          1HB       ARG  28   3.193  12.730 -10.245
  220   1HG   ARG  28          2HG       ARG  28   2.305  13.956 -12.337
  221   2HG   ARG  28          1HG       ARG  28   0.697  13.565 -11.726
  222   1HD   ARG  28          2HD       ARG  28   2.572  14.715  -9.739
  223   2HD   ARG  28          1HD       ARG  28   2.062  15.810 -11.024
  224    HE   ARG  28           HE       ARG  28  -0.297  14.623 -10.141
  225   1HH1  ARG  28          2HH1      ARG  28   1.877  17.090  -9.346
  226   2HH1  ARG  28          1HH1      ARG  28   1.117  17.500  -7.845
  227   1HH2  ARG  28          1HH2      ARG  28  -1.106  14.841  -7.938
  228   2HH2  ARG  28          2HH2      ARG  28  -0.572  16.228  -7.047
  229    H    GLY  29           H        GLY  29   0.922   9.532 -11.485
  230   1HA   GLY  29          2HA       GLY  29  -1.416   9.547 -12.270
  231   2HA   GLY  29          1HA       GLY  29  -0.891  10.516 -13.646
  232    H    THR  30           H        THR  30   1.464   8.225 -13.111
  233    HA   THR  30           HA       THR  30   0.463   6.608 -15.379
  234    HB   THR  30           HB       THR  30   3.051   6.025 -13.986
  235    HG1  THR  30           HG1      THR  30   2.325   8.386 -15.258
  236   1HG2  THR  30          1HG2      THR  30   1.954   4.935 -16.139
  237   2HG2  THR  30          3HG2      THR  30   2.652   6.347 -16.933
  238   3HG2  THR  30          2HG2      THR  30   3.692   5.221 -16.060
  239    H    PHE  31           H        PHE  31  -1.299   5.704 -13.981
  240    HA   PHE  31           HA       PHE  31  -0.411   3.793 -11.912
  241   1HB   PHE  31          2HB       PHE  31  -3.108   4.767 -12.851
  242   2HB   PHE  31          1HB       PHE  31  -2.943   3.423 -11.720
  243    HD1  PHE  31           HD1      PHE  31  -1.271   6.759 -12.181
  244    HD2  PHE  31           HD2      PHE  31  -3.262   4.054  -9.502
  245    HE1  PHE  31           HE1      PHE  31  -0.951   8.365 -10.320
  246    HE2  PHE  31           HE2      PHE  31  -2.941   5.660  -7.642
  247    HZ   PHE  31           HZ       PHE  31  -1.785   7.817  -8.050
  248    H    LEU  32           H        LEU  32   0.676   2.279 -13.355
  249    HA   LEU  32           HA       LEU  32  -0.981   0.905 -15.368
  250   1HB   LEU  32          2HB       LEU  32   1.079  -0.308 -15.916
  251   2HB   LEU  32          1HB       LEU  32   1.397   1.426 -15.853
  252    HG   LEU  32           HG       LEU  32   1.986   0.944 -13.338
  253   1HD1  LEU  32          3HD1      LEU  32   1.904  -1.763 -14.616
  254   2HD1  LEU  32          2HD1      LEU  32   3.161  -1.435 -13.423
  255   3HD1  LEU  32          1HD1      LEU  32   1.462  -1.287 -12.976
  256   1HD2  LEU  32          3HD2      LEU  32   3.771   0.082 -15.635
  257   2HD2  LEU  32          2HD2      LEU  32   3.604   1.723 -15.013
  258   3HD2  LEU  32          1HD2      LEU  32   4.332   0.470 -14.009
  259    H    ILE  33           H        ILE  33  -0.145  -1.672 -15.219
  260    HA   ILE  33           HA       ILE  33  -0.718  -2.653 -12.470
  261    HB   ILE  33           HB       ILE  33  -2.361  -3.180 -14.944
  262   1HG1  ILE  33          2HG1      ILE  33  -2.925  -2.645 -12.024
  263   2HG1  ILE  33          1HG1      ILE  33  -3.269  -1.591 -13.395
  264   1HG2  ILE  33          3HG2      ILE  33  -1.556  -5.401 -14.212
  265   2HG2  ILE  33          2HG2      ILE  33  -2.157  -5.071 -12.589
  266   3HG2  ILE  33          1HG2      ILE  33  -3.285  -5.207 -13.935
  267   1HD1  ILE  33          1HD1      ILE  33  -4.671  -3.671 -14.236
  268   2HD1  ILE  33          3HD1      ILE  33  -4.680  -4.090 -12.523
  269   3HD1  ILE  33          2HD1      ILE  33  -5.360  -2.553 -13.060
  270    H    ARG  34           H        ARG  34  -0.298  -5.148 -12.463
  271    HA   ARG  34           HA       ARG  34   1.163  -6.404 -14.525
  272   1HB   ARG  34          2HB       ARG  34   3.479  -6.161 -13.261
  273   2HB   ARG  34          1HB       ARG  34   2.971  -4.957 -14.446
  274   1HG   ARG  34          2HG       ARG  34   2.805  -3.344 -12.871
  275   2HG   ARG  34          1HG       ARG  34   1.907  -4.401 -11.782
  276   1HD   ARG  34          2HD       ARG  34   4.287  -5.549 -11.490
  277   2HD   ARG  34          1HD       ARG  34   4.861  -3.958 -11.990
  278    HE   ARG  34           HE       ARG  34   3.360  -3.098 -10.059
  279   1HH1  ARG  34          2HH1      ARG  34   3.613  -6.433  -9.972
  280   2HH1  ARG  34          1HH1      ARG  34   4.230  -6.526  -8.355
  281   1HH2  ARG  34          1HH2      ARG  34   4.690  -3.102  -8.052
  282   2HH2  ARG  34          2HH2      ARG  34   4.840  -4.638  -7.268
  283    H    GLU  35           H        GLU  35   1.836  -8.478 -13.946
  284    HA   GLU  35           HA       GLU  35   0.557  -9.730 -11.762
  285   1HB   GLU  35          2HB       GLU  35   2.558 -10.430 -13.803
  286   2HB   GLU  35          1HB       GLU  35   2.618 -11.416 -12.356
  287   1HG   GLU  35          2HG       GLU  35   0.055 -11.601 -12.619
  288   2HG   GLU  35          1HG       GLU  35   0.312 -10.963 -14.245
  289    H    SER  36           H        SER  36   1.085  -9.812  -9.625
  290    HA   SER  36           HA       SER  36   3.602  -8.657  -8.685
  291   1HB   SER  36          2HB       SER  36   1.336 -10.009  -7.185
  292   2HB   SER  36          1HB       SER  36   2.672  -9.138  -6.447
  293    HG   SER  36           HG       SER  36   1.103  -7.893  -8.408
  294    H    GLU  37           H        GLU  37   5.416  -9.881  -8.441
  295    HA   GLU  37           HA       GLU  37   5.205 -12.823  -8.524
  296   1HB   GLU  37          2HB       GLU  37   7.614 -11.009  -8.254
  297   2HB   GLU  37          1HB       GLU  37   7.668 -12.751  -8.512
  298   1HG   GLU  37          2HG       GLU  37   6.703 -12.557 -10.689
  299   2HG   GLU  37          1HG       GLU  37   6.224 -10.884 -10.404
  300    H    THR  38           H        THR  38   4.522 -10.788  -6.195
  301    HA   THR  38           HA       THR  38   6.256 -11.639  -4.030
  302    HB   THR  38           HB       THR  38   4.819  -9.482  -4.209
  303    HG1  THR  38           HG1      THR  38   4.711 -11.036  -1.843
  304   1HG2  THR  38          3HG2      THR  38   2.688 -10.618  -4.698
  305   2HG2  THR  38          2HG2      THR  38   2.759 -11.422  -3.130
  306   3HG2  THR  38          1HG2      THR  38   2.576  -9.670  -3.215
  307    H    THR  39           H        THR  39   2.975 -12.425  -5.108
  308    HA   THR  39           HA       THR  39   3.000 -14.740  -3.208
  309    HB   THR  39           HB       THR  39   1.071 -13.073  -3.228
  310    HG1  THR  39           HG1      THR  39  -0.487 -14.902  -3.335
  311   1HG2  THR  39          2HG2      THR  39   1.151 -13.741  -5.999
  312   2HG2  THR  39          1HG2      THR  39  -0.386 -14.307  -5.346
  313   3HG2  THR  39          3HG2      THR  39   0.076 -12.615  -5.176
  314    H    LYS  40           H        LYS  40   1.358 -16.529  -4.409
  315    HA   LYS  40           HA       LYS  40   2.911 -17.977  -6.177
  316   1HB   LYS  40          2HB       LYS  40  -0.075 -17.840  -6.549
  317   2HB   LYS  40          1HB       LYS  40   0.982 -19.242  -6.705
  318   1HG   LYS  40          2HG       LYS  40   1.494 -18.814  -4.179
  319   2HG   LYS  40          1HG       LYS  40   0.003 -17.873  -4.212
  320   1HD   LYS  40          2HD       LYS  40  -0.461 -20.348  -5.580
  321   2HD   LYS  40          1HD       LYS  40   0.288 -20.708  -4.024
  322   1HE   LYS  40          2HE       LYS  40  -1.458 -19.756  -2.813
  323   2HE   LYS  40          1HE       LYS  40  -1.932 -18.693  -4.137
  324   1HZ   LYS  40          1HZ       LYS  40  -2.673 -20.688  -5.356
  325   2HZ   LYS  40          3HZ       LYS  40  -2.337 -21.629  -3.986
  326   3HZ   LYS  40          2HZ       LYS  40  -3.539 -20.431  -3.917
  327    H    GLY  41           H        GLY  41   0.712 -15.335  -6.880
  328   1HA   GLY  41          2HA       GLY  41   1.984 -14.203  -9.016
  329   2HA   GLY  41          1HA       GLY  41   1.077 -15.521  -9.767
  330    H    ALA  42           H        ALA  42   0.638 -12.803  -7.526
  331    HA   ALA  42           HA       ALA  42  -2.238 -12.622  -8.162
  332   1HB   ALA  42          1HB       ALA  42  -0.380 -11.066  -6.341
  333   2HB   ALA  42          3HB       ALA  42  -2.090 -10.674  -6.540
  334   3HB   ALA  42          2HB       ALA  42  -1.616 -12.229  -5.858
  335    H    TYR  43           H        TYR  43  -2.448  -9.789  -8.077
  336    HA   TYR  43           HA       TYR  43  -0.955  -9.065 -10.553
  337   1HB   TYR  43          2HB       TYR  43  -3.787  -9.149 -10.134
  338   2HB   TYR  43          1HB       TYR  43  -3.300  -7.467 -10.366
  339    HD1  TYR  43           HD1      TYR  43  -1.026  -7.559 -12.121
  340    HD2  TYR  43           HD2      TYR  43  -4.582  -9.989 -12.168
  341    HE1  TYR  43           HE1      TYR  43  -0.707  -8.006 -14.549
  342    HE2  TYR  43           HE2      TYR  43  -4.251 -10.434 -14.582
  343    HH   TYR  43           HH       TYR  43  -1.757 -10.301 -16.146
  344    H    SER  44           H        SER  44  -1.353  -6.400 -10.704
  345    HA   SER  44           HA       SER  44  -1.041  -5.159  -8.070
  346   1HB   SER  44          2HB       SER  44   1.163  -6.032  -8.259
  347   2HB   SER  44          1HB       SER  44   1.266  -5.538  -9.951
  348    HG   SER  44           HG       SER  44   1.255  -3.925  -7.635
  349    H    LEU  45           H        LEU  45  -0.529  -2.842  -8.283
  350    HA   LEU  45           HA       LEU  45  -1.206  -1.693 -10.948
  351   1HB   LEU  45          2HB       LEU  45  -3.307  -1.835  -9.568
  352   2HB   LEU  45          1HB       LEU  45  -2.539  -0.766  -8.392
  353    HG   LEU  45           HG       LEU  45  -2.521   0.067 -11.258
  354   1HD1  LEU  45          1HD1      LEU  45  -4.881  -0.749 -10.581
  355   2HD1  LEU  45          3HD1      LEU  45  -4.905   0.650  -9.507
  356   3HD1  LEU  45          2HD1      LEU  45  -4.739   0.879 -11.248
  357   1HD2  LEU  45          1HD2      LEU  45  -2.636   1.392  -8.551
  358   2HD2  LEU  45          3HD2      LEU  45  -1.374   1.513  -9.779
  359   3HD2  LEU  45          2HD2      LEU  45  -2.935   2.294 -10.037
  360    H    SER  46           H        SER  46   0.972  -1.008 -11.075
  361    HA   SER  46           HA       SER  46   2.225   0.538  -8.966
  362   1HB   SER  46          2HB       SER  46   3.260   0.898 -11.699
  363   2HB   SER  46          1HB       SER  46   4.094   0.359 -10.242
  364    HG   SER  46           HG       SER  46   3.988  -1.513 -11.185
  365    H    ILE  47           H        ILE  47   2.494   2.800  -8.867
  366    HA   ILE  47           HA       ILE  47   1.054   4.383 -10.941
  367    HB   ILE  47           HB       ILE  47  -0.218   5.588  -9.386
  368   1HG1  ILE  47          2HG1      ILE  47   1.509   4.460  -7.157
  369   2HG1  ILE  47          1HG1      ILE  47   1.700   6.070  -7.850
  370   1HG2  ILE  47          3HG2      ILE  47   0.052   2.756  -8.345
  371   2HG2  ILE  47          2HG2      ILE  47  -1.233   3.863  -7.861
  372   3HG2  ILE  47          1HG2      ILE  47  -1.101   3.345  -9.541
  373   1HD1  ILE  47          3HD1      ILE  47  -0.942   5.135  -6.731
  374   2HD1  ILE  47          2HD1      ILE  47   0.282   5.890  -5.710
  375   3HD1  ILE  47          1HD1      ILE  47  -0.416   6.787  -7.060
  376    H    ARG  48           H        ARG  48   2.282   6.041 -11.675
  377    HA   ARG  48           HA       ARG  48   4.861   6.605 -10.396
  378   1HB   ARG  48          2HB       ARG  48   5.011   6.687 -12.742
  379   2HB   ARG  48          1HB       ARG  48   3.461   7.507 -12.906
  380   1HG   ARG  48          2HG       ARG  48   5.253   9.091 -13.377
  381   2HG   ARG  48          1HG       ARG  48   4.473   9.540 -11.861
  382   1HD   ARG  48          2HD       ARG  48   6.278   8.830 -10.568
  383   2HD   ARG  48          1HD       ARG  48   6.850   7.706 -11.799
  384    HE   ARG  48           HE       ARG  48   7.780  10.357 -11.523
  385   1HH1  ARG  48          2HH1      ARG  48   6.798   8.022 -13.843
  386   2HH1  ARG  48          1HH1      ARG  48   7.463   8.881 -15.193
  387   1HH2  ARG  48          1HH2      ARG  48   8.492  11.595 -13.297
  388   2HH2  ARG  48          2HH2      ARG  48   8.421  10.904 -14.884
  389    H    ASP  49           H        ASP  49   5.276   8.370  -9.069
  390    HA   ASP  49           HA       ASP  49   3.305  10.577  -9.023
  391   1HB   ASP  49          2HB       ASP  49   2.393   9.065  -7.366
  392   2HB   ASP  49          1HB       ASP  49   3.975   8.872  -6.609
  393    H    TRP  50           H        TRP  50   5.108  11.829  -9.833
  394    HA   TRP  50           HA       TRP  50   7.595  12.036  -8.316
  395   1HB   TRP  50          2HB       TRP  50   7.757  12.574 -10.641
  396   2HB   TRP  50          1HB       TRP  50   6.357  13.642 -10.566
  397    HD1  TRP  50           HD1      TRP  50  10.048  13.676 -10.303
  398    HE1  TRP  50           HE1      TRP  50  10.871  15.977  -9.475
  399    HE3  TRP  50           HE3      TRP  50   5.628  15.675  -8.879
  400    HZ2  TRP  50           HZ2      TRP  50   9.757  18.390  -8.397
  401    HZ3  TRP  50           HZ3      TRP  50   5.500  17.984  -7.965
  402    HH2  TRP  50           HH2      TRP  50   7.564  19.342  -7.723
  403    H    ASP  51           H        ASP  51   8.216  13.886  -7.024
  404    HA   ASP  51           HA       ASP  51   5.949  15.609  -6.131
  405   1HB   ASP  51          2HB       ASP  51   7.114  13.528  -4.614
  406   2HB   ASP  51          1HB       ASP  51   7.736  15.034  -3.937
  407    H    ASP  52           H        ASP  52   6.702  17.601  -5.038
  408    HA   ASP  52           HA       ASP  52   9.110  18.659  -6.356
  409   1HB   ASP  52          2HB       ASP  52   8.365  20.809  -5.613
  410   2HB   ASP  52          1HB       ASP  52   6.909  19.934  -6.092
  411    H    MET  53           H        MET  53   9.915  16.699  -4.616
  412    HA   MET  53           HA       MET  53  11.570  18.215  -2.797
  413   1HB   MET  53          2HB       MET  53  10.833  17.075  -0.740
  414   2HB   MET  53          1HB       MET  53   9.519  18.010  -1.454
  415   1HG   MET  53          2HG       MET  53   9.235  15.586  -2.719
  416   2HG   MET  53          1HG       MET  53   9.781  15.095  -1.116
  417   1HE   MET  53          2HE       MET  53   7.707  17.100  -3.247
  418   2HE   MET  53          1HE       MET  53   6.060  16.961  -2.637
  419   3HE   MET  53          3HE       MET  53   7.101  18.282  -2.089
  420    H    LYS  54           H        LYS  54  10.597  15.104  -4.124
  421    HA   LYS  54           HA       LYS  54  13.307  14.129  -3.480
  422   1HB   LYS  54          2HB       LYS  54  12.063  11.804  -3.590
  423   2HB   LYS  54          1HB       LYS  54  12.040  12.762  -2.110
  424   1HG   LYS  54          2HG       LYS  54   9.871  13.740  -2.777
  425   2HG   LYS  54          1HG       LYS  54   9.896  12.785  -4.259
  426   1HD   LYS  54          2HD       LYS  54  10.123  10.729  -2.725
  427   2HD   LYS  54          1HD       LYS  54   9.656  11.807  -1.411
  428   1HE   LYS  54          2HE       LYS  54   7.523  12.200  -2.327
  429   2HE   LYS  54          1HE       LYS  54   8.014  11.663  -3.933
  430   1HZ   LYS  54          1HZ       LYS  54   8.419   9.584  -2.078
  431   2HZ   LYS  54          3HZ       LYS  54   6.829  10.153  -1.926
  432   3HZ   LYS  54          2HZ       LYS  54   7.395   9.614  -3.434
  433    H    GLY  55           H        GLY  55  11.168  14.853  -6.015
  434   1HA   GLY  55          2HA       GLY  55  11.871  14.683  -8.309
  435   2HA   GLY  55          1HA       GLY  55  12.898  13.336  -7.838
  436    H    ASP  56           H        ASP  56  11.741  12.326  -9.755
  437    HA   ASP  56           HA       ASP  56   8.932  11.717  -9.520
  438   1HB   ASP  56          2HB       ASP  56   9.585   9.915 -11.266
  439   2HB   ASP  56          1HB       ASP  56   9.807  11.603 -11.716
  440    H    HIS  57           H        HIS  57   8.145   9.409  -9.302
  441    HA   HIS  57           HA       HIS  57   9.823   7.465  -7.962
  442   1HB   HIS  57          2HB       HIS  57   8.108   9.310  -6.372
  443   2HB   HIS  57          1HB       HIS  57   8.063   7.606  -5.927
  444    HD1  HIS  57           HD1      HIS  57   9.361   9.571  -3.974
  445    HD2  HIS  57           HD2      HIS  57  11.496   7.579  -6.950
  446    HE1  HIS  57           HE1      HIS  57  11.781   9.547  -3.227
  447    H    VAL  58           H        VAL  58   8.028   5.812  -6.854
  448    HA   VAL  58           HA       VAL  58   5.562   5.680  -8.414
  449    HB   VAL  58           HB       VAL  58   7.234   4.870 -10.051
  450   1HG1  VAL  58          3HG1      VAL  58   8.026   3.270  -7.687
  451   2HG1  VAL  58          2HG1      VAL  58   8.068   2.436  -9.244
  452   3HG1  VAL  58          1HG1      VAL  58   9.014   3.909  -9.003
  453   1HG2  VAL  58          2HG2      VAL  58   5.362   2.795  -8.885
  454   2HG2  VAL  58          1HG2      VAL  58   5.058   3.871 -10.250
  455   3HG2  VAL  58          3HG2      VAL  58   6.237   2.565 -10.401
  456    H    LYS  59           H        LYS  59   4.221   3.890  -7.722
  457    HA   LYS  59           HA       LYS  59   5.144   2.439  -5.295
  458   1HB   LYS  59          2HB       LYS  59   2.613   4.091  -5.557
  459   2HB   LYS  59          1HB       LYS  59   2.877   2.911  -4.272
  460   1HG   LYS  59          2HG       LYS  59   4.241   4.315  -3.136
  461   2HG   LYS  59          1HG       LYS  59   5.140   4.737  -4.593
  462   1HD   LYS  59          2HD       LYS  59   3.964   6.702  -3.623
  463   2HD   LYS  59          1HD       LYS  59   3.386   6.323  -5.245
  464   1HE   LYS  59          2HE       LYS  59   1.422   6.687  -3.939
  465   2HE   LYS  59          1HE       LYS  59   1.557   4.937  -4.108
  466   1HZ   LYS  59          1HZ       LYS  59   3.043   5.551  -1.891
  467   2HZ   LYS  59          3HZ       LYS  59   1.670   6.537  -1.753
  468   3HZ   LYS  59          2HZ       LYS  59   1.493   4.854  -1.906
  469    H    HIS  60           H        HIS  60   2.855   1.008  -4.771
  470    HA   HIS  60           HA       HIS  60   1.730   0.027  -7.292
  471   1HB   HIS  60          2HB       HIS  60   3.115  -2.081  -5.706
  472   2HB   HIS  60          1HB       HIS  60   2.741  -2.043  -7.424
  473    HD1  HIS  60           HD1      HIS  60   4.540  -1.216  -8.982
  474    HD2  HIS  60           HD2      HIS  60   5.396  -0.346  -4.996
  475    HE1  HIS  60           HE1      HIS  60   6.898  -0.293  -8.943
  476    H    TYR  61           H        TYR  61  -0.110  -1.154  -7.005
  477    HA   TYR  61           HA       TYR  61  -0.973  -1.599  -4.177
  478   1HB   TYR  61          2HB       TYR  61  -2.760  -1.035  -6.570
  479   2HB   TYR  61          1HB       TYR  61  -3.274  -1.184  -4.892
  480    HD1  TYR  61           HD1      TYR  61  -0.657   0.269  -3.863
  481    HD2  TYR  61           HD2      TYR  61  -3.683   1.250  -6.750
  482    HE1  TYR  61           HE1      TYR  61  -0.208   2.683  -3.513
  483    HE2  TYR  61           HE2      TYR  61  -3.233   3.664  -6.400
  484    HH   TYR  61           HH       TYR  61  -2.166   5.168  -5.128
  485    H    LYS  62           H        LYS  62  -0.360  -3.742  -4.042
  486    HA   LYS  62           HA       LYS  62  -0.477  -5.677  -6.068
  487   1HB   LYS  62          2HB       LYS  62   0.714  -6.169  -4.051
  488   2HB   LYS  62          1HB       LYS  62  -0.725  -5.933  -3.061
  489   1HG   LYS  62          2HG       LYS  62  -0.764  -8.008  -5.227
  490   2HG   LYS  62          1HG       LYS  62   0.061  -8.367  -3.709
  491   1HD   LYS  62          2HD       LYS  62  -2.359  -7.187  -2.937
  492   2HD   LYS  62          1HD       LYS  62  -2.793  -8.260  -4.268
  493   1HE   LYS  62          2HE       LYS  62  -1.818 -10.156  -3.171
  494   2HE   LYS  62          1HE       LYS  62  -1.040  -9.136  -1.960
  495   1HZ   LYS  62          1HZ       LYS  62  -3.954  -9.004  -2.236
  496   2HZ   LYS  62          3HZ       LYS  62  -3.284 -10.352  -1.455
  497   3HZ   LYS  62          2HZ       LYS  62  -2.986  -8.789  -0.856
  498    H    ILE  63           H        ILE  63  -2.245  -6.123  -7.235
  499    HA   ILE  63           HA       ILE  63  -4.938  -5.938  -6.096
  500    HB   ILE  63           HB       ILE  63  -3.811  -6.591  -8.817
  501   1HG1  ILE  63          2HG1      ILE  63  -5.815  -4.657  -8.969
  502   2HG1  ILE  63          1HG1      ILE  63  -4.994  -4.299  -7.450
  503   1HG2  ILE  63          3HG2      ILE  63  -6.687  -6.851  -7.889
  504   2HG2  ILE  63          2HG2      ILE  63  -6.203  -6.782  -9.583
  505   3HG2  ILE  63          1HG2      ILE  63  -5.672  -8.123  -8.569
  506   1HD1  ILE  63          1HD1      ILE  63  -3.135  -4.952  -9.617
  507   2HD1  ILE  63          3HD1      ILE  63  -4.125  -3.535  -9.970
  508   3HD1  ILE  63          2HD1      ILE  63  -3.133  -3.576  -8.513
  509    H    ARG  64           H        ARG  64  -6.444  -7.782  -6.281
  510    HA   ARG  64           HA       ARG  64  -5.141 -10.446  -6.179
  511   1HB   ARG  64          2HB       ARG  64  -6.099  -9.121  -3.908
  512   2HB   ARG  64          1HB       ARG  64  -7.410 -10.210  -4.360
  513   1HG   ARG  64          2HG       ARG  64  -5.714 -11.238  -2.805
  514   2HG   ARG  64          1HG       ARG  64  -5.933 -12.119  -4.318
  515   1HD   ARG  64          2HD       ARG  64  -3.977 -10.175  -4.851
  516   2HD   ARG  64          1HD       ARG  64  -3.551 -10.851  -3.280
  517    HE   ARG  64           HE       ARG  64  -3.586 -12.317  -5.839
  518   1HH1  ARG  64          2HH1      ARG  64  -2.042 -12.052  -2.935
  519   2HH1  ARG  64          1HH1      ARG  64  -1.950 -13.749  -2.597
  520   1HH2  ARG  64          1HH2      ARG  64  -4.077 -14.649  -5.183
  521   2HH2  ARG  64          2HH2      ARG  64  -3.102 -15.219  -3.870
  522    H    LYS  65           H        LYS  65  -7.151 -12.088  -5.985
  523    HA   LYS  65           HA       LYS  65  -9.301 -11.112  -7.795
  524   1HB   LYS  65          2HB       LYS  65  -7.610 -12.145  -9.245
  525   2HB   LYS  65          1HB       LYS  65  -7.649 -13.611  -8.267
  526   1HG   LYS  65          2HG       LYS  65 -10.209 -13.594  -8.778
  527   2HG   LYS  65          1HG       LYS  65  -9.774 -12.506 -10.096
  528   1HD   LYS  65          2HD       LYS  65  -8.282 -14.157 -11.049
  529   2HD   LYS  65          1HD       LYS  65  -8.484 -15.213  -9.650
  530   1HE   LYS  65          2HE       LYS  65 -11.004 -15.174 -10.236
  531   2HE   LYS  65          1HE       LYS  65 -10.493 -14.539 -11.800
  532   1HZ   LYS  65          1HZ       LYS  65  -8.833 -16.677 -11.250
  533   2HZ   LYS  65          3HZ       LYS  65 -10.394 -17.200 -10.842
  534   3HZ   LYS  65          2HZ       LYS  65 -10.079 -16.613 -12.404
  535    H    LEU  66           H        LEU  66 -11.225 -11.684  -7.017
  536    HA   LEU  66           HA       LEU  66 -11.578 -13.346  -4.713
  537   1HB   LEU  66          2HB       LEU  66 -13.428 -12.268  -6.826
  538   2HB   LEU  66          1HB       LEU  66 -14.026 -13.444  -5.660
  539    HG   LEU  66           HG       LEU  66 -14.518 -11.339  -4.697
  540   1HD1  LEU  66          1HD1      LEU  66 -12.870 -13.071  -3.398
  541   2HD1  LEU  66          3HD1      LEU  66 -11.908 -11.594  -3.329
  542   3HD1  LEU  66          2HD1      LEU  66 -13.538 -11.616  -2.657
  543   1HD2  LEU  66          1HD2      LEU  66 -11.741 -10.572  -5.604
  544   2HD2  LEU  66          3HD2      LEU  66 -13.277  -9.848  -6.079
  545   3HD2  LEU  66          2HD2      LEU  66 -12.657  -9.606  -4.447
  546    H    ASP  67           H        ASP  67 -12.350 -15.493  -4.549
  547    HA   ASP  67           HA       ASP  67 -11.441 -17.270  -6.656
  548   1HB   ASP  67          2HB       ASP  67 -12.476 -17.497  -3.938
  549   2HB   ASP  67          1HB       ASP  67 -13.159 -18.726  -4.999
  550    H    ASN  68           H        ASN  68 -14.275 -15.512  -5.956
  551    HA   ASN  68           HA       ASN  68 -16.012 -17.226  -7.643
  552   1HB   ASN  68          2HB       ASN  68 -16.581 -14.596  -6.237
  553   2HB   ASN  68          1HB       ASN  68 -17.779 -15.624  -7.026
  554   1HD2  ASN  68          2HD2      ASN  68 -17.252 -16.340  -3.240
  555   2HD2  ASN  68          1HD2      ASN  68 -17.204 -14.844  -4.040
  556    H    GLY  69           H        GLY  69 -13.699 -14.928  -8.143
  557   1HA   GLY  69          2HA       GLY  69 -13.150 -14.057 -10.310
  558   2HA   GLY  69          1HA       GLY  69 -14.842 -14.228 -10.760
  559    H    GLY  70           H        GLY  70 -12.597 -12.273  -8.855
  560   1HA   GLY  70          2HA       GLY  70 -14.234  -9.930  -9.337
  561   2HA   GLY  70          1HA       GLY  70 -14.096 -10.380  -7.655
  562    H    TYR  71           H        TYR  71 -12.286  -9.169 -10.460
  563    HA   TYR  71           HA       TYR  71  -9.738  -9.107  -9.069
  564   1HB   TYR  71          2HB       TYR  71 -10.807  -7.738 -11.540
  565   2HB   TYR  71          1HB       TYR  71  -9.247  -7.274 -10.873
  566    HD1  TYR  71           HD1      TYR  71  -8.986 -10.407  -9.859
  567    HD2  TYR  71           HD2      TYR  71  -9.483  -8.361 -13.614
  568    HE1  TYR  71           HE1      TYR  71  -7.947 -12.315 -11.054
  569    HE2  TYR  71           HE2      TYR  71  -8.453 -10.264 -14.793
  570    HH   TYR  71           HH       TYR  71  -6.610 -12.461 -13.476
  571    H    TYR  72           H        TYR  72  -9.154  -7.716  -7.470
  572    HA   TYR  72           HA       TYR  72 -10.385  -5.002  -7.430
  573   1HB   TYR  72          2HB       TYR  72 -11.023  -5.191  -5.091
  574   2HB   TYR  72          1HB       TYR  72 -11.795  -6.487  -5.999
  575    HD1  TYR  72           HD1      TYR  72 -11.055  -8.802  -5.764
  576    HD2  TYR  72           HD2      TYR  72  -9.176  -5.654  -3.550
  577    HE1  TYR  72           HE1      TYR  72  -9.944 -10.483  -4.325
  578    HE2  TYR  72           HE2      TYR  72  -8.064  -7.312  -2.111
  579    HH   TYR  72           HH       TYR  72  -7.758  -9.469  -1.686
  580    H    ILE  73           H        ILE  73  -8.829  -3.481  -6.886
  581    HA   ILE  73           HA       ILE  73  -6.178  -4.409  -6.008
  582    HB   ILE  73           HB       ILE  73  -6.941  -1.510  -5.889
  583   1HG1  ILE  73          2HG1      ILE  73  -6.768  -3.151  -8.427
  584   2HG1  ILE  73          1HG1      ILE  73  -8.071  -2.076  -7.923
  585   1HG2  ILE  73          2HG2      ILE  73  -4.592  -2.859  -5.672
  586   2HG2  ILE  73          1HG2      ILE  73  -4.585  -2.479  -7.395
  587   3HG2  ILE  73          3HG2      ILE  73  -4.709  -1.181  -6.207
  588   1HD1  ILE  73          1HD1      ILE  73  -5.241  -1.157  -8.511
  589   2HD1  ILE  73          3HD1      ILE  73  -6.569  -1.072  -9.668
  590   3HD1  ILE  73          2HD1      ILE  73  -6.637  -0.131  -8.178
  591    H    THR  74           H        THR  74  -9.102  -3.069  -4.768
  592    HA   THR  74           HA       THR  74  -8.108  -3.436  -1.993
  593    HB   THR  74           HB       THR  74  -8.338  -1.203  -1.690
  594    HG1  THR  74           HG1      THR  74 -11.066  -1.305  -2.184
  595   1HG2  THR  74          2HG2      THR  74  -8.414  -0.939  -4.212
  596   2HG2  THR  74          1HG2      THR  74 -10.173  -0.979  -4.083
  597   3HG2  THR  74          3HG2      THR  74  -9.262   0.316  -3.308
  598    H    THR  75           H        THR  75  -9.617  -4.486  -0.699
  599    HA   THR  75           HA       THR  75 -11.542  -6.101  -2.056
  600    HB   THR  75           HB       THR  75 -12.172  -6.905   0.135
  601    HG1  THR  75           HG1      THR  75 -12.182  -5.549   1.722
  602   1HG2  THR  75          3HG2      THR  75  -9.530  -6.734  -0.879
  603   2HG2  THR  75          2HG2      THR  75  -9.418  -6.537   0.876
  604   3HG2  THR  75          1HG2      THR  75 -10.193  -7.970   0.198
  605    H    ARG  76           H        ARG  76 -11.779  -2.866  -1.222
  606    HA   ARG  76           HA       ARG  76 -14.549  -2.730  -0.462
  607   1HB   ARG  76          2HB       ARG  76 -12.429  -0.908  -0.769
  608   2HB   ARG  76          1HB       ARG  76 -13.646  -0.400  -1.940
  609   1HG   ARG  76          2HG       ARG  76 -15.333  -0.232  -0.238
  610   2HG   ARG  76          1HG       ARG  76 -14.299  -1.027   0.950
  611   1HD   ARG  76          2HD       ARG  76 -12.676   1.012   0.290
  612   2HD   ARG  76          1HD       ARG  76 -14.227   1.778  -0.056
  613    HE   ARG  76           HE       ARG  76 -13.862   0.466   2.587
  614   1HH1  ARG  76          2HH1      ARG  76 -13.132   3.364   1.058
  615   2HH1  ARG  76          1HH1      ARG  76 -13.993   4.373   2.172
  616   1HH2  ARG  76          1HH2      ARG  76 -15.462   1.718   3.851
  617   2HH2  ARG  76          2HH2      ARG  76 -15.312   3.441   3.754
  618    H    ALA  77           H        ALA  77 -12.935  -3.290  -3.480
  619    HA   ALA  77           HA       ALA  77 -15.532  -3.543  -4.814
  620   1HB   ALA  77          3HB       ALA  77 -13.627  -1.307  -5.462
  621   2HB   ALA  77          2HB       ALA  77 -14.701  -1.961  -6.699
  622   3HB   ALA  77          1HB       ALA  77 -15.375  -1.238  -5.238
  623    H    GLN  78           H        GLN  78 -15.404  -5.141  -6.292
  624    HA   GLN  78           HA       GLN  78 -12.753  -5.851  -7.439
  625   1HB   GLN  78          2HB       GLN  78 -14.048  -8.213  -7.570
  626   2HB   GLN  78          1HB       GLN  78 -13.047  -7.771  -6.195
  627   1HG   GLN  78          2HG       GLN  78 -15.847  -6.834  -6.071
  628   2HG   GLN  78          1HG       GLN  78 -15.634  -8.575  -5.987
  629   1HE2  GLN  78          2HE2      GLN  78 -13.401  -6.686  -3.129
  630   2HE2  GLN  78          1HE2      GLN  78 -13.188  -6.296  -4.765
  631    H    PHE  79           H        PHE  79 -13.204  -7.289  -9.520
  632    HA   PHE  79           HA       PHE  79 -15.670  -6.410 -10.920
  633   1HB   PHE  79          2HB       PHE  79 -12.846  -5.764 -11.777
  634   2HB   PHE  79          1HB       PHE  79 -14.199  -5.765 -12.911
  635    HD1  PHE  79           HD1      PHE  79 -13.135  -4.380  -9.609
  636    HD2  PHE  79           HD2      PHE  79 -15.579  -3.862 -13.099
  637    HE1  PHE  79           HE1      PHE  79 -13.804  -2.145  -8.802
  638    HE2  PHE  79           HE2      PHE  79 -16.251  -1.614 -12.292
  639    HZ   PHE  79           HZ       PHE  79 -15.362  -0.753 -10.141
  640    H    GLU  80           H        GLU  80 -15.075  -7.337 -13.450
  641    HA   GLU  80           HA       GLU  80 -14.795 -10.225 -12.859
  642   1HB   GLU  80          2HB       GLU  80 -15.787 -10.497 -15.155
  643   2HB   GLU  80          1HB       GLU  80 -16.818  -9.606 -14.033
  644   1HG   GLU  80          2HG       GLU  80 -15.083  -7.728 -15.299
  645   2HG   GLU  80          1HG       GLU  80 -15.801  -8.735 -16.557
  646    H    THR  81           H        THR  81 -13.279  -7.646 -14.747
  647    HA   THR  81           HA       THR  81 -11.016  -9.507 -15.232
  648    HB   THR  81           HB       THR  81 -11.793  -9.849 -17.359
  649    HG1  THR  81           HG1      THR  81 -11.324  -7.287 -18.193
  650   1HG2  THR  81          1HG2      THR  81 -13.936  -8.693 -16.729
  651   2HG2  THR  81          3HG2      THR  81 -13.202  -7.191 -17.288
  652   3HG2  THR  81          2HG2      THR  81 -13.481  -8.516 -18.422
  653    H    LEU  82           H        LEU  82  -9.285  -8.042 -16.558
  654    HA   LEU  82           HA       LEU  82  -8.777  -5.787 -14.759
  655   1HB   LEU  82          2HB       LEU  82  -7.163  -6.853 -17.088
  656   2HB   LEU  82          1HB       LEU  82  -6.614  -5.639 -15.931
  657    HG   LEU  82           HG       LEU  82  -7.705  -8.111 -14.731
  658   1HD1  LEU  82          3HD1      LEU  82  -6.486  -9.013 -16.688
  659   2HD1  LEU  82          2HD1      LEU  82  -5.044  -8.122 -16.184
  660   3HD1  LEU  82          1HD1      LEU  82  -5.689  -9.417 -15.169
  661   1HD2  LEU  82          3HD2      LEU  82  -6.499  -6.071 -13.649
  662   2HD2  LEU  82          2HD2      LEU  82  -6.069  -7.693 -13.103
  663   3HD2  LEU  82          1HD2      LEU  82  -5.024  -6.837 -14.237
  664    H    GLN  83           H        GLN  83  -9.809  -6.318 -18.056
  665    HA   GLN  83           HA       GLN  83  -9.453  -3.559 -18.877
  666   1HB   GLN  83          2HB       GLN  83  -9.546  -5.263 -20.599
  667   2HB   GLN  83          1HB       GLN  83 -11.111  -5.828 -20.016
  668   1HG   GLN  83          2HG       GLN  83 -11.475  -4.418 -21.963
  669   2HG   GLN  83          1HG       GLN  83 -12.056  -3.562 -20.535
  670   1HE2  GLN  83          2HE2      GLN  83  -9.119  -1.926 -22.750
  671   2HE2  GLN  83          1HE2      GLN  83  -9.976  -3.306 -23.243
  672    H    GLN  84           H        GLN  84 -12.006  -5.500 -17.442
  673    HA   GLN  84           HA       GLN  84 -14.090  -3.523 -17.688
  674   1HB   GLN  84          2HB       GLN  84 -13.729  -6.005 -16.034
  675   2HB   GLN  84          1HB       GLN  84 -15.115  -4.955 -15.794
  676   1HG   GLN  84          2HG       GLN  84 -15.234  -6.972 -17.521
  677   2HG   GLN  84          1HG       GLN  84 -16.032  -5.443 -17.864
  678   1HE2  GLN  84          2HE2      GLN  84 -13.747  -4.526 -20.464
  679   2HE2  GLN  84          1HE2      GLN  84 -14.859  -3.912 -19.340
  680    H    LEU  85           H        LEU  85 -11.774  -4.345 -15.136
  681    HA   LEU  85           HA       LEU  85 -12.865  -2.293 -13.335
  682   1HB   LEU  85          2HB       LEU  85 -11.479  -3.170 -11.734
  683   2HB   LEU  85          1HB       LEU  85 -11.472  -4.548 -12.831
  684    HG   LEU  85           HG       LEU  85  -9.472  -2.991 -13.884
  685   1HD1  LEU  85          3HD1      LEU  85  -9.973  -1.803 -11.448
  686   2HD1  LEU  85          2HD1      LEU  85  -8.661  -2.921 -11.065
  687   3HD1  LEU  85          1HD1      LEU  85  -8.446  -1.709 -12.327
  688   1HD2  LEU  85          3HD2      LEU  85  -9.669  -5.476 -13.145
  689   2HD2  LEU  85          2HD2      LEU  85  -8.081  -4.720 -13.238
  690   3HD2  LEU  85          1HD2      LEU  85  -8.875  -4.914 -11.674
  691    H    VAL  86           H        VAL  86 -10.279  -2.466 -15.715
  692    HA   VAL  86           HA       VAL  86  -9.112   0.010 -14.826
  693    HB   VAL  86           HB       VAL  86  -8.023   0.085 -17.052
  694   1HG1  VAL  86          3HG1      VAL  86  -7.948  -2.183 -15.204
  695   2HG1  VAL  86          2HG1      VAL  86  -7.382  -2.603 -16.821
  696   3HG1  VAL  86          1HG1      VAL  86  -6.615  -1.287 -15.933
  697   1HG2  VAL  86          2HG2      VAL  86  -9.831  -2.277 -17.589
  698   2HG2  VAL  86          1HG2      VAL  86  -9.887  -0.715 -18.399
  699   3HG2  VAL  86          3HG2      VAL  86  -8.505  -1.784 -18.639
  700    H    GLN  87           H        GLN  87 -11.855  -1.000 -16.555
  701    HA   GLN  87           HA       GLN  87 -12.445   1.431 -17.977
  702   1HB   GLN  87          2HB       GLN  87 -13.393  -0.829 -18.499
  703   2HB   GLN  87          1HB       GLN  87 -14.337  -0.723 -17.024
  704   1HG   GLN  87          2HG       GLN  87 -15.548   1.171 -17.812
  705   2HG   GLN  87          1HG       GLN  87 -14.453   1.392 -19.178
  706   1HE2  GLN  87          2HE2      GLN  87 -16.555  -2.097 -19.537
  707   2HE2  GLN  87          1HE2      GLN  87 -15.585  -1.817 -18.172
  708    H    HIS  88           H        HIS  88 -13.456   0.026 -14.904
  709    HA   HIS  88           HA       HIS  88 -15.237   2.183 -14.216
  710   1HB   HIS  88          2HB       HIS  88 -15.149  -0.279 -13.342
  711   2HB   HIS  88          1HB       HIS  88 -13.965   0.355 -12.207
  712    HD1  HIS  88           HD1      HIS  88 -14.890   2.721 -10.984
  713    HD2  HIS  88           HD2      HIS  88 -17.721  -0.002 -12.383
  714    HE1  HIS  88           HE1      HIS  88 -17.057   3.264  -9.791
  715    H    TYR  89           H        TYR  89 -11.946   1.284 -13.428
  716    HA   TYR  89           HA       TYR  89 -11.529   3.499 -11.619
  717   1HB   TYR  89          2HB       TYR  89  -9.656   1.554 -12.971
  718   2HB   TYR  89          1HB       TYR  89  -9.087   2.825 -11.897
  719    HD1  TYR  89           HD1      TYR  89 -11.868   0.311 -11.912
  720    HD2  TYR  89           HD2      TYR  89  -8.658   2.116  -9.715
  721    HE1  TYR  89           HE1      TYR  89 -12.362  -1.158 -10.014
  722    HE2  TYR  89           HE2      TYR  89  -9.163   0.643  -7.783
  723    HH   TYR  89           HH       TYR  89 -10.473  -0.957  -6.985
  724    H    SER  90           H        SER  90 -11.619   3.167 -14.996
  725    HA   SER  90           HA       SER  90  -9.666   5.124 -15.730
  726   1HB   SER  90          2HB       SER  90 -11.631   3.483 -17.064
  727   2HB   SER  90          1HB       SER  90 -11.710   5.135 -17.675
  728    HG   SER  90           HG       SER  90 -10.119   3.593 -18.639
  729    H    GLU  91           H        GLU  91 -13.076   5.230 -14.907
  730    HA   GLU  91           HA       GLU  91 -13.158   8.156 -15.360
  731   1HB   GLU  91          2HB       GLU  91 -15.560   7.909 -14.844
  732   2HB   GLU  91          1HB       GLU  91 -15.068   6.793 -16.116
  733   1HG   GLU  91          2HG       GLU  91 -15.078   4.938 -14.647
  734   2HG   GLU  91          1HG       GLU  91 -15.073   5.967 -13.215
  735    H    ARG  92           H        ARG  92 -12.732   5.836 -12.849
  736    HA   ARG  92           HA       ARG  92 -12.734   8.072 -10.865
  737   1HB   ARG  92          2HB       ARG  92 -14.027   5.391 -10.309
  738   2HB   ARG  92          1HB       ARG  92 -14.013   6.806  -9.257
  739   1HG   ARG  92          2HG       ARG  92 -15.050   7.771 -11.657
  740   2HG   ARG  92          1HG       ARG  92 -15.787   6.178 -11.490
  741   1HD   ARG  92          2HD       ARG  92 -15.703   7.788  -9.009
  742   2HD   ARG  92          1HD       ARG  92 -16.746   8.426 -10.279
  743    HE   ARG  92           HE       ARG  92 -17.617   5.908 -10.270
  744   1HH1  ARG  92          2HH1      ARG  92 -17.914   8.394  -8.097
  745   2HH1  ARG  92          1HH1      ARG  92 -18.396   7.421  -6.748
  746   1HH2  ARG  92          1HH2      ARG  92 -17.692   4.415  -8.327
  747   2HH2  ARG  92          2HH2      ARG  92 -18.271   5.168  -6.879
  748    H    ALA  93           H        ALA  93 -11.597   7.430  -8.817
  749    HA   ALA  93           HA       ALA  93  -9.194   5.882  -9.477
  750   1HB   ALA  93          2HB       ALA  93  -9.429   8.076  -8.007
  751   2HB   ALA  93          1HB       ALA  93  -9.746   6.915  -6.719
  752   3HB   ALA  93          3HB       ALA  93  -8.220   6.858  -7.603
  753    H    ALA  94           H        ALA  94 -11.958   5.640  -7.297
  754    HA   ALA  94           HA       ALA  94 -13.005   3.584  -6.651
  755   1HB   ALA  94          3HB       ALA  94 -11.204   2.464  -8.260
  756   2HB   ALA  94          2HB       ALA  94 -10.418   2.086  -6.727
  757   3HB   ALA  94          1HB       ALA  94 -12.056   1.513  -7.044
  758    H    GLY  95           H        GLY  95 -10.146   5.099  -5.502
  759   1HA   GLY  95          2HA       GLY  95 -10.652   5.537  -2.946
  760   2HA   GLY  95          1HA       GLY  95 -10.433   3.793  -2.850
  761    H    LEU  96           H        LEU  96  -8.313   4.212  -5.127
  762    HA   LEU  96           HA       LEU  96  -6.085   4.441  -3.266
  763   1HB   LEU  96          2HB       LEU  96  -4.722   3.706  -5.039
  764   2HB   LEU  96          1HB       LEU  96  -6.253   2.880  -5.309
  765    HG   LEU  96           HG       LEU  96  -5.295   5.390  -6.697
  766   1HD1  LEU  96          3HD1      LEU  96  -5.309   2.503  -7.307
  767   2HD1  LEU  96          2HD1      LEU  96  -5.894   3.540  -8.609
  768   3HD1  LEU  96          1HD1      LEU  96  -4.274   3.780  -7.950
  769   1HD2  LEU  96          3HD2      LEU  96  -7.900   3.880  -6.907
  770   2HD2  LEU  96          2HD2      LEU  96  -7.687   5.549  -6.379
  771   3HD2  LEU  96          1HD2      LEU  96  -7.376   5.108  -8.059
  772    H    SER  97           H        SER  97  -4.185   5.875  -3.929
  773    HA   SER  97           HA       SER  97  -4.763   8.558  -3.603
  774   1HB   SER  97          2HB       SER  97  -2.473   7.337  -3.645
  775   2HB   SER  97          1HB       SER  97  -2.468   7.732  -5.364
  776    HG   SER  97           HG       SER  97  -2.499   9.865  -4.890
  777    H    SER  98           H        SER  98  -4.323   6.913  -6.732
  778    HA   SER  98           HA       SER  98  -5.991   9.037  -7.963
  779   1HB   SER  98          2HB       SER  98  -3.211   9.069  -8.189
  780   2HB   SER  98          1HB       SER  98  -3.754   8.322  -9.692
  781    HG   SER  98           HG       SER  98  -4.891  10.687  -8.642
  782    H    ARG  99           H        ARG  99  -6.803   8.393 -10.098
  783    HA   ARG  99           HA       ARG  99  -7.516   5.581 -10.146
  784   1HB   ARG  99          2HB       ARG  99  -8.572   6.299 -12.397
  785   2HB   ARG  99          1HB       ARG  99  -9.213   7.029 -10.927
  786   1HG   ARG  99          2HG       ARG  99  -8.053   9.064 -11.304
  787   2HG   ARG  99          1HG       ARG  99  -6.986   8.327 -12.499
  788   1HD   ARG  99          2HD       ARG  99  -9.364   7.832 -13.672
  789   2HD   ARG  99          1HD       ARG  99  -9.781   9.304 -12.795
  790    HE   ARG  99           HE       ARG  99  -7.524   9.149 -14.753
  791   1HH1  ARG  99          1HH2      ARG  99  -7.301  11.551 -13.173
  792   2HH1  ARG  99          2HH2      ARG  99  -8.310  12.697 -13.992
  793   1HH2  ARG  99          2HH1      ARG  99 -10.032  10.288 -15.796
  794   2HH2  ARG  99          1HH1      ARG  99  -9.856  11.981 -15.478
  795    H    LEU 100           H        LEU 100  -7.264   4.281 -12.160
  796    HA   LEU 100           HA       LEU 100  -4.618   3.697 -12.789
  797   1HB   LEU 100          2HB       LEU 100  -5.602   2.715 -14.957
  798   2HB   LEU 100          1HB       LEU 100  -6.247   2.107 -13.434
  799    HG   LEU 100           HG       LEU 100  -8.037   3.975 -13.693
  800   1HD1  LEU 100          2HD1      LEU 100  -6.465   4.346 -16.074
  801   2HD1  LEU 100          1HD1      LEU 100  -8.116   3.898 -16.509
  802   3HD1  LEU 100          3HD1      LEU 100  -7.826   5.302 -15.482
  803   1HD2  LEU 100          2HD2      LEU 100  -8.114   1.374 -14.171
  804   2HD2  LEU 100          1HD2      LEU 100  -9.466   2.413 -14.621
  805   3HD2  LEU 100          3HD2      LEU 100  -8.293   1.915 -15.841
  806    H    VAL 101           H        VAL 101  -3.951   3.787 -15.364
  807    HA   VAL 101           HA       VAL 101  -2.844   6.254 -15.895
  808    HB   VAL 101           HB       VAL 101  -3.571   5.509 -18.450
  809   1HG1  VAL 101          2HG1      VAL 101  -1.288   5.217 -16.647
  810   2HG1  VAL 101          1HG1      VAL 101  -1.333   3.971 -17.895
  811   3HG1  VAL 101          3HG1      VAL 101  -1.323   5.675 -18.350
  812   1HG2  VAL 101          1HG2      VAL 101  -4.789   3.544 -17.379
  813   2HG2  VAL 101          3HG2      VAL 101  -3.591   3.128 -18.605
  814   3HG2  VAL 101          2HG2      VAL 101  -3.202   2.946 -16.894
  815    H    VAL 102           H        VAL 102  -3.403   8.141 -16.746
  816    HA   VAL 102           HA       VAL 102  -6.307   8.707 -16.974
  817    HB   VAL 102           HB       VAL 102  -4.544  11.004 -17.213
  818   1HG1  VAL 102          2HG1      VAL 102  -7.033  10.327 -16.117
  819   2HG1  VAL 102          1HG1      VAL 102  -6.037  10.754 -14.725
  820   3HG1  VAL 102          3HG1      VAL 102  -6.258  11.909 -16.039
  821   1HG2  VAL 102          1HG2      VAL 102  -4.131   9.180 -14.841
  822   2HG2  VAL 102          3HG2      VAL 102  -2.903   9.792 -15.948
  823   3HG2  VAL 102          2HG2      VAL 102  -3.708  10.892 -14.829
  824    HA   PRO 103           HA       PRO 103  -5.966   9.525 -21.294
  825   1HB   PRO 103          2HB       PRO 103  -6.886  12.083 -21.691
  826   2HB   PRO 103          1HB       PRO 103  -7.933  10.714 -21.290
  827   1HG   PRO 103          2HG       PRO 103  -7.056  12.981 -19.565
  828   2HG   PRO 103          1HG       PRO 103  -8.495  11.961 -19.424
  829   1HD   PRO 103          2HD       PRO 103  -6.103  11.747 -17.898
  830   2HD   PRO 103          1HD       PRO 103  -7.442  10.581 -17.919
  831    H    SER 104           H        SER 104  -4.786  10.656 -23.030
  832    HA   SER 104           HA       SER 104  -2.705  11.460 -23.800
  833   1HB   SER 104          2HB       SER 104  -3.848  13.659 -22.081
  834   2HB   SER 104          1HB       SER 104  -2.317  13.872 -22.929
  835    HG   SER 104           HG       SER 104  -3.538  13.140 -24.841
  836    H    HIS 105           H        HIS 105  -2.198   9.618 -21.854
  837    HA   HIS 105           HA       HIS 105  -0.721  10.589 -19.596
  838   1HB   HIS 105          2HB       HIS 105   0.172   8.300 -19.455
  839   2HB   HIS 105          1HB       HIS 105  -1.563   8.264 -19.773
  840    HD1  HIS 105           HD1      HIS 105   1.726   7.363 -21.247
  841    HD2  HIS 105           HD2      HIS 105  -2.244   7.556 -22.503
  842    HE1  HIS 105           HE1      HIS 105   1.609   6.109 -23.443
  843    H    LYS 106           HN       LYS 106   0.117  10.101 -22.958
  844    HA   LYS 106           HA       LYS 106   2.857   9.861 -22.982
  845   1HB   LYS 106          2HB       LYS 106   1.370  10.191 -24.993
  846   2HB   LYS 106          1HB       LYS 106   1.375  11.918 -24.640
  847   1HG   LYS 106          2HG       LYS 106   3.687  12.121 -25.075
  848   2HG   LYS 106          1HG       LYS 106   3.958  10.385 -24.915
  849   1HD   LYS 106          2HD       LYS 106   2.064  11.284 -27.039
  850   2HD   LYS 106          1HD       LYS 106   3.782  11.576 -27.312
  851   1HE   LYS 106          2HE       LYS 106   2.748   8.876 -26.433
  852   2HE   LYS 106          1HE       LYS 106   2.838   9.326 -28.136
  853   1HZ   LYS 106          1HZ       LYS 106   5.260  10.051 -27.228
  854   2HZ   LYS 106          3HZ       LYS 106   4.955   8.672 -26.289
  855   3HZ   LYS 106          2HZ       LYS 106   4.919   8.568 -27.984
  856   1H    GLU 201          3HT       GLU 201  -0.068  -5.569   0.500
  857   2H    GLU 201          2HT       GLU 201  -1.372  -6.653   0.395
  858   3H    GLU 201          1HT       GLU 201  -1.561  -5.168   1.198
  859    HA   GLU 201           HA       GLU 201  -0.728  -5.932   3.097
  860   1HB   GLU 201          2HB       GLU 201  -1.766  -8.141   1.551
  861   2HB   GLU 201          1HB       GLU 201  -0.472  -8.703   2.611
  862   1HG   GLU 201          2HG       GLU 201  -2.204  -6.818   3.988
  863   2HG   GLU 201          1HG       GLU 201  -3.126  -8.183   3.353
  864    HA   PRO 202           HA       PRO 202   3.362  -8.134   1.995
  865   1HB   PRO 202          2HB       PRO 202   3.802  -8.761  -0.645
  866   2HB   PRO 202          1HB       PRO 202   3.012  -9.857   0.502
  867   1HG   PRO 202          2HG       PRO 202   1.799  -8.249  -1.696
  868   2HG   PRO 202          1HG       PRO 202   1.228  -9.756  -0.961
  869   1HD   PRO 202          2HD       PRO 202   0.225  -7.163  -0.428
  870   2HD   PRO 202          1HD       PRO 202  -0.110  -8.629   0.517
  871    H    GLN 203           H        GLN 203   3.520  -5.629   2.321
  872    HA   GLN 203           HA       GLN 203   4.724  -3.676   1.825
  873   1HB   GLN 203          2HB       GLN 203   6.410  -5.479   1.053
  874   2HB   GLN 203          1HB       GLN 203   5.855  -5.107  -0.580
  875   1HG   GLN 203          2HG       GLN 203   6.278  -2.608   0.209
  876   2HG   GLN 203          1HG       GLN 203   7.381  -3.392   1.340
  877   1HE2  GLN 203          2HE2      GLN 203   8.888  -4.949  -1.856
  878   2HE2  GLN 203          1HE2      GLN 203   7.799  -5.626  -0.744
  879   1HN   PTR 204          1HN       PTR 204   2.081  -3.916   0.855
  880    HA   PTR 204           HA       PTR 204   2.298  -2.276  -1.630
  881   1HB   PTR 204          1HB       PTR 204   0.036  -3.402  -2.248
  882    HD1  PTR 204           HD1      PTR 204   1.462  -2.907  -4.244
  883    HD2  PTR 204           HD2      PTR 204   2.273  -6.208  -1.612
  884    HE1  PTR 204           HE1      PTR 204   2.942  -3.919  -5.960
  885    HE2  PTR 204           HE2      PTR 204   3.753  -7.213  -3.327
  886    H    GLU 205           H        GLU 205   0.802  -0.565  -1.739
  887    HA   GLU 205           HA       GLU 205  -0.219   0.421   0.759
  888   1HB   GLU 205          2HB       GLU 205  -0.487   1.232  -2.120
  889   2HB   GLU 205          1HB       GLU 205  -1.543   1.973  -0.917
  890   1HG   GLU 205          2HG       GLU 205   1.319   1.824  -0.168
  891   2HG   GLU 205          1HG       GLU 205   0.943   2.908  -1.509
  892    H    GLU 206           H        GLU 206  -2.692   1.130   0.783
  893    HA   GLU 206           HA       GLU 206  -4.469  -0.907  -0.393
  894   1HB   GLU 206          2HB       GLU 206  -3.801  -0.745   2.530
  895   2HB   GLU 206          1HB       GLU 206  -5.427  -1.223   2.040
  896   1HG   GLU 206          2HG       GLU 206  -4.090  -2.826   0.395
  897   2HG   GLU 206          1HG       GLU 206  -2.824  -2.635   1.607
  898    H    ILE 207           H        ILE 207  -6.226   0.211  -1.075
  899    HA   ILE 207           HA       ILE 207  -6.723   2.917  -0.578
  900    HB   ILE 207           HB       ILE 207  -8.491   0.650  -1.461
  901   1HG1  ILE 207          2HG1      ILE 207  -8.608   2.505  -3.382
  902   2HG1  ILE 207          1HG1      ILE 207  -7.094   3.009  -2.635
  903   1HG2  ILE 207          2HG2      ILE 207  -9.922   2.162  -0.096
  904   2HG2  ILE 207          1HG2      ILE 207  -9.385   3.524  -1.078
  905   3HG2  ILE 207          3HG2      ILE 207 -10.334   2.229  -1.809
  906   1HD1  ILE 207          3HD1      ILE 207  -6.963   0.196  -2.806
  907   2HD1  ILE 207          2HD1      ILE 207  -7.595   0.744  -4.358
  908   3HD1  ILE 207          1HD1      ILE 207  -6.053   1.364  -3.765
  909    HA   PRO 208           HA       PRO 208  -9.599   1.710   3.041
  910   1HB   PRO 208          2HB       PRO 208  -9.449  -0.870   3.977
  911   2HB   PRO 208          1HB       PRO 208 -10.588  -0.349   2.722
  912   1HG   PRO 208          2HG       PRO 208  -8.096  -1.958   2.442
  913   2HG   PRO 208          1HG       PRO 208  -9.535  -1.929   1.410
  914   1HD   PRO 208          2HD       PRO 208  -7.071  -0.643   0.871
  915   2HD   PRO 208          1HD       PRO 208  -8.602  -0.377   0.014
  916    H    ILE 209           H        ILE 209  -9.079   1.831   5.322
  917    HA   ILE 209           HA       ILE 209  -6.439   0.877   6.213
  918    HB   ILE 209           HB       ILE 209  -7.159   3.815   6.067
  919   1HG1  ILE 209          2HG1      ILE 209  -6.169   2.832   4.023
  920   2HG1  ILE 209          1HG1      ILE 209  -5.046   3.951   4.796
  921   1HG2  ILE 209          3HG2      ILE 209  -5.448   2.327   7.922
  922   2HG2  ILE 209          2HG2      ILE 209  -4.585   3.605   7.069
  923   3HG2  ILE 209          1HG2      ILE 209  -6.022   3.991   8.015
  924   1HD1  ILE 209          3HD1      ILE 209  -4.651   1.369   5.953
  925   2HD1  ILE 209          2HD1      ILE 209  -4.643   1.187   4.198
  926   3HD1  ILE 209          1HD1      ILE 209  -3.523   2.307   4.974
  927    H    TYR 210           H        TYR 210  -9.389   2.694   6.953
  928    HA   TYR 210           HA       TYR 210  -9.109   2.494   9.820
  929   1HB   TYR 210          2HB       TYR 210 -11.179   3.370   7.904
  930   2HB   TYR 210          1HB       TYR 210 -11.805   2.730   9.423
  931    HD1  TYR 210           HD1      TYR 210  -9.321   5.154   8.033
  932    HD2  TYR 210           HD2      TYR 210 -11.767   4.038  11.381
  933    HE1  TYR 210           HE1      TYR 210  -8.724   7.274   9.174
  934    HE2  TYR 210           HE2      TYR 210 -11.171   6.157  12.524
  935    HH   TYR 210           HH       TYR 210 -10.124   8.730  11.192
  936    H    LEU 211           HN       LEU 211 -11.393   1.400  10.803
  937    HA   LEU 211           HA       LEU 211 -10.853  -1.404  10.772
  938   1HB   LEU 211          2HB       LEU 211 -12.021  -0.220  12.629
  939   2HB   LEU 211          1HB       LEU 211 -13.425  -0.015  11.581
  940    HG   LEU 211           HG       LEU 211 -12.591  -2.770  11.527
  941   1HD1  LEU 211          1HD1      LEU 211 -11.806  -1.783  13.897
  942   2HD1  LEU 211          3HD1      LEU 211 -13.507  -2.056  14.273
  943   3HD1  LEU 211          2HD1      LEU 211 -12.496  -3.398  13.741
  944   1HD2  LEU 211          2HD2      LEU 211 -14.933  -1.218  11.525
  945   2HD2  LEU 211          1HD2      LEU 211 -14.835  -2.975  11.405
  946   3HD2  LEU 211          3HD2      LEU 211 -15.043  -2.210  12.979
   
  No H/Q in entry =         946
  Start of MODEL   19
    1   1H    SER   1          3HT       SER   1  -6.823 -10.117 -24.075
    2   2H    SER   1          2HT       SER   1  -6.655 -10.764 -25.637
    3   3H    SER   1          1HT       SER   1  -5.483 -11.087 -24.450
    4    HA   SER   1           HA       SER   1  -4.341  -9.287 -24.987
    5   1HB   SER   1          2HB       SER   1  -5.101  -8.021 -27.035
    6   2HB   SER   1          1HB       SER   1  -4.999  -9.767 -27.263
    7    HG   SER   1           HG       SER   1  -6.963  -8.850 -28.052
    8    H    ILE   2           H        ILE   2  -5.382  -8.631 -22.745
    9    HA   ILE   2           HA       ILE   2  -7.421  -6.699 -22.540
   10    HB   ILE   2           HB       ILE   2  -5.891  -5.851 -20.548
   11   1HG1  ILE   2          2HG1      ILE   2  -4.719  -8.599 -20.968
   12   2HG1  ILE   2          1HG1      ILE   2  -3.934  -7.172 -21.644
   13   1HG2  ILE   2          2HG2      ILE   2  -7.972  -7.202 -20.362
   14   2HG2  ILE   2          1HG2      ILE   2  -7.024  -8.664 -20.635
   15   3HG2  ILE   2          3HG2      ILE   2  -6.754  -7.696 -19.186
   16   1HD1  ILE   2          1HD1      ILE   2  -4.644  -6.585 -18.938
   17   2HD1  ILE   2          3HD1      ILE   2  -3.816  -8.142 -18.956
   18   3HD1  ILE   2          2HD1      ILE   2  -3.031  -6.718 -19.637
   19    H    GLN   3           H        GLN   3  -6.467  -4.348 -21.535
   20    HA   GLN   3           HA       GLN   3  -5.481  -3.027 -23.971
   21   1HB   GLN   3          2HB       GLN   3  -7.124  -2.272 -21.808
   22   2HB   GLN   3          1HB       GLN   3  -5.668  -1.282 -21.674
   23   1HG   GLN   3          2HG       GLN   3  -6.734  -1.575 -24.420
   24   2HG   GLN   3          1HG       GLN   3  -7.777  -0.685 -23.310
   25   1HE2  GLN   3          2HE2      GLN   3  -5.814   2.167 -24.030
   26   2HE2  GLN   3          1HE2      GLN   3  -7.351   1.450 -24.087
   27    H    ALA   4           H        ALA   4  -3.415  -4.558 -23.262
   28    HA   ALA   4           HA       ALA   4  -1.668  -3.409 -21.279
   29   1HB   ALA   4          3HB       ALA   4  -1.138  -5.216 -23.649
   30   2HB   ALA   4          2HB       ALA   4   0.112  -4.735 -22.503
   31   3HB   ALA   4          1HB       ALA   4  -1.269  -5.684 -21.953
   32    H    GLU   5           H        GLU   5  -1.582  -1.164 -21.706
   33    HA   GLU   5           HA       GLU   5   0.422  -0.385 -23.669
   34   1HB   GLU   5          2HB       GLU   5  -2.491   0.247 -24.114
   35   2HB   GLU   5          1HB       GLU   5  -1.227   1.309 -24.736
   36   1HG   GLU   5          2HG       GLU   5  -0.197  -0.886 -25.701
   37   2HG   GLU   5          1HG       GLU   5  -1.810  -1.557 -25.453
   38    H    GLU   6           H        GLU   6  -2.021   0.587 -21.277
   39    HA   GLU   6           HA       GLU   6  -0.173   2.801 -20.523
   40   1HB   GLU   6          2HB       GLU   6  -3.184   3.023 -20.753
   41   2HB   GLU   6          1HB       GLU   6  -2.109   4.285 -20.154
   42   1HG   GLU   6          2HG       GLU   6  -1.659   3.054 -22.867
   43   2HG   GLU   6          1HG       GLU   6  -2.828   4.357 -22.658
   44    H    TRP   7           H        TRP   7  -2.902   0.757 -19.467
   45    HA   TRP   7           HA       TRP   7  -2.063   1.332 -16.667
   46   1HB   TRP   7          2HB       TRP   7  -4.269   0.380 -16.003
   47   2HB   TRP   7          1HB       TRP   7  -4.418   1.801 -17.025
   48    HD1  TRP   7           HD1      TRP   7  -5.594   1.549 -19.310
   49    HE1  TRP   7           HE1      TRP   7  -6.794  -0.402 -20.493
   50    HE3  TRP   7           HE3      TRP   7  -4.153  -2.324 -16.311
   51    HZ2  TRP   7           HZ2      TRP   7  -7.101  -3.229 -20.206
   52    HZ3  TRP   7           HZ3      TRP   7  -4.914  -4.635 -16.789
   53    HH2  TRP   7           HH2      TRP   7  -6.383  -5.091 -18.732
   54    H    TYR   8           H        TYR   8  -1.409  -0.880 -18.962
   55    HA   TYR   8           HA       TYR   8  -0.669  -2.892 -16.958
   56   1HB   TYR   8          2HB       TYR   8  -2.806  -3.729 -17.298
   57   2HB   TYR   8          1HB       TYR   8  -2.806  -3.354 -19.020
   58    HD1  TYR   8           HD1      TYR   8  -0.754  -4.647 -20.326
   59    HD2  TYR   8           HD2      TYR   8  -2.657  -5.912 -16.694
   60    HE1  TYR   8           HE1      TYR   8  -0.074  -6.980 -20.786
   61    HE2  TYR   8           HE2      TYR   8  -1.988  -8.244 -17.164
   62    HH   TYR   8           HH       TYR   8   0.113  -9.289 -18.672
   63    H    PHE   9           H        PHE   9   1.261  -3.638 -17.453
   64    HA   PHE   9           HA       PHE   9   2.326  -3.120 -20.171
   65   1HB   PHE   9          2HB       PHE   9   3.523  -3.505 -17.444
   66   2HB   PHE   9          1HB       PHE   9   4.518  -3.778 -18.871
   67    HD1  PHE   9           HD1      PHE   9   1.747  -1.358 -19.005
   68    HD2  PHE   9           HD2      PHE   9   5.968  -1.832 -18.286
   69    HE1  PHE   9           HE1      PHE   9   2.069   1.085 -19.239
   70    HE2  PHE   9           HE2      PHE   9   6.276   0.614 -18.522
   71    HZ   PHE   9           HZ       PHE   9   4.330   2.072 -18.998
   72    H    GLY  10           H        GLY  10   1.827  -5.743 -17.841
   73   1HA   GLY  10          2HA       GLY  10   1.295  -7.870 -19.352
   74   2HA   GLY  10          1HA       GLY  10   2.990  -7.673 -19.768
   75    H    LYS  11           H        LYS  11   4.256  -8.981 -18.621
   76    HA   LYS  11           HA       LYS  11   3.422  -9.771 -15.867
   77   1HB   LYS  11          2HB       LYS  11   5.605 -11.143 -17.413
   78   2HB   LYS  11          1HB       LYS  11   4.506 -11.815 -16.208
   79   1HG   LYS  11          2HG       LYS  11   2.658 -11.762 -17.750
   80   2HG   LYS  11          1HG       LYS  11   3.587 -10.826 -18.921
   81   1HD   LYS  11          2HD       LYS  11   5.208 -12.773 -19.039
   82   2HD   LYS  11          1HD       LYS  11   4.059 -13.699 -18.073
   83   1HE   LYS  11          2HE       LYS  11   2.310 -13.238 -19.805
   84   2HE   LYS  11          1HE       LYS  11   3.542 -12.449 -20.789
   85   1HZ   LYS  11          2HZ       LYS  11   4.497 -14.955 -19.946
   86   2HZ   LYS  11          1HZ       LYS  11   2.960 -15.166 -20.637
   87   3HZ   LYS  11          3HZ       LYS  11   4.193 -14.415 -21.527
   88    H    LEU  12           H        LEU  12   4.281  -7.506 -15.427
   89    HA   LEU  12           HA       LEU  12   7.259  -7.468 -15.270
   90   1HB   LEU  12          2HB       LEU  12   5.988  -5.618 -16.466
   91   2HB   LEU  12          1HB       LEU  12   5.354  -5.152 -14.890
   92    HG   LEU  12           HG       LEU  12   7.569  -4.709 -14.052
   93   1HD1  LEU  12          3HD1      LEU  12   8.322  -6.398 -16.318
   94   2HD1  LEU  12          2HD1      LEU  12   9.285  -4.925 -16.237
   95   3HD1  LEU  12          1HD1      LEU  12   9.232  -6.017 -14.853
   96   1HD2  LEU  12          2HD2      LEU  12   6.495  -3.449 -16.435
   97   2HD2  LEU  12          1HD2      LEU  12   7.262  -2.707 -15.028
   98   3HD2  LEU  12          3HD2      LEU  12   8.252  -3.290 -16.367
   99    H    GLY  13           H        GLY  13   8.107  -6.270 -13.268
  100   1HA   GLY  13          2HA       GLY  13   6.540  -7.188 -10.891
  101   2HA   GLY  13          1HA       GLY  13   8.301  -7.104 -10.939
  102    H    ARG  14           H        ARG  14   8.005  -5.751  -8.966
  103    HA   ARG  14           HA       ARG  14   6.880  -3.054  -9.397
  104   1HB   ARG  14          2HB       ARG  14   7.643  -2.766  -6.973
  105   2HB   ARG  14          1HB       ARG  14   6.392  -3.977  -7.252
  106   1HG   ARG  14          2HG       ARG  14   7.736  -5.635  -6.519
  107   2HG   ARG  14          1HG       ARG  14   9.052  -5.110  -7.570
  108   1HD   ARG  14          2HD       ARG  14  10.108  -4.052  -5.877
  109   2HD   ARG  14          1HD       ARG  14   8.620  -3.275  -5.337
  110    HE   ARG  14           HE       ARG  14   8.954  -6.135  -4.653
  111   1HH1  ARG  14          1HH2      ARG  14   7.131  -5.472  -2.875
  112   2HH1  ARG  14          2HH2      ARG  14   7.878  -4.612  -1.569
  113   1HH2  ARG  14          2HH1      ARG  14  10.759  -3.874  -3.351
  114   2HH2  ARG  14          1HH1      ARG  14   9.931  -3.707  -1.838
  115    H    LYS  15           H        LYS  15   9.944  -4.635  -9.474
  116    HA   LYS  15           HA       LYS  15  11.524  -2.282  -8.946
  117   1HB   LYS  15          2HB       LYS  15  12.261  -4.715  -8.625
  118   2HB   LYS  15          1HB       LYS  15  12.458  -4.769 -10.376
  119   1HG   LYS  15          2HG       LYS  15  14.319  -3.446 -10.336
  120   2HG   LYS  15          1HG       LYS  15  13.686  -2.428  -9.042
  121   1HD   LYS  15          2HD       LYS  15  14.854  -3.582  -7.499
  122   2HD   LYS  15          1HD       LYS  15  14.153  -5.102  -8.052
  123   1HE   LYS  15          2HE       LYS  15  16.063  -5.665  -9.105
  124   2HE   LYS  15          1HE       LYS  15  16.089  -4.131  -9.974
  125   1HZ   LYS  15          2HZ       LYS  15  17.045  -4.557  -7.194
  126   2HZ   LYS  15          1HZ       LYS  15  18.037  -4.390  -8.565
  127   3HZ   LYS  15          3HZ       LYS  15  17.084  -3.086  -8.044
  128    H    ASP  16           H        ASP  16  10.433  -4.028 -11.829
  129    HA   ASP  16           HA       ASP  16  11.856  -2.313 -13.631
  130   1HB   ASP  16          2HB       ASP  16  10.873  -4.736 -13.944
  131   2HB   ASP  16          1HB       ASP  16   9.429  -3.851 -14.410
  132    H    ALA  17           H        ALA  17   8.618  -2.500 -12.295
  133    HA   ALA  17           HA       ALA  17   7.389  -0.522 -13.923
  134   1HB   ALA  17          1HB       ALA  17   6.831  -1.334 -11.063
  135   2HB   ALA  17          3HB       ALA  17   5.787  -0.270 -12.007
  136   3HB   ALA  17          2HB       ALA  17   6.031  -1.943 -12.512
  137    H    GLU  18           H        GLU  18   9.059  -0.226 -10.799
  138    HA   GLU  18           HA       GLU  18   8.712   2.587 -10.511
  139   1HB   GLU  18          2HB       GLU  18  10.778   2.452  -9.072
  140   2HB   GLU  18          1HB       GLU  18   9.525   1.291  -8.638
  141   1HG   GLU  18          2HG       GLU  18  10.688  -0.461  -9.918
  142   2HG   GLU  18          1HG       GLU  18  11.930   0.698 -10.391
  143    H    ARG  19           H        ARG  19  11.254   0.687 -12.133
  144    HA   ARG  19           HA       ARG  19  12.616   3.145 -13.007
  145   1HB   ARG  19          2HB       ARG  19  13.379   0.465 -12.659
  146   2HB   ARG  19          1HB       ARG  19  13.433   0.732 -14.402
  147   1HG   ARG  19          2HG       ARG  19  14.534   3.036 -13.103
  148   2HG   ARG  19          1HG       ARG  19  15.309   1.599 -12.435
  149   1HD   ARG  19          2HD       ARG  19  15.857   0.814 -14.692
  150   2HD   ARG  19          1HD       ARG  19  15.020   2.198 -15.395
  151    HE   ARG  19           HE       ARG  19  16.958   3.462 -14.980
  152   1HH1  ARG  19          2HH1      ARG  19  17.527   0.358 -13.871
  153   2HH1  ARG  19          1HH1      ARG  19  18.731   0.799 -12.706
  154   1HH2  ARG  19          1HH2      ARG  19  18.198   4.208 -13.050
  155   2HH2  ARG  19          2HH2      ARG  19  19.110   2.977 -12.241
  156    H    GLN  20           H        GLN  20   9.909   1.461 -14.026
  157    HA   GLN  20           HA       GLN  20  10.355   1.835 -16.912
  158   1HB   GLN  20          2HB       GLN  20   8.123   0.712 -15.232
  159   2HB   GLN  20          1HB       GLN  20   7.826   1.138 -16.918
  160   1HG   GLN  20          2HG       GLN  20  10.272  -0.463 -16.328
  161   2HG   GLN  20          1HG       GLN  20   8.718  -1.289 -16.206
  162   1HE2  GLN  20          2HE2      GLN  20   9.890  -1.511 -19.762
  163   2HE2  GLN  20          1HE2      GLN  20  10.518  -2.018 -18.270
  164    H    LEU  21           H        LEU  21   8.717   3.436 -14.253
  165    HA   LEU  21           HA       LEU  21   7.493   5.386 -16.122
  166   1HB   LEU  21          2HB       LEU  21   7.317   5.527 -13.118
  167   2HB   LEU  21          1HB       LEU  21   6.160   6.100 -14.319
  168    HG   LEU  21           HG       LEU  21   6.756   3.233 -13.551
  169   1HD1  LEU  21          3HD1      LEU  21   5.141   4.525 -12.156
  170   2HD1  LEU  21          2HD1      LEU  21   4.184   4.839 -13.603
  171   3HD1  LEU  21          1HD1      LEU  21   4.372   3.189 -13.013
  172   1HD2  LEU  21          3HD2      LEU  21   5.975   4.301 -16.110
  173   2HD2  LEU  21          2HD2      LEU  21   6.214   2.616 -15.647
  174   3HD2  LEU  21          1HD2      LEU  21   4.637   3.376 -15.431
  175    H    LEU  22           H        LEU  22   9.877   5.201 -13.507
  176    HA   LEU  22           HA       LEU  22  10.520   8.037 -13.654
  177   1HB   LEU  22          2HB       LEU  22  12.166   5.798 -12.445
  178   2HB   LEU  22          1HB       LEU  22  12.296   7.519 -12.088
  179    HG   LEU  22           HG       LEU  22  10.048   5.627 -11.386
  180   1HD1  LEU  22          2HD1      LEU  22  12.222   6.971 -10.002
  181   2HD1  LEU  22          1HD1      LEU  22  10.661   7.383  -9.291
  182   3HD1  LEU  22          3HD1      LEU  22  11.153   5.694  -9.422
  183   1HD2  LEU  22          2HD2      LEU  22   9.995   8.591 -11.798
  184   2HD2  LEU  22          1HD2      LEU  22   8.738   7.395 -12.112
  185   3HD2  LEU  22          3HD2      LEU  22   9.070   7.913 -10.459
  186    H    SER  23           H        SER  23  11.963   5.040 -14.950
  187    HA   SER  23           HA       SER  23  14.082   6.617 -16.274
  188   1HB   SER  23          2HB       SER  23  13.628   3.705 -16.808
  189   2HB   SER  23          1HB       SER  23  15.145   4.593 -16.684
  190    HG   SER  23           HG       SER  23  14.900   4.684 -14.481
  191    H    PHE  24           H        PHE  24  11.525   7.352 -17.139
  192    HA   PHE  24           HA       PHE  24  11.558   6.298 -19.933
  193   1HB   PHE  24          2HB       PHE  24   9.463   6.023 -18.026
  194   2HB   PHE  24          1HB       PHE  24   8.924   7.190 -19.234
  195    HD1  PHE  24           HD1      PHE  24  11.305   4.366 -19.718
  196    HD2  PHE  24           HD2      PHE  24   7.376   5.912 -20.510
  197    HE1  PHE  24           HE1      PHE  24  10.901   2.519 -21.324
  198    HE2  PHE  24           HE2      PHE  24   6.973   4.065 -22.116
  199    HZ   PHE  24           HZ       PHE  24   8.736   2.369 -22.522
  200    H    GLY  25           H        GLY  25   9.516   8.763 -18.413
  201   1HA   GLY  25          2HA       GLY  25  10.877  11.105 -18.979
  202   2HA   GLY  25          1HA       GLY  25  10.155  10.661 -20.524
  203    H    ASN  26           H        ASN  26   7.854   9.369 -19.031
  204    HA   ASN  26           HA       ASN  26   6.146  11.708 -18.984
  205   1HB   ASN  26          2HB       ASN  26   5.512   8.941 -17.925
  206   2HB   ASN  26          1HB       ASN  26   4.362  10.169 -18.456
  207   1HD2  ASN  26          2HD2      ASN  26   4.505   8.176 -21.458
  208   2HD2  ASN  26          1HD2      ASN  26   3.662   8.338 -19.994
  209    HA   PRO  27           HA       PRO  27   6.733  12.736 -14.732
  210   1HB   PRO  27          2HB       PRO  27   4.573  14.419 -14.495
  211   2HB   PRO  27          1HB       PRO  27   6.081  14.869 -15.306
  212   1HG   PRO  27          2HG       PRO  27   3.433  14.169 -16.497
  213   2HG   PRO  27          1HG       PRO  27   4.720  15.192 -17.153
  214   1HD   PRO  27          2HD       PRO  27   4.170  12.508 -17.897
  215   2HD   PRO  27          1HD       PRO  27   5.628  13.431 -18.313
  216    H    ARG  28           H        ARG  28   4.714  13.267 -12.898
  217    HA   ARG  28           HA       ARG  28   3.894  10.699 -12.032
  218   1HB   ARG  28          2HB       ARG  28   3.931  12.477 -10.430
  219   2HB   ARG  28          1HB       ARG  28   2.843  13.467 -11.401
  220   1HG   ARG  28          2HG       ARG  28   1.015  11.895 -11.025
  221   2HG   ARG  28          1HG       ARG  28   2.093  10.803 -10.158
  222   1HD   ARG  28          2HD       ARG  28   1.732  11.932  -8.246
  223   2HD   ARG  28          1HD       ARG  28   2.309  13.420  -8.999
  224    HE   ARG  28           HE       ARG  28  -0.141  13.532  -9.922
  225   1HH1  ARG  28          2HH1      ARG  28  -0.015  11.170  -7.619
  226   2HH1  ARG  28          1HH1      ARG  28  -1.117  11.910  -6.507
  227   1HH2  ARG  28          1HH2      ARG  28  -1.192  14.942  -8.188
  228   2HH2  ARG  28          2HH2      ARG  28  -1.784  14.046  -6.830
  229    H    GLY  29           H        GLY  29   1.546   9.991 -11.799
  230   1HA   GLY  29          2HA       GLY  29  -0.688   9.856 -12.660
  231   2HA   GLY  29          1HA       GLY  29  -0.235  10.969 -13.950
  232    H    THR  30           H        THR  30   2.009   8.439 -13.384
  233    HA   THR  30           HA       THR  30   1.122   7.136 -15.910
  234    HB   THR  30           HB       THR  30   3.667   6.285 -14.670
  235    HG1  THR  30           HG1      THR  30   3.073   8.945 -15.310
  236   1HG2  THR  30          1HG2      THR  30   2.820   7.257 -17.412
  237   2HG2  THR  30          3HG2      THR  30   4.431   6.655 -17.020
  238   3HG2  THR  30          2HG2      THR  30   3.038   5.580 -16.912
  239    H    PHE  31           H        PHE  31  -0.632   6.007 -14.754
  240    HA   PHE  31           HA       PHE  31   0.204   3.977 -12.775
  241   1HB   PHE  31          2HB       PHE  31  -2.492   4.800 -13.870
  242   2HB   PHE  31          1HB       PHE  31  -2.276   3.482 -12.720
  243    HD1  PHE  31           HD1      PHE  31  -0.999   6.996 -13.137
  244    HD2  PHE  31           HD2      PHE  31  -2.676   4.048 -10.502
  245    HE1  PHE  31           HE1      PHE  31  -0.945   8.631 -11.275
  246    HE2  PHE  31           HE2      PHE  31  -2.623   5.684  -8.639
  247    HZ   PHE  31           HZ       PHE  31  -1.756   7.975  -9.027
  248    H    LEU  32           H        LEU  32   0.852   2.014 -13.474
  249    HA   LEU  32           HA       LEU  32  -0.397   0.917 -15.957
  250   1HB   LEU  32          2HB       LEU  32   1.721  -0.006 -16.631
  251   2HB   LEU  32          1HB       LEU  32   2.004   1.695 -16.259
  252    HG   LEU  32           HG       LEU  32   2.494   0.753 -13.836
  253   1HD1  LEU  32          3HD1      LEU  32   2.544  -1.633 -15.625
  254   2HD1  LEU  32          2HD1      LEU  32   3.823  -1.504 -14.419
  255   3HD1  LEU  32          1HD1      LEU  32   2.133  -1.521 -13.914
  256   1HD2  LEU  32          3HD2      LEU  32   4.138   1.137 -16.238
  257   2HD2  LEU  32          2HD2      LEU  32   4.398   1.719 -14.593
  258   3HD2  LEU  32          1HD2      LEU  32   4.891   0.086 -15.038
  259    H    ILE  33           H        ILE  33  -0.135  -1.538 -16.012
  260    HA   ILE  33           HA       ILE  33  -0.410  -2.625 -13.244
  261    HB   ILE  33           HB       ILE  33  -1.894  -3.247 -15.778
  262   1HG1  ILE  33          2HG1      ILE  33  -2.659  -2.967 -12.864
  263   2HG1  ILE  33          1HG1      ILE  33  -2.910  -1.762 -14.122
  264   1HG2  ILE  33          1HG2      ILE  33  -0.911  -5.411 -15.048
  265   2HG2  ILE  33          3HG2      ILE  33  -1.660  -5.179 -13.468
  266   3HG2  ILE  33          2HG2      ILE  33  -2.666  -5.370 -14.901
  267   1HD1  ILE  33          3HD1      ILE  33  -4.110  -3.913 -15.269
  268   2HD1  ILE  33          2HD1      ILE  33  -4.409  -4.259 -13.566
  269   3HD1  ILE  33          1HD1      ILE  33  -4.971  -2.741 -14.269
  270    H    ARG  34           H        ARG  34   0.153  -5.071 -13.217
  271    HA   ARG  34           HA       ARG  34   1.943  -6.213 -15.105
  272   1HB   ARG  34          2HB       ARG  34   4.053  -5.847 -13.594
  273   2HB   ARG  34          1HB       ARG  34   3.579  -4.581 -14.728
  274   1HG   ARG  34          2HG       ARG  34   2.956  -3.149 -13.065
  275   2HG   ARG  34          1HG       ARG  34   2.281  -4.440 -12.072
  276   1HD   ARG  34          2HD       ARG  34   4.719  -5.165 -11.667
  277   2HD   ARG  34          1HD       ARG  34   5.169  -3.592 -12.326
  278    HE   ARG  34           HE       ARG  34   3.954  -2.548 -10.447
  279   1HH1  ARG  34          2HH1      ARG  34   3.287  -5.842 -10.359
  280   2HH1  ARG  34          1HH1      ARG  34   3.560  -6.029  -8.659
  281   1HH2  ARG  34          1HH2      ARG  34   4.811  -2.822  -8.239
  282   2HH2  ARG  34          2HH2      ARG  34   4.423  -4.319  -7.458
  283    H    GLU  35           H        GLU  35   2.426  -8.304 -14.490
  284    HA   GLU  35           HA       GLU  35   0.975  -9.569 -12.450
  285   1HB   GLU  35          2HB       GLU  35   2.122 -11.506 -13.051
  286   2HB   GLU  35          1HB       GLU  35   2.339 -10.517 -14.485
  287   1HG   GLU  35          2HG       GLU  35   4.562  -9.855 -13.751
  288   2HG   GLU  35          1HG       GLU  35   4.341 -10.687 -12.211
  289    H    SER  36           H        SER  36   1.334  -9.962 -10.263
  290    HA   SER  36           HA       SER  36   3.586  -8.539  -9.005
  291   1HB   SER  36          2HB       SER  36   1.243 -10.067  -7.832
  292   2HB   SER  36          1HB       SER  36   2.451  -9.206  -6.894
  293    HG   SER  36           HG       SER  36   1.673  -7.330  -7.529
  294    H    GLU  37           H        GLU  37   5.088  -9.593  -7.643
  295    HA   GLU  37           HA       GLU  37   5.336 -12.538  -8.106
  296   1HB   GLU  37          2HB       GLU  37   7.389 -10.387  -7.580
  297   2HB   GLU  37          1HB       GLU  37   7.757 -12.102  -7.420
  298   1HG   GLU  37          2HG       GLU  37   6.383 -11.592  -9.919
  299   2HG   GLU  37          1HG       GLU  37   7.817 -10.574  -9.788
  300    H    THR  38           H        THR  38   3.945 -10.692  -6.016
  301    HA   THR  38           HA       THR  38   5.310 -11.376  -3.524
  302    HB   THR  38           HB       THR  38   3.776  -9.310  -4.074
  303    HG1  THR  38           HG1      THR  38   4.438  -9.293  -2.065
  304   1HG2  THR  38          1HG2      THR  38   1.752 -11.392  -3.214
  305   2HG2  THR  38          3HG2      THR  38   1.440  -9.659  -3.306
  306   3HG2  THR  38          2HG2      THR  38   1.805 -10.569  -4.772
  307    H    THR  39           H        THR  39   2.435 -12.405  -5.300
  308    HA   THR  39           HA       THR  39   2.265 -14.727  -3.402
  309    HB   THR  39           HB       THR  39   0.282 -13.005  -3.758
  310    HG1  THR  39           HG1      THR  39  -0.631 -14.506  -2.648
  311   1HG2  THR  39          1HG2      THR  39   0.432 -13.612  -6.314
  312   2HG2  THR  39          3HG2      THR  39  -0.518 -15.017  -5.833
  313   3HG2  THR  39          2HG2      THR  39  -1.144 -13.393  -5.555
  314    H    LYS  40           H        LYS  40   0.817 -16.523  -4.829
  315    HA   LYS  40           HA       LYS  40   2.589 -17.908  -6.412
  316   1HB   LYS  40          2HB       LYS  40  -0.316 -17.753  -7.200
  317   2HB   LYS  40          1HB       LYS  40   0.757 -19.150  -7.255
  318   1HG   LYS  40          2HG       LYS  40   0.912 -18.868  -4.685
  319   2HG   LYS  40          1HG       LYS  40  -0.511 -17.840  -4.855
  320   1HD   LYS  40          2HD       LYS  40  -1.830 -19.619  -5.702
  321   2HD   LYS  40          1HD       LYS  40  -0.414 -20.609  -6.058
  322   1HE   LYS  40          2HE       LYS  40  -0.015 -20.384  -3.444
  323   2HE   LYS  40          1HE       LYS  40  -1.755 -20.089  -3.430
  324   1HZ   LYS  40          2HZ       LYS  40  -0.590 -22.383  -4.883
  325   2HZ   LYS  40          1HZ       LYS  40  -0.964 -22.483  -3.228
  326   3HZ   LYS  40          3HZ       LYS  40  -2.189 -22.164  -4.356
  327    H    GLY  41           H        GLY  41   0.467 -15.283  -7.399
  328   1HA   GLY  41          2HA       GLY  41   2.060 -14.108  -9.296
  329   2HA   GLY  41          1HA       GLY  41   1.259 -15.401 -10.192
  330    H    ALA  42           H        ALA  42   0.493 -12.757  -7.941
  331    HA   ALA  42           HA       ALA  42  -2.259 -12.524  -8.947
  332   1HB   ALA  42          1HB       ALA  42  -0.994 -11.853  -6.576
  333   2HB   ALA  42          3HB       ALA  42  -1.172 -10.296  -7.385
  334   3HB   ALA  42          2HB       ALA  42  -2.593 -11.293  -7.068
  335    H    TYR  43           H        TYR  43  -2.302  -9.643  -8.837
  336    HA   TYR  43           HA       TYR  43  -0.543  -8.993 -11.143
  337   1HB   TYR  43          2HB       TYR  43  -3.406  -9.129 -11.194
  338   2HB   TYR  43          1HB       TYR  43  -2.894  -7.451 -11.429
  339    HD1  TYR  43           HD1      TYR  43  -0.367  -7.583 -12.717
  340    HD2  TYR  43           HD2      TYR  43  -3.780 -10.126 -13.311
  341    HE1  TYR  43           HE1      TYR  43   0.462  -8.176 -14.984
  342    HE2  TYR  43           HE2      TYR  43  -2.948 -10.722 -15.568
  343    HH   TYR  43           HH       TYR  43  -1.445 -10.234 -17.160
  344    H    SER  44           H        SER  44  -1.010  -6.356 -11.465
  345    HA   SER  44           HA       SER  44  -1.097  -5.017  -8.859
  346   1HB   SER  44          2HB       SER  44   1.152  -5.816  -8.742
  347   2HB   SER  44          1HB       SER  44   1.449  -5.359 -10.420
  348    HG   SER  44           HG       SER  44   1.888  -3.421  -9.783
  349    H    LEU  45           H        LEU  45  -0.623  -2.687  -9.106
  350    HA   LEU  45           HA       LEU  45  -0.949  -1.642 -11.860
  351   1HB   LEU  45          2HB       LEU  45  -3.240  -1.759 -11.091
  352   2HB   LEU  45          1HB       LEU  45  -2.809  -0.986  -9.568
  353    HG   LEU  45           HG       LEU  45  -1.983   0.990 -10.952
  354   1HD1  LEU  45          1HD1      LEU  45  -1.975  -0.506 -13.067
  355   2HD1  LEU  45          3HD1      LEU  45  -3.708  -0.186 -13.128
  356   3HD1  LEU  45          2HD1      LEU  45  -2.560   1.149 -13.234
  357   1HD2  LEU  45          1HD2      LEU  45  -4.779   0.115 -10.530
  358   2HD2  LEU  45          3HD2      LEU  45  -3.964   1.584  -9.996
  359   3HD2  LEU  45          2HD2      LEU  45  -4.559   1.459 -11.652
  360    H    SER  46           H        SER  46   1.249  -0.990 -11.502
  361    HA   SER  46           HA       SER  46   2.117   0.614  -9.313
  362   1HB   SER  46          2HB       SER  46   3.782  -0.411 -10.689
  363   2HB   SER  46          1HB       SER  46   3.149   0.366 -12.135
  364    HG   SER  46           HG       SER  46   4.721   1.707 -11.611
  365    H    ILE  47           H        ILE  47   2.907   2.877  -9.620
  366    HA   ILE  47           HA       ILE  47   1.395   4.563 -11.484
  367    HB   ILE  47           HB       ILE  47   0.026   5.687  -9.974
  368   1HG1  ILE  47          2HG1      ILE  47   1.630   4.590  -7.641
  369   2HG1  ILE  47          1HG1      ILE  47   1.924   6.170  -8.368
  370   1HG2  ILE  47          1HG2      ILE  47   0.294   2.897  -8.818
  371   2HG2  ILE  47          3HG2      ILE  47  -1.067   3.982  -8.537
  372   3HG2  ILE  47          2HG2      ILE  47  -0.747   3.372 -10.160
  373   1HD1  ILE  47          1HD1      ILE  47  -0.869   5.480  -7.540
  374   2HD1  ILE  47          3HD1      ILE  47   0.295   5.931  -6.293
  375   3HD1  ILE  47          2HD1      ILE  47  -0.076   7.054  -7.602
  376    H    ARG  48           H        ARG  48   2.712   6.230 -12.065
  377    HA   ARG  48           HA       ARG  48   5.220   6.622 -10.575
  378   1HB   ARG  48          2HB       ARG  48   4.757   6.681 -13.204
  379   2HB   ARG  48          1HB       ARG  48   4.435   8.382 -12.864
  380   1HG   ARG  48          2HG       ARG  48   6.904   7.112 -11.726
  381   2HG   ARG  48          1HG       ARG  48   6.891   7.586 -13.425
  382   1HD   ARG  48          2HD       ARG  48   5.766   9.653 -11.692
  383   2HD   ARG  48          1HD       ARG  48   7.433   9.262 -11.268
  384    HE   ARG  48           HE       ARG  48   6.966   9.682 -14.137
  385   1HH1  ARG  48          2HH1      ARG  48   6.573  11.886 -11.757
  386   2HH1  ARG  48          1HH1      ARG  48   7.968  12.848 -12.114
  387   1HH2  ARG  48          1HH2      ARG  48   9.323  10.540 -14.319
  388   2HH2  ARG  48          2HH2      ARG  48   9.524  12.086 -13.564
  389    H    ASP  49           H        ASP  49   5.571   8.284  -9.149
  390    HA   ASP  49           HA       ASP  49   3.864  10.690  -9.289
  391   1HB   ASP  49          2HB       ASP  49   2.548   9.220  -7.858
  392   2HB   ASP  49          1HB       ASP  49   3.961   8.878  -6.859
  393    H    TRP  50           H        TRP  50   5.498  12.167  -9.406
  394    HA   TRP  50           HA       TRP  50   7.911  11.842  -7.707
  395   1HB   TRP  50          2HB       TRP  50   8.518  12.519  -9.891
  396   2HB   TRP  50          1HB       TRP  50   7.158  13.629 -10.021
  397    HD1  TRP  50           HD1      TRP  50  10.748  13.524  -9.081
  398    HE1  TRP  50           HE1      TRP  50  11.470  15.784  -8.061
  399    HE3  TRP  50           HE3      TRP  50   6.203  15.641  -8.469
  400    HZ2  TRP  50           HZ2      TRP  50  10.239  18.214  -7.155
  401    HZ3  TRP  50           HZ3      TRP  50   5.970  17.928  -7.535
  402    HH2  TRP  50           HH2      TRP  50   7.984  19.219  -6.877
  403    H    ASP  51           H        ASP  51   8.629  13.755  -6.428
  404    HA   ASP  51           HA       ASP  51   6.467  15.608  -5.610
  405   1HB   ASP  51          2HB       ASP  51   7.261  13.319  -4.078
  406   2HB   ASP  51          1HB       ASP  51   7.791  14.770  -3.226
  407    H    ASP  52           H        ASP  52   7.314  17.496  -4.500
  408    HA   ASP  52           HA       ASP  52  10.084  18.119  -5.302
  409   1HB   ASP  52          2HB       ASP  52   7.721  19.610  -5.066
  410   2HB   ASP  52          1HB       ASP  52   8.747  20.182  -3.751
  411    H    MET  53           H        MET  53   9.898  16.162  -3.270
  412    HA   MET  53           HA       MET  53  11.348  17.558  -1.137
  413   1HB   MET  53          2HB       MET  53   8.939  15.786  -0.692
  414   2HB   MET  53          1HB       MET  53  10.096  16.164   0.582
  415   1HG   MET  53          2HG       MET  53   9.064  18.124   0.957
  416   2HG   MET  53          1HG       MET  53   9.348  18.607  -0.714
  417   1HE   MET  53          3HE       MET  53   8.093  16.373  -2.248
  418   2HE   MET  53          2HE       MET  53   6.403  16.788  -2.536
  419   3HE   MET  53          1HE       MET  53   7.652  18.012  -2.748
  420    H    LYS  54           H        LYS  54  11.550  15.346  -3.405
  421    HA   LYS  54           HA       LYS  54  13.656  13.902  -2.142
  422   1HB   LYS  54          2HB       LYS  54  12.431  11.626  -2.296
  423   2HB   LYS  54          1HB       LYS  54  12.074  12.663  -0.915
  424   1HG   LYS  54          2HG       LYS  54  10.031  13.435  -1.908
  425   2HG   LYS  54          1HG       LYS  54  10.445  12.725  -3.468
  426   1HD   LYS  54          2HD       LYS  54   9.355  10.855  -2.840
  427   2HD   LYS  54          1HD       LYS  54  10.581  10.613  -1.596
  428   1HE   LYS  54          2HE       LYS  54   9.263  11.525   0.073
  429   2HE   LYS  54          1HE       LYS  54   8.392  12.576  -1.044
  430   1HZ   LYS  54          1HZ       LYS  54   7.513  10.357  -1.985
  431   2HZ   LYS  54          3HZ       LYS  54   7.981   9.714  -0.487
  432   3HZ   LYS  54          2HZ       LYS  54   6.839  10.970  -0.551
  433    H    GLY  55           H        GLY  55  11.387  14.170  -4.825
  434   1HA   GLY  55          2HA       GLY  55  12.572  14.206  -7.051
  435   2HA   GLY  55          1HA       GLY  55  13.366  12.744  -6.489
  436    H    ASP  56           H        ASP  56  12.330  11.893  -8.553
  437    HA   ASP  56           HA       ASP  56   9.456  11.605  -8.627
  438   1HB   ASP  56          2HB       ASP  56  10.091   9.776 -10.356
  439   2HB   ASP  56          1HB       ASP  56  10.518  11.442 -10.732
  440    H    HIS  57           H        HIS  57   8.508   9.270  -8.711
  441    HA   HIS  57           HA       HIS  57   9.838   7.248  -7.104
  442   1HB   HIS  57          2HB       HIS  57   7.785   9.063  -5.893
  443   2HB   HIS  57          1HB       HIS  57   7.771   7.360  -5.439
  444    HD1  HIS  57           HD1      HIS  57   9.748  10.503  -5.072
  445    HD2  HIS  57           HD2      HIS  57  10.137   6.478  -4.055
  446    HE1  HIS  57           HE1      HIS  57  11.675  10.360  -3.436
  447    H    VAL  58           H        VAL  58   7.894   5.583  -6.469
  448    HA   VAL  58           HA       VAL  58   5.767   5.533  -8.464
  449    HB   VAL  58           HB       VAL  58   8.304   4.050  -8.811
  450   1HG1  VAL  58          2HG1      VAL  58   5.605   2.709  -9.018
  451   2HG1  VAL  58          1HG1      VAL  58   6.929   2.232 -10.080
  452   3HG1  VAL  58          3HG1      VAL  58   7.099   2.071  -8.333
  453   1HG2  VAL  58          2HG2      VAL  58   6.026   4.960 -10.569
  454   2HG2  VAL  58          1HG2      VAL  58   7.619   5.700 -10.411
  455   3HG2  VAL  58          3HG2      VAL  58   7.452   4.121 -11.182
  456    H    LYS  59           H        LYS  59   4.088   4.800  -7.323
  457    HA   LYS  59           HA       LYS  59   4.563   2.909  -5.072
  458   1HB   LYS  59          2HB       LYS  59   2.990   5.198  -5.247
  459   2HB   LYS  59          1HB       LYS  59   1.824   3.889  -5.439
  460   1HG   LYS  59          2HG       LYS  59   1.917   4.103  -3.113
  461   2HG   LYS  59          1HG       LYS  59   3.102   2.829  -3.400
  462   1HD   LYS  59          2HD       LYS  59   4.637   5.082  -3.700
  463   2HD   LYS  59          1HD       LYS  59   3.505   5.591  -2.448
  464   1HE   LYS  59          2HE       LYS  59   4.444   4.227  -0.904
  465   2HE   LYS  59          1HE       LYS  59   4.505   2.870  -2.030
  466   1HZ   LYS  59          2HZ       LYS  59   6.364   5.122  -2.367
  467   2HZ   LYS  59          1HZ       LYS  59   6.689   3.944  -1.189
  468   3HZ   LYS  59          3HZ       LYS  59   6.551   3.495  -2.818
  469    H    HIS  60           H        HIS  60   2.301   1.442  -4.928
  470    HA   HIS  60           HA       HIS  60   1.546   0.579  -7.634
  471   1HB   HIS  60          2HB       HIS  60   2.698  -1.514  -5.820
  472   2HB   HIS  60          1HB       HIS  60   2.414  -1.597  -7.555
  473    HD1  HIS  60           HD1      HIS  60   4.343  -1.025  -9.036
  474    HD2  HIS  60           HD2      HIS  60   4.915   0.378  -5.153
  475    HE1  HIS  60           HE1      HIS  60   6.688  -0.074  -8.961
  476    H    TYR  61           H        TYR  61  -0.263  -0.704  -7.708
  477    HA   TYR  61           HA       TYR  61  -1.719  -1.041  -5.112
  478   1HB   TYR  61          2HB       TYR  61  -2.763  -0.356  -7.873
  479   2HB   TYR  61          1HB       TYR  61  -3.819  -0.887  -6.568
  480    HD1  TYR  61           HD1      TYR  61  -1.193   1.644  -7.407
  481    HD2  TYR  61           HD2      TYR  61  -4.607   0.686  -4.983
  482    HE1  TYR  61           HE1      TYR  61  -1.206   3.955  -6.507
  483    HE2  TYR  61           HE2      TYR  61  -4.621   2.994  -4.088
  484    HH   TYR  61           HH       TYR  61  -2.307   5.433  -5.258
  485    H    LYS  62           H        LYS  62  -1.114  -3.158  -4.746
  486    HA   LYS  62           HA       LYS  62  -0.811  -5.212  -6.642
  487   1HB   LYS  62          2HB       LYS  62   0.038  -5.608  -4.480
  488   2HB   LYS  62          1HB       LYS  62  -1.493  -5.212  -3.705
  489   1HG   LYS  62          2HG       LYS  62  -1.136  -7.634  -3.679
  490   2HG   LYS  62          1HG       LYS  62  -2.504  -7.240  -4.724
  491   1HD   LYS  62          2HD       LYS  62  -1.460  -8.390  -6.362
  492   2HD   LYS  62          1HD       LYS  62  -0.252  -7.105  -6.394
  493   1HE   LYS  62          2HE       LYS  62  -0.073  -9.313  -4.354
  494   2HE   LYS  62          1HE       LYS  62   0.546  -9.558  -5.986
  495   1HZ   LYS  62          2HZ       LYS  62   1.573  -7.169  -5.403
  496   2HZ   LYS  62          1HZ       LYS  62   1.554  -7.870  -3.855
  497   3HZ   LYS  62          3HZ       LYS  62   2.385  -8.634  -5.120
  498    H    ILE  63           H        ILE  63  -2.288  -5.984  -8.019
  499    HA   ILE  63           HA       ILE  63  -5.166  -5.787  -7.456
  500    HB   ILE  63           HB       ILE  63  -3.552  -6.773  -9.812
  501   1HG1  ILE  63          2HG1      ILE  63  -5.265  -4.356  -9.211
  502   2HG1  ILE  63          1HG1      ILE  63  -3.570  -4.393  -9.696
  503   1HG2  ILE  63          2HG2      ILE  63  -6.558  -6.714  -9.405
  504   2HG2  ILE  63          1HG2      ILE  63  -5.772  -6.958 -10.964
  505   3HG2  ILE  63          3HG2      ILE  63  -5.560  -8.142  -9.676
  506   1HD1  ILE  63          3HD1      ILE  63  -4.586  -5.661 -11.804
  507   2HD1  ILE  63          2HD1      ILE  63  -6.029  -4.757 -11.345
  508   3HD1  ILE  63          1HD1      ILE  63  -4.537  -3.899 -11.732
  509    H    ARG  64           H        ARG  64  -5.887  -7.367  -6.037
  510    HA   ARG  64           HA       ARG  64  -4.829 -10.132  -6.398
  511   1HB   ARG  64          2HB       ARG  64  -5.367  -8.602  -4.090
  512   2HB   ARG  64          1HB       ARG  64  -6.630  -9.829  -4.154
  513   1HG   ARG  64          2HG       ARG  64  -4.597 -10.608  -2.933
  514   2HG   ARG  64          1HG       ARG  64  -4.968 -11.599  -4.344
  515   1HD   ARG  64          2HD       ARG  64  -2.961 -11.124  -5.242
  516   2HD   ARG  64          1HD       ARG  64  -3.299  -9.396  -5.146
  517    HE   ARG  64           HE       ARG  64  -1.696  -9.404  -3.426
  518   1HH1  ARG  64          2HH1      ARG  64  -2.703 -12.601  -3.819
  519   2HH1  ARG  64          1HH1      ARG  64  -2.384 -13.079  -2.185
  520   1HH2  ARG  64          1HH2      ARG  64  -1.671  -9.864  -1.103
  521   2HH2  ARG  64          2HH2      ARG  64  -1.798 -11.530  -0.647
  522    H    LYS  65           H        LYS  65  -6.242 -11.808  -6.950
  523    HA   LYS  65           HA       LYS  65  -8.996 -10.924  -7.678
  524   1HB   LYS  65          2HB       LYS  65  -8.128 -11.665  -9.697
  525   2HB   LYS  65          1HB       LYS  65  -7.045 -12.818  -8.928
  526   1HG   LYS  65          2HG       LYS  65  -9.197 -14.160  -8.329
  527   2HG   LYS  65          1HG       LYS  65 -10.003 -13.139  -9.512
  528   1HD   LYS  65          2HD       LYS  65  -9.254 -15.156 -10.624
  529   2HD   LYS  65          1HD       LYS  65  -8.265 -13.811 -11.192
  530   1HE   LYS  65          2HE       LYS  65  -6.382 -14.728 -10.348
  531   2HE   LYS  65          1HE       LYS  65  -7.152 -15.037  -8.791
  532   1HZ   LYS  65          2HZ       LYS  65  -8.000 -16.726 -10.998
  533   2HZ   LYS  65          1HZ       LYS  65  -6.408 -16.963 -10.455
  534   3HZ   LYS  65          3HZ       LYS  65  -7.705 -17.125  -9.373
  535    H    LEU  66           H        LEU  66 -10.701 -11.905  -6.710
  536    HA   LEU  66           HA       LEU  66 -10.110 -14.061  -4.757
  537   1HB   LEU  66          2HB       LEU  66 -12.593 -12.400  -5.291
  538   2HB   LEU  66          1HB       LEU  66 -12.569 -13.750  -4.165
  539    HG   LEU  66           HG       LEU  66 -12.028 -12.180  -2.627
  540   1HD1  LEU  66          3HD1      LEU  66  -9.378 -12.292  -4.100
  541   2HD1  LEU  66          2HD1      LEU  66  -9.597 -11.624  -2.482
  542   3HD1  LEU  66          1HD1      LEU  66  -9.885 -13.339  -2.774
  543   1HD2  LEU  66          2HD2      LEU  66 -11.111 -10.506  -4.966
  544   2HD2  LEU  66          1HD2      LEU  66 -12.612 -10.339  -4.057
  545   3HD2  LEU  66          3HD2      LEU  66 -11.071  -9.946  -3.293
  546    H    ASP  67           H        ASP  67 -10.740 -16.160  -5.161
  547    HA   ASP  67           HA       ASP  67 -11.642 -16.855  -7.832
  548   1HB   ASP  67          2HB       ASP  67 -10.791 -18.239  -5.404
  549   2HB   ASP  67          1HB       ASP  67 -12.125 -19.060  -6.207
  550    H    ASN  68           H        ASN  68 -13.105 -15.896  -4.925
  551    HA   ASN  68           HA       ASN  68 -15.719 -17.121  -5.439
  552   1HB   ASN  68          2HB       ASN  68 -14.864 -15.000  -3.452
  553   2HB   ASN  68          1HB       ASN  68 -16.382 -15.901  -3.421
  554   1HD2  ASN  68          2HD2      ASN  68 -13.152 -17.511  -1.676
  555   2HD2  ASN  68          1HD2      ASN  68 -13.241 -15.887  -2.159
  556    H    GLY  69           H        GLY  69 -14.018 -14.462  -6.646
  557   1HA   GLY  69          2HA       GLY  69 -16.552 -13.331  -7.602
  558   2HA   GLY  69          1HA       GLY  69 -15.558 -12.249  -6.640
  559    H    GLY  70           H        GLY  70 -13.501 -11.587  -7.517
  560   1HA   GLY  70          2HA       GLY  70 -12.659 -12.473 -10.135
  561   2HA   GLY  70          1HA       GLY  70 -13.504 -10.941 -10.218
  562    H    TYR  71           H        TYR  71 -12.371  -9.109  -9.799
  563    HA   TYR  71           HA       TYR  71  -9.630  -9.478  -8.622
  564   1HB   TYR  71          2HB       TYR  71 -10.552  -7.755 -10.920
  565   2HB   TYR  71          1HB       TYR  71  -9.011  -7.494 -10.100
  566    HD1  TYR  71           HD1      TYR  71 -11.036 -10.162 -11.771
  567    HD2  TYR  71           HD2      TYR  71  -7.132  -8.730 -10.712
  568    HE1  TYR  71           HE1      TYR  71 -10.011 -11.968 -13.128
  569    HE2  TYR  71           HE2      TYR  71  -6.098 -10.538 -12.066
  570    HH   TYR  71           HH       TYR  71  -6.467 -12.347 -13.299
  571    H    TYR  72           H        TYR  72  -8.729  -7.389  -7.717
  572    HA   TYR  72           HA       TYR  72 -10.432  -5.173  -7.088
  573   1HB   TYR  72          2HB       TYR  72 -11.128  -5.612  -4.852
  574   2HB   TYR  72          1HB       TYR  72 -11.573  -7.040  -5.780
  575    HD1  TYR  72           HD1      TYR  72 -10.170  -9.093  -5.671
  576    HD2  TYR  72           HD2      TYR  72  -9.468  -5.717  -3.126
  577    HE1  TYR  72           HE1      TYR  72  -8.752 -10.498  -4.194
  578    HE2  TYR  72           HE2      TYR  72  -8.046  -7.098  -1.659
  579    HH   TYR  72           HH       TYR  72  -8.096 -10.171  -1.426
  580    H    ILE  73           H        ILE  73  -8.898  -3.593  -6.709
  581    HA   ILE  73           HA       ILE  73  -6.230  -4.373  -5.741
  582    HB   ILE  73           HB       ILE  73  -7.485  -1.791  -6.671
  583   1HG1  ILE  73          2HG1      ILE  73  -4.980  -3.337  -7.379
  584   2HG1  ILE  73          1HG1      ILE  73  -6.457  -3.229  -8.338
  585   1HG2  ILE  73          2HG2      ILE  73  -6.261  -1.289  -4.552
  586   2HG2  ILE  73          1HG2      ILE  73  -4.808  -1.975  -5.279
  587   3HG2  ILE  73          3HG2      ILE  73  -5.545  -0.531  -5.973
  588   1HD1  ILE  73          3HD1      ILE  73  -5.488  -0.583  -7.661
  589   2HD1  ILE  73          2HD1      ILE  73  -4.230  -1.515  -8.472
  590   3HD1  ILE  73          1HD1      ILE  73  -5.794  -1.279  -9.252
  591    H    THR  74           H        THR  74  -9.210  -3.064  -4.585
  592    HA   THR  74           HA       THR  74  -8.103  -3.056  -1.823
  593    HB   THR  74           HB       THR  74  -8.518  -0.833  -1.783
  594    HG1  THR  74           HG1      THR  74 -10.253  -0.852  -0.653
  595   1HG2  THR  74          1HG2      THR  74  -8.716  -0.805  -4.273
  596   2HG2  THR  74          3HG2      THR  74 -10.439  -1.145  -4.103
  597   3HG2  THR  74          2HG2      THR  74  -9.776   0.371  -3.492
  598    H    THR  75           H        THR  75  -9.393  -4.086  -0.350
  599    HA   THR  75           HA       THR  75 -11.272  -5.996  -1.353
  600    HB   THR  75           HB       THR  75 -11.779  -6.352   1.117
  601    HG1  THR  75           HG1      THR  75  -9.564  -4.727   1.607
  602   1HG2  THR  75          3HG2      THR  75  -9.451  -6.831  -0.472
  603   2HG2  THR  75          2HG2      THR  75  -8.942  -6.562   1.199
  604   3HG2  THR  75          1HG2      THR  75 -10.114  -7.828   0.827
  605    H    ARG  76           H        ARG  76 -11.716  -2.725  -0.864
  606    HA   ARG  76           HA       ARG  76 -14.416  -2.750   0.164
  607   1HB   ARG  76          2HB       ARG  76 -12.547  -0.799  -0.187
  608   2HB   ARG  76          1HB       ARG  76 -13.592  -0.499  -1.575
  609   1HG   ARG  76          2HG       ARG  76 -15.059  -1.036   0.920
  610   2HG   ARG  76          1HG       ARG  76 -14.067   0.421   0.977
  611   1HD   ARG  76          2HD       ARG  76 -15.323   1.497  -0.611
  612   2HD   ARG  76          1HD       ARG  76 -15.649   0.013  -1.506
  613    HE   ARG  76           HE       ARG  76 -17.011   0.049   1.057
  614   1HH1  ARG  76          1HH2      ARG  76 -18.637  -1.209  -0.751
  615   2HH1  ARG  76          2HH2      ARG  76 -19.659   0.001  -1.454
  616   1HH2  ARG  76          2HH1      ARG  76 -17.647   2.649  -0.471
  617   2HH2  ARG  76          1HH1      ARG  76 -19.099   2.185  -1.294
  618    H    ALA  77           H        ALA  77 -13.019  -3.421  -2.936
  619    HA   ALA  77           HA       ALA  77 -15.643  -4.022  -4.027
  620   1HB   ALA  77          1HB       ALA  77 -14.382  -1.410  -4.577
  621   2HB   ALA  77          3HB       ALA  77 -14.971  -2.269  -6.000
  622   3HB   ALA  77          2HB       ALA  77 -16.077  -1.887  -4.680
  623    H    GLN  78           H        GLN  78 -15.410  -5.560  -5.572
  624    HA   GLN  78           HA       GLN  78 -12.754  -5.922  -6.828
  625   1HB   GLN  78          2HB       GLN  78 -14.481  -8.259  -6.999
  626   2HB   GLN  78          1HB       GLN  78 -12.863  -8.130  -6.347
  627   1HG   GLN  78          2HG       GLN  78 -15.217  -7.169  -4.758
  628   2HG   GLN  78          1HG       GLN  78 -14.718  -8.854  -4.721
  629   1HE2  GLN  78          2HE2      GLN  78 -12.766  -6.254  -2.425
  630   2HE2  GLN  78          1HE2      GLN  78 -14.297  -5.971  -3.099
  631    H    PHE  79           H        PHE  79 -13.417  -7.593  -8.892
  632    HA   PHE  79           HA       PHE  79 -15.752  -6.541 -10.329
  633   1HB   PHE  79          2HB       PHE  79 -12.893  -6.049 -11.210
  634   2HB   PHE  79          1HB       PHE  79 -14.269  -5.946 -12.310
  635    HD1  PHE  79           HD1      PHE  79 -12.834  -4.585  -9.171
  636    HD2  PHE  79           HD2      PHE  79 -15.720  -4.063 -12.301
  637    HE1  PHE  79           HE1      PHE  79 -13.340  -2.328  -8.316
  638    HE2  PHE  79           HE2      PHE  79 -16.228  -1.786 -11.451
  639    HZ   PHE  79           HZ       PHE  79 -15.038  -0.915  -9.453
  640    H    GLU  80           H        GLU  80 -14.985  -7.556 -12.843
  641    HA   GLU  80           HA       GLU  80 -14.845 -10.434 -12.128
  642   1HB   GLU  80          2HB       GLU  80 -15.857 -10.758 -14.410
  643   2HB   GLU  80          1HB       GLU  80 -16.859  -9.820 -13.304
  644   1HG   GLU  80          2HG       GLU  80 -15.078  -8.039 -14.673
  645   2HG   GLU  80          1HG       GLU  80 -15.912  -9.038 -15.862
  646    H    THR  81           H        THR  81 -13.212  -7.945 -13.986
  647    HA   THR  81           HA       THR  81 -11.033  -9.878 -14.490
  648    HB   THR  81           HB       THR  81 -11.838 -10.269 -16.598
  649    HG1  THR  81           HG1      THR  81 -11.296  -7.763 -17.535
  650   1HG2  THR  81          2HG2      THR  81 -13.932  -8.945 -15.966
  651   2HG2  THR  81          1HG2      THR  81 -13.137  -7.565 -16.725
  652   3HG2  THR  81          3HG2      THR  81 -13.518  -8.998 -17.677
  653    H    LEU  82           H        LEU  82  -9.270  -8.535 -15.872
  654    HA   LEU  82           HA       LEU  82  -8.597  -6.258 -14.175
  655   1HB   LEU  82          2HB       LEU  82  -7.232  -7.758 -16.390
  656   2HB   LEU  82          1HB       LEU  82  -6.625  -6.171 -15.918
  657    HG   LEU  82           HG       LEU  82  -7.225  -7.980 -13.662
  658   1HD1  LEU  82          2HD1      LEU  82  -6.195  -9.394 -15.616
  659   2HD1  LEU  82          1HD1      LEU  82  -4.707  -8.539 -15.206
  660   3HD1  LEU  82          3HD1      LEU  82  -5.515  -9.538 -13.995
  661   1HD2  LEU  82          1HD2      LEU  82  -4.865  -6.258 -14.474
  662   2HD2  LEU  82          3HD2      LEU  82  -6.143  -5.815 -13.343
  663   3HD2  LEU  82          2HD2      LEU  82  -5.007  -7.098 -12.930
  664    H    GLN  83           H        GLN  83  -9.740  -6.818 -17.448
  665    HA   GLN  83           HA       GLN  83  -9.427  -4.057 -18.280
  666   1HB   GLN  83          2HB       GLN  83  -9.619  -6.184 -19.768
  667   2HB   GLN  83          1HB       GLN  83 -11.357  -6.005 -19.526
  668   1HG   GLN  83          2HG       GLN  83  -9.743  -3.619 -20.371
  669   2HG   GLN  83          1HG       GLN  83 -10.190  -4.827 -21.577
  670   1HE2  GLN  83          2HE2      GLN  83 -12.899  -2.115 -20.818
  671   2HE2  GLN  83          1HE2      GLN  83 -11.213  -1.926 -20.780
  672    H    GLN  84           H        GLN  84 -11.918  -5.992 -16.744
  673    HA   GLN  84           HA       GLN  84 -14.047  -4.059 -17.106
  674   1HB   GLN  84          2HB       GLN  84 -13.659  -6.510 -15.423
  675   2HB   GLN  84          1HB       GLN  84 -14.993  -5.422 -15.070
  676   1HG   GLN  84          2HG       GLN  84 -15.404  -7.390 -16.737
  677   2HG   GLN  84          1HG       GLN  84 -16.035  -5.801 -17.126
  678   1HE2  GLN  84          2HE2      GLN  84 -13.825  -7.485 -19.876
  679   2HE2  GLN  84          1HE2      GLN  84 -14.811  -8.264 -18.735
  680    H    LEU  85           H        LEU  85 -11.618  -4.675 -14.623
  681    HA   LEU  85           HA       LEU  85 -12.761  -2.611 -12.859
  682   1HB   LEU  85          2HB       LEU  85 -11.268  -3.318 -11.262
  683   2HB   LEU  85          1HB       LEU  85 -11.301  -4.771 -12.255
  684    HG   LEU  85           HG       LEU  85  -9.377  -3.258 -13.509
  685   1HD1  LEU  85          2HD1      LEU  85  -9.721  -1.837 -11.255
  686   2HD1  LEU  85          1HD1      LEU  85  -8.592  -3.049 -10.644
  687   3HD1  LEU  85          3HD1      LEU  85  -8.137  -2.030 -12.009
  688   1HD2  LEU  85          2HD2      LEU  85  -9.528  -5.708 -12.646
  689   2HD2  LEU  85          1HD2      LEU  85  -7.944  -4.957 -12.842
  690   3HD2  LEU  85          3HD2      LEU  85  -8.672  -5.077 -11.238
  691    H    VAL  86           H        VAL  86 -10.202  -2.797 -15.290
  692    HA   VAL  86           HA       VAL  86  -9.150  -0.200 -14.588
  693    HB   VAL  86           HB       VAL  86  -8.080  -0.218 -16.783
  694   1HG1  VAL  86          3HG1      VAL  86  -8.070  -2.597 -15.039
  695   2HG1  VAL  86          2HG1      VAL  86  -7.444  -2.884 -16.662
  696   3HG1  VAL  86          1HG1      VAL  86  -6.717  -1.640 -15.644
  697   1HG2  VAL  86          1HG2      VAL  86  -9.899  -2.563 -17.351
  698   2HG2  VAL  86          3HG2      VAL  86 -10.046  -0.961 -18.066
  699   3HG2  VAL  86          2HG2      VAL  86  -8.644  -1.968 -18.433
  700    H    GLN  87           H        GLN  87 -11.920  -1.468 -16.112
  701    HA   GLN  87           HA       GLN  87 -12.707   0.867 -17.614
  702   1HB   GLN  87          2HB       GLN  87 -13.487  -1.477 -18.053
  703   2HB   GLN  87          1HB       GLN  87 -14.423  -1.387 -16.571
  704   1HG   GLN  87          2HG       GLN  87 -15.884  -0.810 -18.415
  705   2HG   GLN  87          1HG       GLN  87 -15.563   0.646 -17.474
  706   1HE2  GLN  87          2HE2      GLN  87 -15.022   1.667 -20.975
  707   2HE2  GLN  87          1HE2      GLN  87 -16.332   1.268 -19.972
  708    H    HIS  88           H        HIS  88 -13.587  -0.529 -14.485
  709    HA   HIS  88           HA       HIS  88 -15.516   1.496 -13.829
  710   1HB   HIS  88          2HB       HIS  88 -15.190  -0.895 -12.841
  711   2HB   HIS  88          1HB       HIS  88 -14.013  -0.117 -11.791
  712    HD1  HIS  88           HD1      HIS  88 -17.658  -0.489 -12.355
  713    HD2  HIS  88           HD2      HIS  88 -15.156   1.926 -10.057
  714    HE1  HIS  88           HE1      HIS  88 -19.136   0.645 -10.638
  715    H    TYR  89           H        TYR  89 -12.140   0.949 -13.146
  716    HA   TYR  89           HA       TYR  89 -11.821   3.224 -11.416
  717   1HB   TYR  89          2HB       TYR  89  -9.885   1.453 -12.904
  718   2HB   TYR  89          1HB       TYR  89  -9.343   2.814 -11.930
  719    HD1  TYR  89           HD1      TYR  89 -11.859   0.052 -11.596
  720    HD2  TYR  89           HD2      TYR  89  -8.630   2.217  -9.787
  721    HE1  TYR  89           HE1      TYR  89 -12.028  -1.383  -9.619
  722    HE2  TYR  89           HE2      TYR  89  -8.806   0.778  -7.772
  723    HH   TYR  89           HH       TYR  89 -11.135  -1.919  -7.644
  724    H    SER  90           H        SER  90 -11.956   2.749 -14.820
  725    HA   SER  90           HA       SER  90 -10.454   5.062 -15.611
  726   1HB   SER  90          2HB       SER  90 -11.800   2.922 -16.904
  727   2HB   SER  90          1HB       SER  90 -12.490   4.421 -17.526
  728    HG   SER  90           HG       SER  90 -10.443   3.485 -18.489
  729    H    GLU  91           H        GLU  91 -13.822   4.421 -14.828
  730    HA   GLU  91           HA       GLU  91 -14.586   7.197 -15.490
  731   1HB   GLU  91          2HB       GLU  91 -16.263   5.004 -14.231
  732   2HB   GLU  91          1HB       GLU  91 -16.850   6.497 -14.963
  733   1HG   GLU  91          2HG       GLU  91 -15.239   5.310 -16.933
  734   2HG   GLU  91          1HG       GLU  91 -16.164   3.978 -16.237
  735    H    ARG  92           H        ARG  92 -13.377   5.409 -12.850
  736    HA   ARG  92           HA       ARG  92 -13.801   7.751 -11.086
  737   1HB   ARG  92          2HB       ARG  92 -14.409   5.088  -9.880
  738   2HB   ARG  92          1HB       ARG  92 -15.014   6.683  -9.434
  739   1HG   ARG  92          2HG       ARG  92 -16.421   6.730 -11.450
  740   2HG   ARG  92          1HG       ARG  92 -15.791   5.158 -11.940
  741   1HD   ARG  92          2HD       ARG  92 -17.604   4.344 -10.825
  742   2HD   ARG  92          1HD       ARG  92 -16.616   4.620  -9.388
  743    HE   ARG  92           HE       ARG  92 -17.943   6.542  -8.887
  744   1HH1  ARG  92          1HH2      ARG  92 -18.440   8.213 -10.985
  745   2HH1  ARG  92          2HH2      ARG  92 -19.985   7.781 -11.641
  746   1HH2  ARG  92          2HH1      ARG  92 -20.041   4.652 -10.147
  747   2HH2  ARG  92          1HH1      ARG  92 -20.891   5.765 -11.167
  748    H    ALA  93           H        ALA  93 -12.235   7.854  -9.401
  749    HA   ALA  93           HA       ALA  93  -9.722   6.588  -9.969
  750   1HB   ALA  93          2HB       ALA  93  -9.886   8.754  -8.786
  751   2HB   ALA  93          1HB       ALA  93 -10.645   7.944  -7.415
  752   3HB   ALA  93          3HB       ALA  93  -8.972   7.580  -7.838
  753    H    ALA  94           H        ALA  94 -12.423   5.746  -7.917
  754    HA   ALA  94           HA       ALA  94 -12.912   3.619  -7.008
  755   1HB   ALA  94          1HB       ALA  94 -10.765   2.997  -8.649
  756   2HB   ALA  94          3HB       ALA  94 -10.201   2.513  -7.050
  757   3HB   ALA  94          2HB       ALA  94 -11.696   1.842  -7.697
  758    H    GLY  95           H        GLY  95 -10.473   5.806  -6.079
  759   1HA   GLY  95          2HA       GLY  95 -10.582   6.429  -3.657
  760   2HA   GLY  95          1HA       GLY  95 -10.590   4.704  -3.308
  761    H    LEU  96           H        LEU  96  -8.498   5.397  -5.896
  762    HA   LEU  96           HA       LEU  96  -6.188   5.264  -4.008
  763   1HB   LEU  96          2HB       LEU  96  -4.990   4.533  -6.222
  764   2HB   LEU  96          1HB       LEU  96  -6.034   3.383  -5.394
  765    HG   LEU  96           HG       LEU  96  -7.336   5.186  -7.366
  766   1HD1  LEU  96          3HD1      LEU  96  -5.197   4.480  -8.465
  767   2HD1  LEU  96          2HD1      LEU  96  -5.670   2.800  -8.210
  768   3HD1  LEU  96          1HD1      LEU  96  -6.634   3.838  -9.260
  769   1HD2  LEU  96          1HD2      LEU  96  -7.591   2.415  -6.261
  770   2HD2  LEU  96          3HD2      LEU  96  -8.831   3.650  -6.476
  771   3HD2  LEU  96          2HD2      LEU  96  -8.255   2.729  -7.865
  772    H    SER  97           H        SER  97  -4.219   6.076  -5.900
  773    HA   SER  97           HA       SER  97  -4.239   8.877  -5.558
  774   1HB   SER  97          2HB       SER  97  -2.188   7.579  -5.974
  775   2HB   SER  97          1HB       SER  97  -2.733   7.247  -7.618
  776    HG   SER  97           HG       SER  97  -2.933   9.766  -7.505
  777    H    SER  98           H        SER  98  -4.683   7.108  -8.643
  778    HA   SER  98           HA       SER  98  -6.694   9.116  -9.438
  779   1HB   SER  98          2HB       SER  98  -4.512   8.665 -11.421
  780   2HB   SER  98          1HB       SER  98  -5.525  10.086 -11.171
  781    HG   SER  98           HG       SER  98  -3.227   9.259  -9.795
  782    H    ARG  99           H        ARG  99  -7.998   8.429 -11.169
  783    HA   ARG  99           HA       ARG  99  -8.616   5.712 -11.391
  784   1HB   ARG  99          2HB       ARG  99  -9.528   6.492 -13.749
  785   2HB   ARG  99          1HB       ARG  99 -10.266   7.097 -12.266
  786   1HG   ARG  99          2HG       ARG  99  -9.187   9.183 -12.438
  787   2HG   ARG  99          1HG       ARG  99  -7.958   8.558 -13.539
  788   1HD   ARG  99          2HD       ARG  99  -9.662   8.280 -15.297
  789   2HD   ARG  99          1HD       ARG  99 -10.903   8.881 -14.197
  790    HE   ARG  99           HE       ARG  99  -9.231  10.977 -14.161
  791   1HH1  ARG  99          2HH1      ARG  99 -11.134   9.490 -16.514
  792   2HH1  ARG  99          1HH1      ARG  99 -10.574  10.471 -17.828
  793   1HH2  ARG  99          1HH2      ARG  99  -8.097  12.022 -15.964
  794   2HH2  ARG  99          2HH2      ARG  99  -8.855  11.904 -17.516
  795    H    LEU 100           H        LEU 100  -6.919   4.300 -11.795
  796    HA   LEU 100           HA       LEU 100  -5.034   3.395 -12.912
  797   1HB   LEU 100          2HB       LEU 100  -5.994   3.381 -15.553
  798   2HB   LEU 100          1HB       LEU 100  -6.187   2.110 -14.353
  799    HG   LEU 100           HG       LEU 100  -8.202   3.849 -13.646
  800   1HD1  LEU 100          2HD1      LEU 100  -7.426   4.364 -16.421
  801   2HD1  LEU 100          1HD1      LEU 100  -9.122   3.910 -16.250
  802   3HD1  LEU 100          3HD1      LEU 100  -8.486   5.295 -15.362
  803   1HD2  LEU 100          2HD2      LEU 100  -8.240   1.353 -14.000
  804   2HD2  LEU 100          1HD2      LEU 100  -9.677   2.203 -14.560
  805   3HD2  LEU 100          3HD2      LEU 100  -8.462   1.671 -15.721
  806    H    VAL 101           H        VAL 101  -4.236   3.762 -15.638
  807    HA   VAL 101           HA       VAL 101  -2.300   5.708 -15.521
  808    HB   VAL 101           HB       VAL 101  -3.596   5.810 -18.154
  809   1HG1  VAL 101          3HG1      VAL 101  -0.981   5.709 -16.956
  810   2HG1  VAL 101          2HG1      VAL 101  -1.110   4.453 -18.191
  811   3HG1  VAL 101          1HG1      VAL 101  -1.424   6.141 -18.609
  812   1HG2  VAL 101          2HG2      VAL 101  -2.796   3.121 -17.014
  813   2HG2  VAL 101          1HG2      VAL 101  -4.425   3.604 -17.486
  814   3HG2  VAL 101          3HG2      VAL 101  -3.166   3.443 -18.707
  815    H    VAL 102           H        VAL 102  -2.377   7.853 -15.097
  816    HA   VAL 102           HA       VAL 102  -4.709   9.382 -16.165
  817    HB   VAL 102           HB       VAL 102  -4.840   9.032 -13.685
  818   1HG1  VAL 102          1HG1      VAL 102  -2.122   9.429 -13.771
  819   2HG1  VAL 102          3HG1      VAL 102  -2.695  10.991 -13.186
  820   3HG1  VAL 102          2HG1      VAL 102  -3.099   9.518 -12.305
  821   1HG2  VAL 102          1HG2      VAL 102  -5.323  11.302 -15.161
  822   2HG2  VAL 102          3HG2      VAL 102  -5.793  11.085 -13.474
  823   3HG2  VAL 102          2HG2      VAL 102  -4.291  11.920 -13.871
  824    HA   PRO 103           HA       PRO 103  -0.495  11.361 -17.079
  825   1HB   PRO 103          2HB       PRO 103  -0.110  10.494 -19.657
  826   2HB   PRO 103          1HB       PRO 103   0.551   9.660 -18.241
  827   1HG   PRO 103          2HG       PRO 103  -1.779   8.908 -19.962
  828   2HG   PRO 103          1HG       PRO 103  -0.689   7.866 -19.036
  829   1HD   PRO 103          2HD       PRO 103  -3.297   8.615 -18.257
  830   2HD   PRO 103          1HD       PRO 103  -2.052   7.910 -17.207
  831    H    SER 104           H        SER 104  -2.157  10.721 -20.130
  832    HA   SER 104           HA       SER 104  -3.937  12.904 -20.195
  833   1HB   SER 104          2HB       SER 104  -1.499  13.995 -20.046
  834   2HB   SER 104          1HB       SER 104  -1.531  13.698 -21.785
  835    HG   SER 104           HG       SER 104  -3.803  14.820 -20.647
  836    H    HIS 105           H        HIS 105  -3.842  10.262 -21.114
  837    HA   HIS 105           HA       HIS 105  -3.276  10.128 -23.949
  838   1HB   HIS 105          2HB       HIS 105  -4.447   7.985 -23.876
  839   2HB   HIS 105          1HB       HIS 105  -3.396   8.123 -22.465
  840    HD1  HIS 105           HD1      HIS 105  -6.954   7.837 -23.469
  841    HD2  HIS 105           HD2      HIS 105  -4.820   8.703 -19.995
  842    HE1  HIS 105           HE1      HIS 105  -8.602   7.658 -21.553
  843    H    LYS 106           HN       LYS 106  -6.249  10.638 -22.051
  844    HA   LYS 106           HA       LYS 106  -8.206  10.603 -23.983
  845   1HB   LYS 106          2HB       LYS 106  -7.891  11.816 -21.425
  846   2HB   LYS 106          1HB       LYS 106  -8.581  13.029 -22.503
  847   1HG   LYS 106          2HG       LYS 106  -9.748  10.331 -22.784
  848   2HG   LYS 106          1HG       LYS 106 -10.043  11.099 -21.224
  849   1HD   LYS 106          2HD       LYS 106 -11.784  12.074 -22.344
  850   2HD   LYS 106          1HD       LYS 106 -10.531  13.190 -22.887
  851   1HE   LYS 106          2HE       LYS 106 -10.200  11.894 -24.924
  852   2HE   LYS 106          1HE       LYS 106 -11.336  10.666 -24.366
  853   1HZ   LYS 106          1HZ       LYS 106 -12.610  13.141 -24.209
  854   2HZ   LYS 106          3HZ       LYS 106 -11.880  13.053 -25.739
  855   3HZ   LYS 106          2HZ       LYS 106 -12.968  11.844 -25.247
  856   1H    GLU 201          3HT       GLU 201   8.120   1.124   5.115
  857   2H    GLU 201          2HT       GLU 201   9.295  -0.005   5.594
  858   3H    GLU 201          1HT       GLU 201   9.307   0.620   4.015
  859    HA   GLU 201           HA       GLU 201   8.369  -1.453   3.707
  860   1HB   GLU 201          2HB       GLU 201   6.466  -2.170   5.300
  861   2HB   GLU 201          1HB       GLU 201   8.109  -2.214   5.938
  862   1HG   GLU 201          2HG       GLU 201   7.718  -0.528   7.412
  863   2HG   GLU 201          1HG       GLU 201   6.750   0.385   6.254
  864    HA   PRO 202           HA       PRO 202   5.254   1.425   1.962
  865   1HB   PRO 202          2HB       PRO 202   6.024   1.003  -0.644
  866   2HB   PRO 202          1HB       PRO 202   6.748   2.236   0.404
  867   1HG   PRO 202          2HG       PRO 202   7.877  -0.382  -0.471
  868   2HG   PRO 202          1HG       PRO 202   8.721   1.100   0.009
  869   1HD   PRO 202          2HD       PRO 202   8.363  -1.201   1.620
  870   2HD   PRO 202          1HD       PRO 202   8.904   0.395   2.183
  871    H    GLN 203           H        GLN 203   3.935  -0.528   2.797
  872    HA   GLN 203           HA       GLN 203   3.518  -2.847   1.182
  873   1HB   GLN 203          2HB       GLN 203   1.476  -3.164   2.481
  874   2HB   GLN 203          1HB       GLN 203   2.764  -2.614   3.553
  875   1HG   GLN 203          2HG       GLN 203   1.543  -0.278   2.526
  876   2HG   GLN 203          1HG       GLN 203   0.229  -1.359   2.994
  877   1HE2  GLN 203          2HE2      GLN 203   2.299   0.530   5.864
  878   2HE2  GLN 203          1HE2      GLN 203   2.428   0.924   4.218
  879   1HN   PTR 204          1HN       PTR 204   1.655  -3.315  -0.206
  880    HA   PTR 204           HA       PTR 204   1.197  -1.420  -2.235
  881   1HB   PTR 204          1HB       PTR 204  -0.958  -2.852  -2.622
  882    HD1  PTR 204           HD1      PTR 204   0.699  -2.237  -4.550
  883    HD2  PTR 204           HD2      PTR 204   1.271  -5.514  -1.829
  884    HE1  PTR 204           HE1      PTR 204   2.265  -3.301  -6.155
  885    HE2  PTR 204           HE2      PTR 204   2.836  -6.573  -3.433
  886    H    GLU 205           H        GLU 205   0.492   0.615  -1.645
  887    HA   GLU 205           HA       GLU 205  -1.181   1.400   0.414
  888   1HB   GLU 205          2HB       GLU 205  -0.888   2.449  -2.398
  889   2HB   GLU 205          1HB       GLU 205  -2.008   3.204  -1.264
  890   1HG   GLU 205          2HG       GLU 205   0.841   2.669  -0.452
  891   2HG   GLU 205          1HG       GLU 205   0.437   4.108  -1.388
  892    H    GLU 206           H        GLU 206  -3.118   0.547   0.990
  893    HA   GLU 206           HA       GLU 206  -4.921  -0.481  -1.139
  894   1HB   GLU 206          2HB       GLU 206  -4.519  -1.045   1.752
  895   2HB   GLU 206          1HB       GLU 206  -6.176  -1.150   1.159
  896   1HG   GLU 206          2HG       GLU 206  -5.732  -3.143   0.221
  897   2HG   GLU 206          1HG       GLU 206  -4.455  -2.412  -0.751
  898    H    ILE 207           H        ILE 207  -6.686   0.691  -1.724
  899    HA   ILE 207           HA       ILE 207  -7.226   3.299  -0.968
  900    HB   ILE 207           HB       ILE 207  -9.056   1.097  -1.924
  901   1HG1  ILE 207          2HG1      ILE 207  -9.072   3.080  -3.784
  902   2HG1  ILE 207          1HG1      ILE 207  -7.471   3.321  -3.082
  903   1HG2  ILE 207          2HG2      ILE 207  -9.749   3.941  -1.177
  904   2HG2  ILE 207          1HG2      ILE 207 -10.683   3.044  -2.374
  905   3HG2  ILE 207          3HG2      ILE 207 -10.581   2.456  -0.713
  906   1HD1  ILE 207          3HD1      ILE 207  -7.617   0.568  -3.346
  907   2HD1  ILE 207          2HD1      ILE 207  -8.446   1.147  -4.792
  908   3HD1  ILE 207          1HD1      ILE 207  -6.790   1.659  -4.460
  909    HA   PRO 208           HA       PRO 208  -8.622   2.808   3.220
  910   1HB   PRO 208          2HB       PRO 208  -9.264   5.451   3.619
  911   2HB   PRO 208          1HB       PRO 208  -7.603   4.831   3.651
  912   1HG   PRO 208          2HG       PRO 208  -8.968   6.430   1.537
  913   2HG   PRO 208          1HG       PRO 208  -7.243   6.322   1.924
  914   1HD   PRO 208          2HD       PRO 208  -8.550   5.008  -0.218
  915   2HD   PRO 208          1HD       PRO 208  -6.911   4.665   0.375
  916    H    ILE 209           H        ILE 209 -10.678   4.090   4.420
  917    HA   ILE 209           HA       ILE 209 -13.030   4.491   2.823
  918    HB   ILE 209           HB       ILE 209 -12.707   2.007   2.523
  919   1HG1  ILE 209          2HG1      ILE 209 -15.125   1.591   3.709
  920   2HG1  ILE 209          1HG1      ILE 209 -15.093   3.353   3.655
  921   1HG2  ILE 209          1HG2      ILE 209 -13.245   2.018   5.509
  922   2HG2  ILE 209          3HG2      ILE 209 -13.217   0.578   4.493
  923   3HG2  ILE 209          2HG2      ILE 209 -11.745   1.521   4.727
  924   1HD1  ILE 209          2HD1      ILE 209 -14.118   2.294   1.158
  925   2HD1  ILE 209          1HD1      ILE 209 -15.690   1.586   1.530
  926   3HD1  ILE 209          3HD1      ILE 209 -15.509   3.338   1.446
  927    H    TYR 210           H        TYR 210 -11.569   5.547   5.177
  928    HA   TYR 210           HA       TYR 210 -13.427   5.063   7.420
  929   1HB   TYR 210          2HB       TYR 210 -10.789   6.416   7.062
  930   2HB   TYR 210          1HB       TYR 210 -11.821   6.973   8.376
  931    HD1  TYR 210           HD1      TYR 210 -10.060   4.036   6.961
  932    HD2  TYR 210           HD2      TYR 210 -12.246   5.604  10.311
  933    HE1  TYR 210           HE1      TYR 210  -9.398   2.067   8.315
  934    HE2  TYR 210           HE2      TYR 210 -11.584   3.635  11.665
  935    HH   TYR 210           HH       TYR 210  -9.764   0.948  10.230
  936    H    LEU 211           HN       LEU 211 -13.732   7.457   8.621
  937    HA   LEU 211           HA       LEU 211 -15.830   8.727   7.273
  938   1HB   LEU 211          2HB       LEU 211 -15.277   9.077   9.676
  939   2HB   LEU 211          1HB       LEU 211 -13.887  10.049   9.191
  940    HG   LEU 211           HG       LEU 211 -16.033  11.113   7.740
  941   1HD1  LEU 211          3HD1      LEU 211 -17.156   9.699   9.843
  942   2HD1  LEU 211          2HD1      LEU 211 -17.028  11.335  10.489
  943   3HD1  LEU 211          1HD1      LEU 211 -17.918  11.044   8.994
  944   1HD2  LEU 211          3HD2      LEU 211 -13.985  12.060   9.191
  945   2HD2  LEU 211          2HD2      LEU 211 -15.367  13.068   8.763
  946   3HD2  LEU 211          1HD2      LEU 211 -15.279  12.324  10.360
   
  No H/Q in entry =         946
  Start of MODEL   20
    1   1H    SER   1          3HT       SER   1  -2.130  -9.868 -22.858
    2   2H    SER   1          2HT       SER   1  -0.789 -10.164 -23.859
    3   3H    SER   1          1HT       SER   1  -0.572  -9.467 -22.324
    4    HA   SER   1           HA       SER   1  -0.745  -7.455 -23.191
    5   1HB   SER   1          2HB       SER   1  -0.636  -7.186 -25.528
    6   2HB   SER   1          1HB       SER   1   0.010  -8.808 -25.285
    7    HG   SER   1           HG       SER   1  -2.429  -9.317 -25.490
    8    H    ILE   2           H        ILE   2  -2.832  -7.757 -21.714
    9    HA   ILE   2           HA       ILE   2  -5.413  -7.938 -22.855
   10    HB   ILE   2           HB       ILE   2  -4.614  -6.176 -20.522
   11   1HG1  ILE   2          2HG1      ILE   2  -5.685  -8.679 -19.693
   12   2HG1  ILE   2          1HG1      ILE   2  -4.408  -9.021 -20.860
   13   1HG2  ILE   2          3HG2      ILE   2  -7.143  -6.979 -21.754
   14   2HG2  ILE   2          2HG2      ILE   2  -7.072  -7.373 -20.037
   15   3HG2  ILE   2          1HG2      ILE   2  -6.826  -5.710 -20.571
   16   1HD1  ILE   2          3HD1      ILE   2  -3.279  -7.017 -19.345
   17   2HD1  ILE   2          2HD1      ILE   2  -4.216  -7.904 -18.142
   18   3HD1  ILE   2          1HD1      ILE   2  -2.997  -8.741 -19.102
   19    H    GLN   3           H        GLN   3  -4.164  -4.820 -21.683
   20    HA   GLN   3           HA       GLN   3  -5.626  -3.480 -23.870
   21   1HB   GLN   3          2HB       GLN   3  -5.913  -2.454 -21.725
   22   2HB   GLN   3          1HB       GLN   3  -4.176  -2.462 -21.418
   23   1HG   GLN   3          2HG       GLN   3  -4.929  -0.212 -22.085
   24   2HG   GLN   3          1HG       GLN   3  -3.846  -0.890 -23.302
   25   1HE2  GLN   3          2HE2      GLN   3  -7.542   0.182 -24.403
   26   2HE2  GLN   3          1HE2      GLN   3  -6.834   0.642 -22.930
   27    H    ALA   4           H        ALA   4  -2.541  -2.439 -22.508
   28    HA   ALA   4           HA       ALA   4  -1.037  -3.089 -24.917
   29   1HB   ALA   4          1HB       ALA   4  -2.203  -0.380 -24.488
   30   2HB   ALA   4          3HB       ALA   4  -0.566  -0.474 -25.136
   31   3HB   ALA   4          2HB       ALA   4  -1.899  -1.243 -25.996
   32    H    GLU   5           H        GLU   5  -0.781  -0.311 -22.706
   33    HA   GLU   5           HA       GLU   5   1.136  -1.531 -20.950
   34   1HB   GLU   5          2HB       GLU   5   3.152  -0.311 -21.725
   35   2HB   GLU   5          1HB       GLU   5   2.582  -1.448 -22.946
   36   1HG   GLU   5          2HG       GLU   5   1.286   0.496 -23.967
   37   2HG   GLU   5          1HG       GLU   5   2.194   1.553 -22.886
   38    H    GLU   6           H        GLU   6  -1.221   0.230 -21.006
   39    HA   GLU   6           HA       GLU   6  -0.093   2.755 -19.917
   40   1HB   GLU   6          2HB       GLU   6  -3.013   2.172 -20.418
   41   2HB   GLU   6          1HB       GLU   6  -2.217   3.742 -20.307
   42   1HG   GLU   6          2HG       GLU   6  -1.100   3.418 -22.407
   43   2HG   GLU   6          1HG       GLU   6  -1.573   1.720 -22.467
   44    H    TRP   7           H        TRP   7  -2.639   0.369 -19.152
   45    HA   TRP   7           HA       TRP   7  -2.200   1.007 -16.273
   46   1HB   TRP   7          2HB       TRP   7  -4.462   0.010 -15.920
   47   2HB   TRP   7          1HB       TRP   7  -4.501   1.426 -16.967
   48    HD1  TRP   7           HD1      TRP   7  -5.273   1.116 -19.421
   49    HE1  TRP   7           HE1      TRP   7  -6.198  -0.881 -20.763
   50    HE3  TRP   7           HE3      TRP   7  -4.255  -2.681 -16.164
   51    HZ2  TRP   7           HZ2      TRP   7  -6.470  -3.720 -20.488
   52    HZ3  TRP   7           HZ3      TRP   7  -4.855  -5.017 -16.728
   53    HH2  TRP   7           HH2      TRP   7  -5.960  -5.541 -18.883
   54    H    TYR   8           H        TYR   8  -1.426  -1.235 -18.600
   55    HA   TYR   8           HA       TYR   8  -0.766  -3.244 -16.572
   56   1HB   TYR   8          2HB       TYR   8  -2.786  -4.208 -16.969
   57   2HB   TYR   8          1HB       TYR   8  -2.935  -3.520 -18.580
   58    HD1  TYR   8           HD1      TYR   8  -1.860  -4.584 -20.519
   59    HD2  TYR   8           HD2      TYR   8  -1.648  -6.318 -16.591
   60    HE1  TYR   8           HE1      TYR   8  -1.102  -6.731 -21.504
   61    HE2  TYR   8           HE2      TYR   8  -0.882  -8.454 -17.574
   62    HH   TYR   8           HH       TYR   8   0.269  -8.753 -20.669
   63    H    PHE   9           H        PHE   9   1.190  -4.054 -17.009
   64    HA   PHE   9           HA       PHE   9   2.341  -3.610 -19.714
   65   1HB   PHE   9          2HB       PHE   9   3.519  -4.107 -16.982
   66   2HB   PHE   9          1HB       PHE   9   4.489  -4.334 -18.435
   67    HD1  PHE   9           HD1      PHE   9   1.831  -1.835 -18.505
   68    HD2  PHE   9           HD2      PHE   9   5.998  -2.477 -17.671
   69    HE1  PHE   9           HE1      PHE   9   2.228   0.607 -18.606
   70    HE2  PHE   9           HE2      PHE   9   6.392  -0.033 -17.776
   71    HZ   PHE   9           HZ       PHE   9   4.507   1.509 -18.243
   72    H    GLY  10           H        GLY  10   1.814  -6.154 -17.294
   73   1HA   GLY  10          2HA       GLY  10   1.083  -8.304 -18.671
   74   2HA   GLY  10          1HA       GLY  10   2.754  -8.203 -19.218
   75    H    LYS  11           H        LYS  11   4.203  -9.281 -18.001
   76    HA   LYS  11           HA       LYS  11   3.427 -10.048 -15.225
   77   1HB   LYS  11          2HB       LYS  11   5.620 -11.342 -16.850
   78   2HB   LYS  11          1HB       LYS  11   4.738 -12.006 -15.473
   79   1HG   LYS  11          2HG       LYS  11   3.157 -12.857 -16.835
   80   2HG   LYS  11          1HG       LYS  11   2.886 -11.277 -17.571
   81   1HD   LYS  11          2HD       LYS  11   3.852 -12.063 -19.451
   82   2HD   LYS  11          1HD       LYS  11   5.373 -12.169 -18.564
   83   1HE   LYS  11          2HE       LYS  11   3.642 -14.392 -17.884
   84   2HE   LYS  11          1HE       LYS  11   3.888 -14.311 -19.628
   85   1HZ   LYS  11          2HZ       LYS  11   6.245 -13.893 -17.981
   86   2HZ   LYS  11          1HZ       LYS  11   5.602 -15.466 -17.967
   87   3HZ   LYS  11          3HZ       LYS  11   6.071 -14.755 -19.434
   88    H    LEU  12           H        LEU  12   4.150  -7.772 -14.790
   89    HA   LEU  12           HA       LEU  12   7.122  -7.515 -14.733
   90   1HB   LEU  12          2HB       LEU  12   5.765  -5.760 -15.921
   91   2HB   LEU  12          1HB       LEU  12   5.042  -5.347 -14.368
   92    HG   LEU  12           HG       LEU  12   7.306  -4.911 -13.458
   93   1HD1  LEU  12          3HD1      LEU  12   8.073  -6.310 -15.807
   94   2HD1  LEU  12          2HD1      LEU  12   8.694  -4.666 -15.965
   95   3HD1  LEU  12          1HD1      LEU  12   9.128  -5.641 -14.560
   96   1HD2  LEU  12          2HD2      LEU  12   6.045  -3.413 -15.657
   97   2HD2  LEU  12          1HD2      LEU  12   6.562  -2.860 -14.062
   98   3HD2  LEU  12          3HD2      LEU  12   7.738  -3.009 -15.370
   99    H    GLY  13           H        GLY  13   8.034  -6.415 -12.787
  100   1HA   GLY  13          2HA       GLY  13   6.560  -7.271 -10.336
  101   2HA   GLY  13          1HA       GLY  13   8.315  -7.122 -10.447
  102    H    ARG  14           H        ARG  14   7.802  -5.734  -8.441
  103    HA   ARG  14           HA       ARG  14   6.639  -3.093  -8.989
  104   1HB   ARG  14          2HB       ARG  14   7.367  -2.648  -6.609
  105   2HB   ARG  14          1HB       ARG  14   6.262  -4.009  -6.797
  106   1HG   ARG  14          2HG       ARG  14   9.116  -4.709  -7.057
  107   2HG   ARG  14          1HG       ARG  14   8.654  -4.129  -5.458
  108   1HD   ARG  14          2HD       ARG  14   6.573  -5.823  -6.088
  109   2HD   ARG  14          1HD       ARG  14   7.956  -6.644  -6.810
  110    HE   ARG  14           HE       ARG  14   7.564  -6.126  -3.926
  111   1HH1  ARG  14          2HH1      ARG  14  10.418  -5.657  -5.042
  112   2HH1  ARG  14          1HH1      ARG  14  11.139  -7.194  -4.697
  113   1HH2  ARG  14          1HH2      ARG  14   8.112  -8.781  -4.114
  114   2HH2  ARG  14          2HH2      ARG  14   9.834  -8.962  -4.171
  115    H    LYS  15           H        LYS  15   9.800  -4.523  -8.995
  116    HA   LYS  15           HA       LYS  15  11.288  -2.113  -8.584
  117   1HB   LYS  15          2HB       LYS  15  11.919  -4.795  -8.715
  118   2HB   LYS  15          1HB       LYS  15  12.590  -4.170 -10.222
  119   1HG   LYS  15          2HG       LYS  15  13.810  -2.435  -8.980
  120   2HG   LYS  15          1HG       LYS  15  13.108  -3.009  -7.466
  121   1HD   LYS  15          2HD       LYS  15  14.334  -5.188  -8.952
  122   2HD   LYS  15          1HD       LYS  15  15.494  -3.898  -8.639
  123   1HE   LYS  15          2HE       LYS  15  15.422  -4.203  -6.365
  124   2HE   LYS  15          1HE       LYS  15  13.719  -4.659  -6.377
  125   1HZ   LYS  15          3HZ       LYS  15  14.829  -6.679  -7.737
  126   2HZ   LYS  15          2HZ       LYS  15  16.078  -6.311  -6.645
  127   3HZ   LYS  15          1HZ       LYS  15  14.529  -6.709  -6.068
  128    H    ASP  16           H        ASP  16  10.148  -3.876 -11.435
  129    HA   ASP  16           HA       ASP  16  11.399  -2.097 -13.284
  130   1HB   ASP  16          2HB       ASP  16  10.440  -4.509 -13.610
  131   2HB   ASP  16          1HB       ASP  16   8.935  -3.654 -13.896
  132    H    ALA  17           H        ALA  17   8.260  -2.348 -11.741
  133    HA   ALA  17           HA       ALA  17   6.829  -0.428 -13.190
  134   1HB   ALA  17          2HB       ALA  17   6.770  -1.012 -10.223
  135   2HB   ALA  17          1HB       ALA  17   5.580  -0.008 -11.052
  136   3HB   ALA  17          3HB       ALA  17   5.733  -1.716 -11.465
  137    H    GLU  18           H        GLU  18   9.104   0.048 -10.512
  138    HA   GLU  18           HA       GLU  18   8.832   2.940 -10.533
  139   1HB   GLU  18          2HB       GLU  18  11.417   1.768  -9.645
  140   2HB   GLU  18          1HB       GLU  18  10.383   2.944  -8.836
  141   1HG   GLU  18          2HG       GLU  18   8.745   0.924  -8.548
  142   2HG   GLU  18          1HG       GLU  18  10.178  -0.056  -8.857
  143    H    ARG  19           H        ARG  19  10.733   0.599 -12.276
  144    HA   ARG  19           HA       ARG  19  12.628   2.489 -13.384
  145   1HB   ARG  19          2HB       ARG  19  11.758  -0.276 -14.257
  146   2HB   ARG  19          1HB       ARG  19  13.039   0.635 -15.056
  147   1HG   ARG  19          2HG       ARG  19  13.136   0.278 -12.076
  148   2HG   ARG  19          1HG       ARG  19  13.639  -1.052 -13.118
  149   1HD   ARG  19          2HD       ARG  19  14.771   1.412 -14.094
  150   2HD   ARG  19          1HD       ARG  19  15.155   1.224 -12.383
  151    HE   ARG  19           HE       ARG  19  16.230  -0.920 -12.931
  152   1HH1  ARG  19          2HH1      ARG  19  16.602   1.559 -15.065
  153   2HH1  ARG  19          1HH1      ARG  19  17.017   0.592 -16.440
  154   1HH2  ARG  19          1HH2      ARG  19  16.164  -2.406 -14.918
  155   2HH2  ARG  19          2HH2      ARG  19  16.769  -1.654 -16.357
  156    H    GLN  20           H        GLN  20  10.314   0.604 -15.319
  157    HA   GLN  20           HA       GLN  20  10.180   2.196 -17.550
  158   1HB   GLN  20          2HB       GLN  20   8.688   0.073 -16.595
  159   2HB   GLN  20          1HB       GLN  20   7.490   1.363 -16.717
  160   1HG   GLN  20          2HG       GLN  20   9.419   0.872 -18.975
  161   2HG   GLN  20          1HG       GLN  20   7.966  -0.116 -18.819
  162   1HE2  GLN  20          2HE2      GLN  20   7.658   3.604 -20.321
  163   2HE2  GLN  20          1HE2      GLN  20   9.151   2.847 -20.043
  164    H    LEU  21           H        LEU  21   8.540   2.832 -14.464
  165    HA   LEU  21           HA       LEU  21   7.001   5.061 -15.467
  166   1HB   LEU  21          2HB       LEU  21   7.674   3.947 -12.787
  167   2HB   LEU  21          1HB       LEU  21   7.143   5.627 -12.852
  168    HG   LEU  21           HG       LEU  21   5.138   4.913 -14.144
  169   1HD1  LEU  21          3HD1      LEU  21   6.662   2.464 -14.284
  170   2HD1  LEU  21          2HD1      LEU  21   5.086   2.148 -13.560
  171   3HD1  LEU  21          1HD1      LEU  21   5.191   2.901 -15.151
  172   1HD2  LEU  21          3HD2      LEU  21   5.490   4.831 -11.476
  173   2HD2  LEU  21          2HD2      LEU  21   3.963   4.392 -12.240
  174   3HD2  LEU  21          1HD2      LEU  21   5.101   3.134 -11.757
  175    H    LEU  22           H        LEU  22   9.753   5.121 -13.196
  176    HA   LEU  22           HA       LEU  22  10.276   7.919 -13.691
  177   1HB   LEU  22          2HB       LEU  22  12.234   5.924 -12.536
  178   2HB   LEU  22          1HB       LEU  22  12.149   7.658 -12.231
  179    HG   LEU  22           HG       LEU  22  10.169   5.539 -11.359
  180   1HD1  LEU  22          3HD1      LEU  22  12.318   6.023 -10.040
  181   2HD1  LEU  22          2HD1      LEU  22  11.623   7.609  -9.705
  182   3HD1  LEU  22          1HD1      LEU  22  10.803   6.152  -9.146
  183   1HD2  LEU  22          1HD2      LEU  22   9.774   8.363 -11.948
  184   2HD2  LEU  22          3HD2      LEU  22   8.581   7.133 -11.535
  185   3HD2  LEU  22          2HD2      LEU  22   9.432   8.001 -10.256
  186    H    SER  23           H        SER  23  12.347   5.079 -14.400
  187    HA   SER  23           HA       SER  23  14.267   6.221 -15.995
  188   1HB   SER  23          2HB       SER  23  12.800   3.635 -16.594
  189   2HB   SER  23          1HB       SER  23  14.368   4.092 -17.262
  190    HG   SER  23           HG       SER  23  14.815   2.887 -15.494
  191    H    PHE  24           H        PHE  24  11.281   4.848 -17.443
  192    HA   PHE  24           HA       PHE  24  11.547   5.835 -20.017
  193   1HB   PHE  24          2HB       PHE  24   9.632   4.440 -19.150
  194   2HB   PHE  24          1HB       PHE  24   8.947   5.915 -18.466
  195    HD1  PHE  24           HD1      PHE  24  10.050   4.325 -21.651
  196    HD2  PHE  24           HD2      PHE  24   7.754   7.460 -19.822
  197    HE1  PHE  24           HE1      PHE  24   9.059   4.886 -23.855
  198    HE2  PHE  24           HE2      PHE  24   6.762   8.021 -22.024
  199    HZ   PHE  24           HZ       PHE  24   7.415   6.733 -24.041
  200    H    GLY  25           H        GLY  25  10.306   7.598 -17.195
  201   1HA   GLY  25          2HA       GLY  25  10.791   9.970 -16.892
  202   2HA   GLY  25          1HA       GLY  25  10.912  10.130 -18.643
  203    H    ASN  26           H        ASN  26   8.314   8.313 -17.145
  204    HA   ASN  26           HA       ASN  26   6.364  10.131 -18.389
  205   1HB   ASN  26          2HB       ASN  26   6.343   7.401 -17.248
  206   2HB   ASN  26          1HB       ASN  26   4.861   8.325 -17.003
  207   1HD2  ASN  26          2HD2      ASN  26   5.269   6.611 -20.506
  208   2HD2  ASN  26          1HD2      ASN  26   5.904   6.067 -19.029
  209    HA   PRO  27           HA       PRO  27   5.648  12.380 -14.663
  210   1HB   PRO  27          2HB       PRO  27   3.283  13.555 -15.426
  211   2HB   PRO  27          1HB       PRO  27   4.870  14.079 -16.008
  212   1HG   PRO  27          2HG       PRO  27   2.754  12.524 -17.432
  213   2HG   PRO  27          1HG       PRO  27   4.008  13.580 -18.101
  214   1HD   PRO  27          2HD       PRO  27   4.062  10.741 -18.046
  215   2HD   PRO  27          1HD       PRO  27   5.431  11.807 -18.426
  216    H    ARG  28           H        ARG  28   3.937  12.583 -12.939
  217    HA   ARG  28           HA       ARG  28   2.954  10.179 -11.975
  218   1HB   ARG  28          2HB       ARG  28   1.324  11.518 -10.657
  219   2HB   ARG  28          1HB       ARG  28   2.934  12.235 -10.639
  220   1HG   ARG  28          2HG       ARG  28   1.491  13.221 -12.923
  221   2HG   ARG  28          1HG       ARG  28   0.507  13.448 -11.478
  222   1HD   ARG  28          2HD       ARG  28   2.013  14.904 -10.516
  223   2HD   ARG  28          1HD       ARG  28   3.404  14.132 -11.276
  224    HE   ARG  28           HE       ARG  28   1.628  15.549 -13.136
  225   1HH1  ARG  28          1HH2      ARG  28   3.984  15.652 -14.381
  226   2HH1  ARG  28          2HH2      ARG  28   4.900  16.973 -13.738
  227   1HH2  ARG  28          2HH1      ARG  28   2.977  17.255 -10.866
  228   2HH2  ARG  28          1HH1      ARG  28   4.330  17.881 -11.748
  229    H    GLY  29           H        GLY  29   0.532   9.585 -11.753
  230   1HA   GLY  29          2HA       GLY  29  -1.608   9.253 -12.746
  231   2HA   GLY  29          1HA       GLY  29  -1.125  10.306 -14.076
  232    H    THR  30           H        THR  30   1.430   8.316 -13.770
  233    HA   THR  30           HA       THR  30   0.540   6.633 -16.008
  234    HB   THR  30           HB       THR  30   3.201   6.290 -14.676
  235    HG1  THR  30           HG1      THR  30   2.200   8.601 -15.828
  236   1HG2  THR  30          2HG2      THR  30   1.995   5.384 -17.013
  237   2HG2  THR  30          1HG2      THR  30   3.059   6.677 -17.563
  238   3HG2  THR  30          3HG2      THR  30   3.718   5.323 -16.647
  239    H    PHE  31           H        PHE  31  -1.095   5.581 -14.520
  240    HA   PHE  31           HA       PHE  31  -0.006   3.700 -12.536
  241   1HB   PHE  31          2HB       PHE  31  -2.798   4.268 -13.560
  242   2HB   PHE  31          1HB       PHE  31  -2.448   3.009 -12.376
  243    HD1  PHE  31           HD1      PHE  31  -1.403   6.579 -12.936
  244    HD2  PHE  31           HD2      PHE  31  -2.868   3.630 -10.179
  245    HE1  PHE  31           HE1      PHE  31  -1.422   8.278 -11.130
  246    HE2  PHE  31           HE2      PHE  31  -2.887   5.329  -8.373
  247    HZ   PHE  31           HZ       PHE  31  -2.164   7.650  -8.848
  248    H    LEU  32           H        LEU  32   0.545   1.612 -13.042
  249    HA   LEU  32           HA       LEU  32  -0.572   0.482 -15.572
  250   1HB   LEU  32          2HB       LEU  32   1.600  -0.632 -15.968
  251   2HB   LEU  32          1HB       LEU  32   1.778   1.122 -15.938
  252    HG   LEU  32           HG       LEU  32   2.305   0.817 -13.420
  253   1HD1  LEU  32          2HD1      LEU  32   2.309  -1.990 -14.463
  254   2HD1  LEU  32          1HD1      LEU  32   3.526  -1.547 -13.265
  255   3HD1  LEU  32          3HD1      LEU  32   1.812  -1.385 -12.884
  256   1HD2  LEU  32          1HD2      LEU  32   4.223  -0.224 -15.530
  257   2HD2  LEU  32          3HD2      LEU  32   3.983   1.470 -15.105
  258   3HD2  LEU  32          2HD2      LEU  32   4.686   0.356 -13.931
  259    H    ILE  33           H        ILE  33  -0.037  -2.022 -15.539
  260    HA   ILE  33           HA       ILE  33  -0.635  -3.062 -12.803
  261    HB   ILE  33           HB       ILE  33  -2.005  -3.613 -15.417
  262   1HG1  ILE  33          2HG1      ILE  33  -2.930  -3.419 -12.543
  263   2HG1  ILE  33          1HG1      ILE  33  -3.029  -2.133 -13.746
  264   1HG2  ILE  33          2HG2      ILE  33  -1.107  -5.821 -14.695
  265   2HG2  ILE  33          1HG2      ILE  33  -1.920  -5.606 -13.142
  266   3HG2  ILE  33          3HG2      ILE  33  -2.866  -5.742 -14.623
  267   1HD1  ILE  33          3HD1      ILE  33  -4.210  -4.328 -15.002
  268   2HD1  ILE  33          2HD1      ILE  33  -4.793  -4.421 -13.341
  269   3HD1  ILE  33          1HD1      ILE  33  -5.060  -2.958 -14.289
  270    H    ARG  34           H        ARG  34  -0.128  -5.519 -12.754
  271    HA   ARG  34           HA       ARG  34   1.683  -6.700 -14.597
  272   1HB   ARG  34          2HB       ARG  34   3.819  -6.402 -13.453
  273   2HB   ARG  34          1HB       ARG  34   3.157  -4.821 -13.872
  274   1HG   ARG  34          2HG       ARG  34   2.314  -4.533 -11.599
  275   2HG   ARG  34          1HG       ARG  34   2.843  -6.159 -11.168
  276   1HD   ARG  34          2HD       ARG  34   5.075  -5.565 -11.099
  277   2HD   ARG  34          1HD       ARG  34   4.880  -4.288 -12.300
  278    HE   ARG  34           HE       ARG  34   4.892  -2.947 -10.341
  279   1HH1  ARG  34          2HH1      ARG  34   4.309  -5.610  -8.715
  280   2HH1  ARG  34          1HH1      ARG  34   2.906  -5.090  -7.845
  281   1HH2  ARG  34          1HH2      ARG  34   2.408  -2.273  -9.806
  282   2HH2  ARG  34          2HH2      ARG  34   1.829  -3.200  -8.463
  283    H    GLU  35           H        GLU  35   2.356  -8.779 -13.879
  284    HA   GLU  35           HA       GLU  35   0.668  -9.973 -11.887
  285   1HB   GLU  35          2HB       GLU  35   2.896 -10.859 -13.652
  286   2HB   GLU  35          1HB       GLU  35   2.495 -11.876 -12.273
  287   1HG   GLU  35          2HG       GLU  35   0.045 -11.600 -13.049
  288   2HG   GLU  35          1HG       GLU  35   0.742 -11.046 -14.575
  289    H    SER  36           H        SER  36   0.999 -10.201  -9.738
  290    HA   SER  36           HA       SER  36   3.327  -9.045  -8.461
  291   1HB   SER  36          2HB       SER  36   1.059 -10.749  -7.393
  292   2HB   SER  36          1HB       SER  36   2.316 -10.050  -6.385
  293    HG   SER  36           HG       SER  36   1.112  -8.354  -6.362
  294    H    GLU  37           H        GLU  37   5.238 -10.061  -8.090
  295    HA   GLU  37           HA       GLU  37   5.421 -12.981  -8.569
  296   1HB   GLU  37          2HB       GLU  37   7.499 -10.865  -7.983
  297   2HB   GLU  37          1HB       GLU  37   7.867 -12.565  -8.268
  298   1HG   GLU  37          2HG       GLU  37   6.204 -11.074 -10.274
  299   2HG   GLU  37          1HG       GLU  37   7.952 -10.843 -10.273
  300    H    THR  38           H        THR  38   4.240 -11.460  -6.134
  301    HA   THR  38           HA       THR  38   5.981 -12.396  -3.953
  302    HB   THR  38           HB       THR  38   4.521 -10.221  -4.048
  303    HG1  THR  38           HG1      THR  38   5.685 -11.280  -2.219
  304   1HG2  THR  38          1HG2      THR  38   2.415 -11.461  -4.579
  305   2HG2  THR  38          3HG2      THR  38   2.492 -12.198  -2.978
  306   3HG2  THR  38          2HG2      THR  38   2.284 -10.453  -3.138
  307    H    THR  39           H        THR  39   2.825 -13.124  -5.357
  308    HA   THR  39           HA       THR  39   2.735 -15.568  -3.623
  309    HB   THR  39           HB       THR  39   0.831 -13.800  -3.607
  310    HG1  THR  39           HG1      THR  39  -0.712 -15.587  -3.548
  311   1HG2  THR  39          2HG2      THR  39   0.885 -14.185  -6.311
  312   2HG2  THR  39          1HG2      THR  39  -0.415 -15.278  -5.836
  313   3HG2  THR  39          3HG2      THR  39  -0.508 -13.565  -5.426
  314    H    LYS  40           H        LYS  40   1.113 -17.231  -4.985
  315    HA   LYS  40           HA       LYS  40   2.663 -18.543  -6.849
  316   1HB   LYS  40          2HB       LYS  40  -0.315 -18.324  -7.250
  317   2HB   LYS  40          1HB       LYS  40   0.722 -19.724  -7.516
  318   1HG   LYS  40          2HG       LYS  40   1.201 -19.584  -4.973
  319   2HG   LYS  40          1HG       LYS  40  -0.221 -18.543  -4.908
  320   1HD   LYS  40          2HD       LYS  40  -1.657 -20.263  -5.666
  321   2HD   LYS  40          1HD       LYS  40  -0.315 -21.233  -6.273
  322   1HE   LYS  40          2HE       LYS  40  -0.667 -20.581  -3.338
  323   2HE   LYS  40          1HE       LYS  40  -1.343 -22.032  -4.080
  324   1HZ   LYS  40          1HZ       LYS  40   1.450 -21.516  -4.659
  325   2HZ   LYS  40          3HZ       LYS  40   1.109 -21.897  -3.043
  326   3HZ   LYS  40          2HZ       LYS  40   0.667 -22.975  -4.279
  327    H    GLY  41           H        GLY  41   0.497 -15.829  -7.375
  328   1HA   GLY  41          2HA       GLY  41   1.830 -14.546  -9.387
  329   2HA   GLY  41          1HA       GLY  41   0.922 -15.786 -10.255
  330    H    ALA  42           H        ALA  42   0.477 -13.219  -7.838
  331    HA   ALA  42           HA       ALA  42  -2.387 -12.971  -8.476
  332   1HB   ALA  42          3HB       ALA  42  -0.522 -11.988  -6.413
  333   2HB   ALA  42          2HB       ALA  42  -1.707 -10.789  -6.932
  334   3HB   ALA  42          1HB       ALA  42  -2.247 -12.338  -6.287
  335    H    TYR  43           H        TYR  43  -2.608 -10.144  -8.409
  336    HA   TYR  43           HA       TYR  43  -1.084  -9.464 -10.885
  337   1HB   TYR  43          2HB       TYR  43  -3.885  -9.484 -10.490
  338   2HB   TYR  43          1HB       TYR  43  -3.387  -7.794 -10.568
  339    HD1  TYR  43           HD1      TYR  43  -1.023  -7.890 -12.321
  340    HD2  TYR  43           HD2      TYR  43  -4.778  -9.982 -12.614
  341    HE1  TYR  43           HE1      TYR  43  -0.725  -8.108 -14.778
  342    HE2  TYR  43           HE2      TYR  43  -4.469 -10.194 -15.063
  343    HH   TYR  43           HH       TYR  43  -1.841 -10.040 -16.603
  344    H    SER  44           H        SER  44  -1.494  -6.765 -11.008
  345    HA   SER  44           HA       SER  44  -1.032  -5.552  -8.402
  346   1HB   SER  44          2HB       SER  44   1.240  -5.645 -10.362
  347   2HB   SER  44          1HB       SER  44   1.245  -4.957  -8.730
  348    HG   SER  44           HG       SER  44   1.062  -7.661  -9.504
  349    H    LEU  45           H        LEU  45  -0.578  -3.226  -8.570
  350    HA   LEU  45           HA       LEU  45  -1.201  -2.032 -11.223
  351   1HB   LEU  45          2HB       LEU  45  -3.367  -2.249 -10.059
  352   2HB   LEU  45          1HB       LEU  45  -2.708  -1.377  -8.673
  353    HG   LEU  45           HG       LEU  45  -2.496  -0.117 -11.375
  354   1HD1  LEU  45          2HD1      LEU  45  -4.844  -0.913 -11.206
  355   2HD1  LEU  45          1HD1      LEU  45  -4.996  -0.071  -9.664
  356   3HD1  LEU  45          3HD1      LEU  45  -4.740   0.847 -11.149
  357   1HD2  LEU  45          1HD2      LEU  45  -2.562   0.701  -8.509
  358   2HD2  LEU  45          3HD2      LEU  45  -1.512   1.256  -9.813
  359   3HD2  LEU  45          2HD2      LEU  45  -3.172   1.847  -9.703
  360    H    SER  46           H        SER  46   0.957  -1.168 -11.238
  361    HA   SER  46           HA       SER  46   1.984   0.304  -8.966
  362   1HB   SER  46          2HB       SER  46   3.653  -0.554 -10.405
  363   2HB   SER  46          1HB       SER  46   2.862   0.104 -11.832
  364    HG   SER  46           HG       SER  46   3.502   2.101 -11.308
  365    H    ILE  47           H        ILE  47   2.637   2.629  -9.247
  366    HA   ILE  47           HA       ILE  47   0.790   4.240 -10.901
  367    HB   ILE  47           HB       ILE  47  -0.651   4.197  -9.096
  368   1HG1  ILE  47          2HG1      ILE  47   0.324   6.567  -9.501
  369   2HG1  ILE  47          1HG1      ILE  47  -0.598   6.295  -8.026
  370   1HG2  ILE  47          3HG2      ILE  47   1.751   3.399  -7.649
  371   2HG2  ILE  47          2HG2      ILE  47   0.722   4.473  -6.700
  372   3HG2  ILE  47          1HG2      ILE  47   0.065   2.972  -7.353
  373   1HD1  ILE  47          2HD1      ILE  47   2.091   5.621  -7.418
  374   2HD1  ILE  47          1HD1      ILE  47   2.137   7.145  -8.299
  375   3HD1  ILE  47          3HD1      ILE  47   1.169   7.003  -6.835
  376    H    ARG  48           H        ARG  48   1.978   5.859 -11.773
  377    HA   ARG  48           HA       ARG  48   4.616   6.500 -10.610
  378   1HB   ARG  48          2HB       ARG  48   4.589   6.297 -13.004
  379   2HB   ARG  48          1HB       ARG  48   3.189   7.359 -13.141
  380   1HG   ARG  48          2HG       ARG  48   5.231   8.584 -13.730
  381   2HG   ARG  48          1HG       ARG  48   4.544   9.233 -12.243
  382   1HD   ARG  48          2HD       ARG  48   6.328   8.584 -11.002
  383   2HD   ARG  48          1HD       ARG  48   6.432   7.019 -11.807
  384    HE   ARG  48           HE       ARG  48   8.046   7.945 -13.257
  385   1HH1  ARG  48          2HH1      ARG  48   6.010  10.398 -11.961
  386   2HH1  ARG  48          1HH1      ARG  48   7.054  11.699 -12.424
  387   1HH2  ARG  48          1HH2      ARG  48   9.500   9.623 -13.738
  388   2HH2  ARG  48          2HH2      ARG  48   9.028  11.261 -13.432
  389    H    ASP  49           H        ASP  49   5.059   8.400  -9.500
  390    HA   ASP  49           HA       ASP  49   3.181  10.655  -9.669
  391   1HB   ASP  49          2HB       ASP  49   2.065   9.293  -7.994
  392   2HB   ASP  49          1HB       ASP  49   3.570   9.102  -7.095
  393    H    TRP  50           H        TRP  50   4.727  12.170 -10.096
  394    HA   TRP  50           HA       TRP  50   7.272  12.180  -8.569
  395   1HB   TRP  50          2HB       TRP  50   7.655  12.640 -10.859
  396   2HB   TRP  50          1HB       TRP  50   6.224  13.660 -10.984
  397    HD1  TRP  50           HD1      TRP  50   9.876  13.831 -10.366
  398    HE1  TRP  50           HE1      TRP  50  10.553  16.222  -9.669
  399    HE3  TRP  50           HE3      TRP  50   5.286  15.788  -9.567
  400    HZ2  TRP  50           HZ2      TRP  50   9.270  18.677  -8.917
  401    HZ3  TRP  50           HZ3      TRP  50   5.005  18.156  -8.869
  402    HH2  TRP  50           HH2      TRP  50   6.995  19.603  -8.542
  403    H    ASP  51           H        ASP  51   7.939  14.281  -7.544
  404    HA   ASP  51           HA       ASP  51   5.660  16.004  -6.730
  405   1HB   ASP  51          2HB       ASP  51   6.559  13.955  -5.098
  406   2HB   ASP  51          1HB       ASP  51   7.448  15.352  -4.496
  407    H    ASP  52           H        ASP  52   6.369  18.077  -5.862
  408    HA   ASP  52           HA       ASP  52   8.943  18.937  -7.010
  409   1HB   ASP  52          2HB       ASP  52   6.490  20.161  -6.753
  410   2HB   ASP  52          1HB       ASP  52   7.412  20.897  -5.443
  411    H    MET  53           H        MET  53   9.354  17.177  -4.879
  412    HA   MET  53           HA       MET  53  10.951  18.854  -3.154
  413   1HB   MET  53          2HB       MET  53   9.906  18.402  -1.063
  414   2HB   MET  53          1HB       MET  53   8.602  18.899  -2.139
  415   1HG   MET  53          2HG       MET  53   8.952  16.077  -2.435
  416   2HG   MET  53          1HG       MET  53   8.870  16.436  -0.711
  417   1HE   MET  53          3HE       MET  53   7.503  17.173  -4.132
  418   2HE   MET  53          2HE       MET  53   5.856  17.759  -3.899
  419   3HE   MET  53          1HE       MET  53   7.221  18.776  -3.441
  420    H    LYS  54           H        LYS  54  11.052  16.424  -4.998
  421    HA   LYS  54           HA       LYS  54  13.093  15.032  -3.597
  422   1HB   LYS  54          2HB       LYS  54  11.938  12.848  -3.284
  423   2HB   LYS  54          1HB       LYS  54  11.268  14.119  -2.262
  424   1HG   LYS  54          2HG       LYS  54   9.748  14.423  -4.504
  425   2HG   LYS  54          1HG       LYS  54  10.041  12.684  -4.544
  426   1HD   LYS  54          2HD       LYS  54   8.965  14.218  -2.157
  427   2HD   LYS  54          1HD       LYS  54   7.994  13.238  -3.254
  428   1HE   LYS  54          2HE       LYS  54   9.727  11.354  -2.659
  429   2HE   LYS  54          1HE       LYS  54  10.049  12.358  -1.246
  430   1HZ   LYS  54          1HZ       LYS  54   7.344  11.452  -2.060
  431   2HZ   LYS  54          3HZ       LYS  54   8.298  10.663  -0.901
  432   3HZ   LYS  54          2HZ       LYS  54   7.765  12.252  -0.622
  433    H    GLY  55           H        GLY  55  10.767  15.076  -6.248
  434   1HA   GLY  55          2HA       GLY  55  11.824  14.861  -8.501
  435   2HA   GLY  55          1HA       GLY  55  12.720  13.512  -7.818
  436    H    ASP  56           H        ASP  56  11.629  12.401  -9.735
  437    HA   ASP  56           HA       ASP  56   8.772  11.945  -9.579
  438   1HB   ASP  56          2HB       ASP  56   9.396  10.034 -11.208
  439   2HB   ASP  56          1HB       ASP  56   9.710  11.683 -11.739
  440    H    HIS  57           H        HIS  57   7.953   9.595  -9.341
  441    HA   HIS  57           HA       HIS  57   9.549   7.765  -7.747
  442   1HB   HIS  57          2HB       HIS  57   7.584   9.610  -6.437
  443   2HB   HIS  57          1HB       HIS  57   7.716   7.956  -5.839
  444    HD1  HIS  57           HD1      HIS  57   9.502  11.211  -5.927
  445    HD2  HIS  57           HD2      HIS  57  10.339   7.288  -4.795
  446    HE1  HIS  57           HE1      HIS  57  11.641  11.296  -4.574
  447    H    VAL  58           H        VAL  58   7.743   6.115  -6.700
  448    HA   VAL  58           HA       VAL  58   5.385   5.819  -8.395
  449    HB   VAL  58           HB       VAL  58   7.101   4.942  -9.912
  450   1HG1  VAL  58          3HG1      VAL  58   7.983   3.632  -7.405
  451   2HG1  VAL  58          2HG1      VAL  58   8.085   2.643  -8.863
  452   3HG1  VAL  58          1HG1      VAL  58   8.935   4.188  -8.782
  453   1HG2  VAL  58          1HG2      VAL  58   4.896   3.804  -9.836
  454   2HG2  VAL  58          3HG2      VAL  58   6.195   2.677 -10.231
  455   3HG2  VAL  58          2HG2      VAL  58   5.517   2.707  -8.603
  456    H    LYS  59           H        LYS  59   4.138   3.888  -7.753
  457    HA   LYS  59           HA       LYS  59   4.917   2.661  -5.172
  458   1HB   LYS  59          2HB       LYS  59   3.129   4.809  -5.280
  459   2HB   LYS  59          1HB       LYS  59   2.088   3.387  -5.216
  460   1HG   LYS  59          2HG       LYS  59   2.446   3.588  -2.962
  461   2HG   LYS  59          1HG       LYS  59   3.920   2.699  -3.345
  462   1HD   LYS  59          2HD       LYS  59   4.974   4.456  -2.353
  463   2HD   LYS  59          1HD       LYS  59   4.684   5.274  -3.889
  464   1HE   LYS  59          2HE       LYS  59   2.673   6.298  -3.055
  465   2HE   LYS  59          1HE       LYS  59   2.702   5.304  -1.598
  466   1HZ   LYS  59          1HZ       LYS  59   4.995   6.383  -1.245
  467   2HZ   LYS  59          3HZ       LYS  59   4.447   7.560  -2.336
  468   3HZ   LYS  59          2HZ       LYS  59   3.602   7.288  -0.888
  469    H    HIS  60           H        HIS  60   2.766   1.076  -4.703
  470    HA   HIS  60           HA       HIS  60   1.767   0.010  -7.242
  471   1HB   HIS  60          2HB       HIS  60   3.166  -2.028  -5.608
  472   2HB   HIS  60          1HB       HIS  60   2.933  -1.958  -7.351
  473    HD1  HIS  60           HD1      HIS  60   4.626  -0.571  -8.742
  474    HD2  HIS  60           HD2      HIS  60   5.475  -0.636  -4.661
  475    HE1  HIS  60           HE1      HIS  60   6.966   0.358  -8.483
  476    H    TYR  61           H        TYR  61  -0.060  -1.140  -7.012
  477    HA   TYR  61           HA       TYR  61  -0.989  -1.658  -4.214
  478   1HB   TYR  61          2HB       TYR  61  -2.765  -1.238  -6.633
  479   2HB   TYR  61          1HB       TYR  61  -3.243  -1.254  -4.939
  480    HD1  TYR  61           HD1      TYR  61  -0.573   0.368  -4.190
  481    HD2  TYR  61           HD2      TYR  61  -3.846   0.972  -6.895
  482    HE1  TYR  61           HE1      TYR  61  -0.205   2.817  -4.082
  483    HE2  TYR  61           HE2      TYR  61  -3.481   3.422  -6.791
  484    HH   TYR  61           HH       TYR  61  -1.265   4.928  -6.217
  485    H    LYS  62           H        LYS  62  -0.352  -3.826  -4.060
  486    HA   LYS  62           HA       LYS  62  -0.326  -5.763  -6.065
  487   1HB   LYS  62          2HB       LYS  62   0.536  -6.208  -3.822
  488   2HB   LYS  62          1HB       LYS  62  -1.084  -6.119  -3.146
  489   1HG   LYS  62          2HG       LYS  62  -0.784  -8.011  -5.391
  490   2HG   LYS  62          1HG       LYS  62   0.145  -8.428  -3.950
  491   1HD   LYS  62          2HD       LYS  62  -2.728  -7.590  -3.669
  492   2HD   LYS  62          1HD       LYS  62  -2.350  -9.239  -4.164
  493   1HE   LYS  62          2HE       LYS  62  -1.990  -9.749  -2.000
  494   2HE   LYS  62          1HE       LYS  62  -0.612  -8.648  -2.013
  495   1HZ   LYS  62          2HZ       LYS  62  -3.243  -7.431  -1.770
  496   2HZ   LYS  62          1HZ       LYS  62  -2.704  -8.323  -0.428
  497   3HZ   LYS  62          3HZ       LYS  62  -1.780  -7.024  -1.007
  498    H    ILE  63           H        ILE  63  -1.914  -6.449  -7.382
  499    HA   ILE  63           HA       ILE  63  -4.722  -5.929  -6.682
  500    HB   ILE  63           HB       ILE  63  -3.224  -6.741  -9.127
  501   1HG1  ILE  63          2HG1      ILE  63  -5.318  -4.690  -8.398
  502   2HG1  ILE  63          1HG1      ILE  63  -3.626  -4.401  -8.803
  503   1HG2  ILE  63          1HG2      ILE  63  -6.208  -7.141  -8.736
  504   2HG2  ILE  63          3HG2      ILE  63  -5.375  -7.217 -10.290
  505   3HG2  ILE  63          2HG2      ILE  63  -5.023  -8.412  -9.041
  506   1HD1  ILE  63          1HD1      ILE  63  -4.570  -5.816 -10.987
  507   2HD1  ILE  63          3HD1      ILE  63  -5.929  -4.774 -10.565
  508   3HD1  ILE  63          2HD1      ILE  63  -4.352  -4.066 -10.917
  509    H    ARG  64           H        ARG  64  -6.116  -7.441  -5.943
  510    HA   ARG  64           HA       ARG  64  -5.140 -10.247  -5.708
  511   1HB   ARG  64          2HB       ARG  64  -6.348  -8.536  -3.840
  512   2HB   ARG  64          1HB       ARG  64  -7.627  -9.654  -4.314
  513   1HG   ARG  64          2HG       ARG  64  -6.278 -10.504  -2.394
  514   2HG   ARG  64          1HG       ARG  64  -6.197 -11.566  -3.799
  515   1HD   ARG  64          2HD       ARG  64  -3.997 -11.023  -4.254
  516   2HD   ARG  64          1HD       ARG  64  -4.145  -9.406  -3.565
  517    HE   ARG  64           HE       ARG  64  -3.160 -11.653  -2.155
  518   1HH1  ARG  64          2HH1      ARG  64  -4.672  -8.643  -1.807
  519   2HH1  ARG  64          1HH1      ARG  64  -4.965  -8.803  -0.108
  520   1HH2  ARG  64          1HH2      ARG  64  -3.892 -12.097   0.034
  521   2HH2  ARG  64          2HH2      ARG  64  -4.523 -10.760   0.934
  522    H    LYS  65           H        LYS  65  -7.220 -11.820  -5.776
  523    HA   LYS  65           HA       LYS  65  -9.098 -10.885  -7.872
  524   1HB   LYS  65          2HB       LYS  65  -7.243 -11.890  -9.113
  525   2HB   LYS  65          1HB       LYS  65  -7.359 -13.353  -8.137
  526   1HG   LYS  65          2HG       LYS  65  -9.793 -13.508  -8.927
  527   2HG   LYS  65          1HG       LYS  65  -9.376 -12.277 -10.118
  528   1HD   LYS  65          2HD       LYS  65  -7.339 -13.930 -10.585
  529   2HD   LYS  65          1HD       LYS  65  -8.459 -15.118  -9.921
  530   1HE   LYS  65          2HE       LYS  65  -8.888 -13.309 -12.312
  531   2HE   LYS  65          1HE       LYS  65  -8.834 -15.071 -12.294
  532   1HZ   LYS  65          3HZ       LYS  65 -10.823 -15.065 -10.901
  533   2HZ   LYS  65          2HZ       LYS  65 -10.885 -13.369 -10.984
  534   3HZ   LYS  65          1HZ       LYS  65 -11.104 -14.301 -12.388
  535    H    LEU  66           H        LEU  66 -11.108 -11.528  -7.380
  536    HA   LEU  66           HA       LEU  66 -11.620 -13.340  -5.162
  537   1HB   LEU  66          2HB       LEU  66 -13.373 -11.982  -7.211
  538   2HB   LEU  66          1HB       LEU  66 -14.034 -13.161  -6.083
  539    HG   LEU  66           HG       LEU  66 -14.386 -11.109  -4.997
  540   1HD1  LEU  66          1HD1      LEU  66 -12.814 -12.911  -3.788
  541   2HD1  LEU  66          3HD1      LEU  66 -11.686 -11.555  -3.818
  542   3HD1  LEU  66          2HD1      LEU  66 -13.249 -11.385  -3.017
  543   1HD2  LEU  66          2HD2      LEU  66 -11.609 -10.363  -5.937
  544   2HD2  LEU  66          1HD2      LEU  66 -13.139  -9.666  -6.473
  545   3HD2  LEU  66          3HD2      LEU  66 -12.567  -9.381  -4.830
  546    H    ASP  67           H        ASP  67 -12.524 -15.435  -5.279
  547    HA   ASP  67           HA       ASP  67 -11.676 -17.002  -7.571
  548   1HB   ASP  67          2HB       ASP  67 -12.781 -17.484  -4.917
  549   2HB   ASP  67          1HB       ASP  67 -13.522 -18.527  -6.128
  550    H    ASN  68           H        ASN  68 -14.402 -15.150  -6.714
  551    HA   ASN  68           HA       ASN  68 -16.270 -16.545  -8.518
  552   1HB   ASN  68          2HB       ASN  68 -16.539 -13.872  -7.106
  553   2HB   ASN  68          1HB       ASN  68 -17.842 -14.783  -7.872
  554   1HD2  ASN  68          2HD2      ASN  68 -16.523 -15.861  -4.163
  555   2HD2  ASN  68          1HD2      ASN  68 -15.720 -14.653  -5.045
  556    H    GLY  69           H        GLY  69 -13.744 -14.350  -8.802
  557   1HA   GLY  69          2HA       GLY  69 -12.995 -13.539 -10.943
  558   2HA   GLY  69          1HA       GLY  69 -14.662 -13.599 -11.495
  559    H    GLY  70           H        GLY  70 -12.362 -11.759  -9.576
  560   1HA   GLY  70          2HA       GLY  70 -13.648  -9.285 -10.208
  561   2HA   GLY  70          1HA       GLY  70 -13.969  -9.736  -8.536
  562    H    TYR  71           H        TYR  71 -11.619  -8.511 -10.746
  563    HA   TYR  71           HA       TYR  71  -9.318  -8.852  -8.985
  564   1HB   TYR  71          2HB       TYR  71  -9.800  -7.185 -11.472
  565   2HB   TYR  71          1HB       TYR  71  -8.286  -7.115 -10.573
  566    HD1  TYR  71           HD1      TYR  71  -8.209 -10.062  -9.733
  567    HD2  TYR  71           HD2      TYR  71  -8.984  -8.148 -13.503
  568    HE1  TYR  71           HE1      TYR  71  -7.419 -12.088 -10.936
  569    HE2  TYR  71           HE2      TYR  71  -8.199 -10.166 -14.696
  570    HH   TYR  71           HH       TYR  71  -6.501 -12.671 -13.146
  571    H    TYR  72           H        TYR  72  -8.960  -7.600  -7.204
  572    HA   TYR  72           HA       TYR  72  -9.957  -4.784  -7.270
  573   1HB   TYR  72          2HB       TYR  72 -11.000  -5.020  -5.092
  574   2HB   TYR  72          1HB       TYR  72 -11.675  -6.227  -6.183
  575    HD1  TYR  72           HD1      TYR  72 -10.915  -8.601  -6.042
  576    HD2  TYR  72           HD2      TYR  72  -9.639  -5.647  -3.214
  577    HE1  TYR  72           HE1      TYR  72 -10.136 -10.395  -4.516
  578    HE2  TYR  72           HE2      TYR  72  -8.858  -7.409  -1.692
  579    HH   TYR  72           HH       TYR  72  -8.695 -10.749  -2.682
  580    H    ILE  73           H        ILE  73  -8.448  -3.402  -6.416
  581    HA   ILE  73           HA       ILE  73  -6.085  -4.519  -5.054
  582    HB   ILE  73           HB       ILE  73  -6.906  -1.812  -6.084
  583   1HG1  ILE  73          2HG1      ILE  73  -4.136  -2.445  -6.349
  584   2HG1  ILE  73          1HG1      ILE  73  -5.066  -3.884  -6.756
  585   1HG2  ILE  73          1HG2      ILE  73  -6.216  -1.367  -3.752
  586   2HG2  ILE  73          3HG2      ILE  73  -4.709  -2.238  -4.039
  587   3HG2  ILE  73          2HG2      ILE  73  -5.036  -0.734  -4.905
  588   1HD1  ILE  73          3HD1      ILE  73  -5.794  -1.167  -7.859
  589   2HD1  ILE  73          2HD1      ILE  73  -4.612  -2.201  -8.660
  590   3HD1  ILE  73          1HD1      ILE  73  -6.273  -2.755  -8.460
  591    H    THR  74           H        THR  74  -9.132  -3.072  -4.407
  592    HA   THR  74           HA       THR  74  -8.650  -3.335  -1.487
  593    HB   THR  74           HB       THR  74  -8.941  -1.100  -1.295
  594    HG1  THR  74           HG1      THR  74 -11.129  -0.438  -1.422
  595   1HG2  THR  74          3HG2      THR  74  -8.549  -0.975  -3.828
  596   2HG2  THR  74          2HG2      THR  74 -10.305  -0.900  -3.982
  597   3HG2  THR  74          1HG2      THR  74  -9.441   0.365  -3.106
  598    H    THR  75           H        THR  75 -10.330  -4.382  -0.458
  599    HA   THR  75           HA       THR  75 -12.018  -6.040  -2.047
  600    HB   THR  75           HB       THR  75 -13.064  -6.677   0.099
  601    HG1  THR  75           HG1      THR  75 -12.306  -5.593   1.965
  602   1HG2  THR  75          1HG2      THR  75 -10.312  -6.783  -0.654
  603   2HG2  THR  75          3HG2      THR  75 -10.393  -6.621   1.104
  604   3HG2  THR  75          2HG2      THR  75 -11.228  -7.954   0.302
  605    H    ARG  76           H        ARG  76 -12.423  -2.774  -1.514
  606    HA   ARG  76           HA       ARG  76 -15.341  -2.819  -1.282
  607   1HB   ARG  76          2HB       ARG  76 -13.667  -0.993  -0.421
  608   2HB   ARG  76          1HB       ARG  76 -13.753  -0.395  -2.078
  609   1HG   ARG  76          2HG       ARG  76 -15.584   0.734  -1.330
  610   2HG   ARG  76          1HG       ARG  76 -16.400  -0.817  -1.528
  611   1HD   ARG  76          2HD       ARG  76 -15.269  -1.132   0.941
  612   2HD   ARG  76          1HD       ARG  76 -15.610   0.598   0.946
  613    HE   ARG  76           HE       ARG  76 -17.789  -1.274   0.174
  614   1HH1  ARG  76          2HH1      ARG  76 -17.063   1.735   1.397
  615   2HH1  ARG  76          1HH1      ARG  76 -18.197   1.688   2.705
  616   1HH2  ARG  76          1HH2      ARG  76 -18.964  -1.665   2.269
  617   2HH2  ARG  76          2HH2      ARG  76 -19.273  -0.238   3.199
  618    H    ALA  77           H        ALA  77 -13.122  -3.244  -3.824
  619    HA   ALA  77           HA       ALA  77 -15.307  -3.006  -5.778
  620   1HB   ALA  77          3HB       ALA  77 -12.928  -1.148  -5.803
  621   2HB   ALA  77          2HB       ALA  77 -13.875  -1.482  -7.253
  622   3HB   ALA  77          1HB       ALA  77 -14.640  -0.726  -5.854
  623    H    GLN  78           H        GLN  78 -15.086  -4.747  -7.060
  624    HA   GLN  78           HA       GLN  78 -12.366  -5.652  -7.840
  625   1HB   GLN  78          2HB       GLN  78 -13.798  -7.947  -8.009
  626   2HB   GLN  78          1HB       GLN  78 -12.867  -7.504  -6.590
  627   1HG   GLN  78          2HG       GLN  78 -15.144  -6.239  -5.957
  628   2HG   GLN  78          1HG       GLN  78 -15.817  -7.489  -6.997
  629   1HE2  GLN  78          2HE2      GLN  78 -14.004  -8.570  -3.466
  630   2HE2  GLN  78          1HE2      GLN  78 -13.639  -7.067  -4.165
  631    H    PHE  79           H        PHE  79 -12.363  -6.748  -9.984
  632    HA   PHE  79           HA       PHE  79 -14.782  -6.323 -11.624
  633   1HB   PHE  79          2HB       PHE  79 -12.118  -5.006 -12.083
  634   2HB   PHE  79          1HB       PHE  79 -13.318  -5.195 -13.371
  635    HD1  PHE  79           HD1      PHE  79 -15.742  -4.512 -12.800
  636    HD2  PHE  79           HD2      PHE  79 -12.307  -3.215 -10.585
  637    HE1  PHE  79           HE1      PHE  79 -17.067  -2.644 -11.836
  638    HE2  PHE  79           HE2      PHE  79 -13.622  -1.362  -9.621
  639    HZ   PHE  79           HZ       PHE  79 -16.005  -1.062 -10.245
  640    H    GLU  80           H        GLU  80 -15.127  -8.133 -12.626
  641    HA   GLU  80           HA       GLU  80 -13.815 -10.457 -12.788
  642   1HB   GLU  80          2HB       GLU  80 -14.665 -10.597 -15.277
  643   2HB   GLU  80          1HB       GLU  80 -15.822 -10.481 -13.951
  644   1HG   GLU  80          2HG       GLU  80 -16.263  -8.214 -14.367
  645   2HG   GLU  80          1HG       GLU  80 -14.753  -7.983 -15.248
  646    H    THR  81           H        THR  81 -12.831  -7.655 -14.794
  647    HA   THR  81           HA       THR  81 -10.384  -9.257 -15.420
  648    HB   THR  81           HB       THR  81 -11.325  -9.336 -17.526
  649    HG1  THR  81           HG1      THR  81 -10.679  -6.768 -18.116
  650   1HG2  THR  81          1HG2      THR  81 -13.320  -7.931 -16.594
  651   2HG2  THR  81          3HG2      THR  81 -12.460  -6.581 -17.329
  652   3HG2  THR  81          2HG2      THR  81 -13.007  -7.927 -18.327
  653    H    LEU  82           H        LEU  82  -8.681  -7.678 -16.417
  654    HA   LEU  82           HA       LEU  82  -8.275  -5.570 -14.422
  655   1HB   LEU  82          2HB       LEU  82  -6.528  -6.263 -16.798
  656   2HB   LEU  82          1HB       LEU  82  -6.058  -5.371 -15.350
  657    HG   LEU  82           HG       LEU  82  -7.231  -7.886 -14.585
  658   1HD1  LEU  82          2HD1      LEU  82  -6.221  -8.262 -17.027
  659   2HD1  LEU  82          1HD1      LEU  82  -4.714  -8.365 -16.116
  660   3HD1  LEU  82          3HD1      LEU  82  -6.042  -9.471 -15.757
  661   1HD2  LEU  82          1HD2      LEU  82  -5.342  -6.189 -13.640
  662   2HD2  LEU  82          3HD2      LEU  82  -5.490  -7.863 -13.106
  663   3HD2  LEU  82          2HD2      LEU  82  -4.309  -7.432 -14.343
  664    H    GLN  83           H        GLN  83  -9.132  -5.862 -17.803
  665    HA   GLN  83           HA       GLN  83  -8.814  -3.045 -18.405
  666   1HB   GLN  83          2HB       GLN  83  -9.030  -5.120 -20.028
  667   2HB   GLN  83          1HB       GLN  83 -10.759  -4.812 -19.863
  668   1HG   GLN  83          2HG       GLN  83  -9.800  -2.281 -20.288
  669   2HG   GLN  83          1HG       GLN  83  -8.692  -3.242 -21.269
  670   1HE2  GLN  83          1HE2      GLN  83 -10.510  -5.339 -22.036
  671   2HE2  GLN  83          2HE2      GLN  83 -11.698  -4.667 -23.045
  672    H    GLN  84           H        GLN  84 -11.304  -5.113 -17.075
  673    HA   GLN  84           HA       GLN  84 -13.431  -3.151 -17.258
  674   1HB   GLN  84          2HB       GLN  84 -13.092  -5.780 -15.858
  675   2HB   GLN  84          1HB       GLN  84 -14.449  -4.739 -15.458
  676   1HG   GLN  84          2HG       GLN  84 -14.666  -6.545 -17.398
  677   2HG   GLN  84          1HG       GLN  84 -15.435  -4.974 -17.538
  678   1HE2  GLN  84          2HE2      GLN  84 -13.223  -3.808 -20.101
  679   2HE2  GLN  84          1HE2      GLN  84 -14.277  -3.303 -18.873
  680    H    LEU  85           H        LEU  85 -10.969  -4.001 -14.909
  681    HA   LEU  85           HA       LEU  85 -12.125  -2.263 -12.841
  682   1HB   LEU  85          2HB       LEU  85 -10.588  -3.204 -11.440
  683   2HB   LEU  85          1HB       LEU  85 -10.404  -4.386 -12.731
  684    HG   LEU  85           HG       LEU  85  -8.705  -2.450 -13.598
  685   1HD1  LEU  85          2HD1      LEU  85  -9.357  -1.586 -11.050
  686   2HD1  LEU  85          1HD1      LEU  85  -7.834  -2.450 -10.806
  687   3HD1  LEU  85          3HD1      LEU  85  -7.916  -1.116 -11.957
  688   1HD2  LEU  85          2HD2      LEU  85  -8.562  -5.039 -12.491
  689   2HD2  LEU  85          1HD2      LEU  85  -7.370  -4.220 -13.498
  690   3HD2  LEU  85          3HD2      LEU  85  -7.280  -4.087 -11.742
  691    H    VAL  86           H        VAL  86  -9.690  -1.990 -15.367
  692    HA   VAL  86           HA       VAL  86  -8.771   0.588 -14.415
  693    HB   VAL  86           HB       VAL  86  -7.551   0.749 -16.475
  694   1HG1  VAL  86          1HG1      VAL  86  -7.668  -1.800 -15.051
  695   2HG1  VAL  86          3HG1      VAL  86  -7.094  -1.989 -16.707
  696   3HG1  VAL  86          2HG1      VAL  86  -6.262  -0.892 -15.606
  697   1HG2  VAL  86          2HG2      VAL  86  -9.545   0.224 -17.914
  698   2HG2  VAL  86          1HG2      VAL  86  -8.062  -0.572 -18.442
  699   3HG2  VAL  86          3HG2      VAL  86  -9.286  -1.481 -17.560
  700    H    GLN  87           H        GLN  87 -11.433  -0.717 -16.055
  701    HA   GLN  87           HA       GLN  87 -12.318   1.641 -17.459
  702   1HB   GLN  87          2HB       GLN  87 -12.971  -0.710 -18.023
  703   2HB   GLN  87          1HB       GLN  87 -13.909  -0.757 -16.541
  704   1HG   GLN  87          2HG       GLN  87 -15.466  -0.151 -18.233
  705   2HG   GLN  87          1HG       GLN  87 -15.085   1.346 -17.382
  706   1HE2  GLN  87          2HE2      GLN  87 -14.672   1.540 -21.236
  707   2HE2  GLN  87          1HE2      GLN  87 -15.853   0.713 -20.339
  708    H    HIS  88           H        HIS  88 -13.127   0.062 -14.399
  709    HA   HIS  88           HA       HIS  88 -15.129   2.039 -13.708
  710   1HB   HIS  88          2HB       HIS  88 -14.870  -0.464 -12.955
  711   2HB   HIS  88          1HB       HIS  88 -13.829   0.223 -11.716
  712    HD1  HIS  88           HD1      HIS  88 -14.974   1.214  -9.712
  713    HD2  HIS  88           HD2      HIS  88 -17.591   0.756 -12.925
  714    HE1  HIS  88           HE1      HIS  88 -17.277   1.825  -8.853
  715    H    TYR  89           H        TYR  89 -11.788   1.374 -12.912
  716    HA   TYR  89           HA       TYR  89 -11.592   3.435 -10.895
  717   1HB   TYR  89          2HB       TYR  89  -9.619   1.769 -12.439
  718   2HB   TYR  89          1HB       TYR  89  -9.071   3.044 -11.357
  719    HD1  TYR  89           HD1      TYR  89 -11.579   0.267 -11.367
  720    HD2  TYR  89           HD2      TYR  89  -8.496   2.329  -9.216
  721    HE1  TYR  89           HE1      TYR  89 -11.804  -1.345  -9.528
  722    HE2  TYR  89           HE2      TYR  89  -8.718   0.715  -7.348
  723    HH   TYR  89           HH       TYR  89 -10.768  -0.857  -6.515
  724    H    SER  90           H        SER  90 -11.485   3.321 -14.339
  725    HA   SER  90           HA       SER  90  -9.881   5.602 -14.877
  726   1HB   SER  90          2HB       SER  90 -11.496   3.786 -16.368
  727   2HB   SER  90          1HB       SER  90 -12.001   5.421 -16.790
  728    HG   SER  90           HG       SER  90 -10.002   5.890 -17.479
  729    H    GLU  91           H        GLU  91 -13.351   5.210 -14.316
  730    HA   GLU  91           HA       GLU  91 -13.720   8.144 -14.411
  731   1HB   GLU  91          2HB       GLU  91 -15.812   6.041 -13.804
  732   2HB   GLU  91          1HB       GLU  91 -16.072   7.692 -14.364
  733   1HG   GLU  91          2HG       GLU  91 -14.475   6.777 -16.351
  734   2HG   GLU  91          1HG       GLU  91 -15.277   5.275 -15.895
  735    H    ARG  92           H        ARG  92 -12.891   5.777 -12.142
  736    HA   ARG  92           HA       ARG  92 -13.578   7.688  -9.958
  737   1HB   ARG  92          2HB       ARG  92 -13.990   4.805  -9.353
  738   2HB   ARG  92          1HB       ARG  92 -14.824   6.216  -8.709
  739   1HG   ARG  92          2HG       ARG  92 -15.857   6.488 -11.036
  740   2HG   ARG  92          1HG       ARG  92 -15.251   4.870 -11.384
  741   1HD   ARG  92          2HD       ARG  92 -16.676   3.860  -9.846
  742   2HD   ARG  92          1HD       ARG  92 -16.826   5.321  -8.872
  743    HE   ARG  92           HE       ARG  92 -18.188   6.218 -10.880
  744   1HH1  ARG  92          1HH2      ARG  92 -18.751   4.590 -12.864
  745   2HH1  ARG  92          2HH2      ARG  92 -19.879   3.387 -12.333
  746   1HH2  ARG  92          2HH1      ARG  92 -19.275   3.932  -8.961
  747   2HH2  ARG  92          1HH1      ARG  92 -20.175   3.015 -10.124
  748    H    ALA  93           H        ALA  93 -12.117   7.625  -8.225
  749    HA   ALA  93           HA       ALA  93  -9.497   6.562  -8.811
  750   1HB   ALA  93          1HB       ALA  93  -9.910   8.605  -7.409
  751   2HB   ALA  93          3HB       ALA  93 -10.547   7.554  -6.145
  752   3HB   ALA  93          2HB       ALA  93  -8.855   7.424  -6.630
  753    H    ALA  94           H        ALA  94 -12.134   5.587  -6.667
  754    HA   ALA  94           HA       ALA  94 -12.660   3.369  -6.000
  755   1HB   ALA  94          2HB       ALA  94 -10.757   2.808  -7.859
  756   2HB   ALA  94          1HB       ALA  94  -9.924   2.304  -6.388
  757   3HB   ALA  94          3HB       ALA  94 -11.481   1.591  -6.808
  758    H    GLY  95           H        GLY  95  -9.922   5.255  -5.077
  759   1HA   GLY  95          2HA       GLY  95 -10.002   5.640  -2.541
  760   2HA   GLY  95          1HA       GLY  95  -9.916   3.887  -2.426
  761    H    LEU  96           H        LEU  96  -8.067   5.009  -5.041
  762    HA   LEU  96           HA       LEU  96  -5.608   4.664  -3.398
  763   1HB   LEU  96          2HB       LEU  96  -4.591   4.572  -5.847
  764   2HB   LEU  96          1HB       LEU  96  -5.395   3.168  -5.163
  765    HG   LEU  96           HG       LEU  96  -7.079   5.155  -6.611
  766   1HD1  LEU  96          3HD1      LEU  96  -4.776   4.271  -7.835
  767   2HD1  LEU  96          2HD1      LEU  96  -5.955   3.055  -8.328
  768   3HD1  LEU  96          1HD1      LEU  96  -6.246   4.758  -8.681
  769   1HD2  LEU  96          3HD2      LEU  96  -6.992   2.175  -6.136
  770   2HD2  LEU  96          2HD2      LEU  96  -8.281   3.312  -5.738
  771   3HD2  LEU  96          1HD2      LEU  96  -8.001   2.847  -7.418
  772    H    SER  97           H        SER  97  -3.866   6.034  -5.263
  773    HA   SER  97           HA       SER  97  -4.367   8.767  -4.353
  774   1HB   SER  97          2HB       SER  97  -2.094   7.225  -5.311
  775   2HB   SER  97          1HB       SER  97  -2.167   8.813  -6.073
  776    HG   SER  97           HG       SER  97  -1.037   8.802  -4.058
  777    H    SER  98           H        SER  98  -4.227   7.055  -7.459
  778    HA   SER  98           HA       SER  98  -5.937   9.142  -8.632
  779   1HB   SER  98          2HB       SER  98  -3.612   8.586 -10.354
  780   2HB   SER  98          1HB       SER  98  -4.426  10.115 -10.021
  781    HG   SER  98           HG       SER  98  -2.139   9.506  -9.140
  782    H    ARG  99           H        ARG  99  -7.063   8.382 -10.444
  783    HA   ARG  99           HA       ARG  99  -7.538   5.606 -10.639
  784   1HB   ARG  99          2HB       ARG  99  -8.617   6.190 -12.850
  785   2HB   ARG  99          1HB       ARG  99  -9.174   7.159 -11.485
  786   1HG   ARG  99          2HG       ARG  99  -7.091   8.680 -12.289
  787   2HG   ARG  99          1HG       ARG  99  -7.530   7.954 -13.834
  788   1HD   ARG  99          2HD       ARG  99  -9.856   8.704 -13.538
  789   2HD   ARG  99          1HD       ARG  99  -9.438   9.408 -11.977
  790    HE   ARG  99           HE       ARG  99  -7.690  10.530 -13.905
  791   1HH1  ARG  99          2HH1      ARG  99 -11.084  10.158 -13.767
  792   2HH1  ARG  99          1HH1      ARG  99 -11.428  11.817 -14.126
  793   1HH2  ARG  99          1HH2      ARG  99  -8.101  12.793 -14.088
  794   2HH2  ARG  99          2HH2      ARG  99  -9.740  13.308 -14.309
  795    H    LEU 100           H        LEU 100  -7.152   4.242 -12.572
  796    HA   LEU 100           HA       LEU 100  -4.493   3.707 -13.096
  797   1HB   LEU 100          2HB       LEU 100  -5.348   2.667 -15.305
  798   2HB   LEU 100          1HB       LEU 100  -5.992   2.038 -13.795
  799    HG   LEU 100           HG       LEU 100  -7.634   2.612 -15.762
  800   1HD1  LEU 100          3HD1      LEU 100  -7.889   2.351 -13.040
  801   2HD1  LEU 100          2HD1      LEU 100  -8.740   3.852 -13.397
  802   3HD1  LEU 100          1HD1      LEU 100  -9.207   2.362 -14.208
  803   1HD2  LEU 100          1HD2      LEU 100  -6.709   4.967 -15.984
  804   2HD2  LEU 100          3HD2      LEU 100  -8.459   4.851 -15.820
  805   3HD2  LEU 100          2HD2      LEU 100  -7.481   5.322 -14.438
  806    H    VAL 101           H        VAL 101  -3.631   3.735 -15.527
  807    HA   VAL 101           HA       VAL 101  -2.350   5.936 -16.250
  808    HB   VAL 101           HB       VAL 101  -3.750   5.252 -18.680
  809   1HG1  VAL 101          2HG1      VAL 101  -1.042   5.319 -17.558
  810   2HG1  VAL 101          1HG1      VAL 101  -1.278   4.009 -18.721
  811   3HG1  VAL 101          3HG1      VAL 101  -1.594   5.678 -19.198
  812   1HG2  VAL 101          2HG2      VAL 101  -4.436   3.248 -17.346
  813   2HG2  VAL 101          1HG2      VAL 101  -3.409   2.854 -18.722
  814   3HG2  VAL 101          3HG2      VAL 101  -2.730   2.882 -17.095
  815    H    VAL 102           H        VAL 102  -2.771   8.067 -16.424
  816    HA   VAL 102           HA       VAL 102  -5.332   8.909 -17.659
  817    HB   VAL 102           HB       VAL 102  -5.721   8.951 -15.231
  818   1HG1  VAL 102          1HG1      VAL 102  -3.029   9.647 -15.110
  819   2HG1  VAL 102          3HG1      VAL 102  -3.863  11.137 -14.662
  820   3HG1  VAL 102          2HG1      VAL 102  -4.158   9.653 -13.754
  821   1HG2  VAL 102          1HG2      VAL 102  -5.931  11.164 -17.024
  822   2HG2  VAL 102          3HG2      VAL 102  -6.949  10.793 -15.633
  823   3HG2  VAL 102          2HG2      VAL 102  -5.514  11.799 -15.433
  824    HA   PRO 103           HA       PRO 103  -1.515  11.561 -18.623
  825   1HB   PRO 103          2HB       PRO 103  -0.661  10.387 -20.954
  826   2HB   PRO 103          1HB       PRO 103  -0.016   9.962 -19.361
  827   1HG   PRO 103          2HG       PRO 103  -1.920   8.444 -21.097
  828   2HG   PRO 103          1HG       PRO 103  -0.766   7.834 -19.903
  829   1HD   PRO 103          2HD       PRO 103  -3.551   8.120 -19.506
  830   2HD   PRO 103          1HD       PRO 103  -2.329   7.867 -18.243
  831    H    SER 104           H        SER 104  -2.986   9.933 -21.432
  832    HA   SER 104           HA       SER 104  -5.038  11.604 -22.140
  833   1HB   SER 104          2HB       SER 104  -2.487  13.011 -22.340
  834   2HB   SER 104          1HB       SER 104  -3.338  12.973 -23.885
  835    HG   SER 104           HG       SER 104  -4.164  14.696 -22.847
  836    H    HIS 105           H        HIS 105  -4.165   8.984 -22.583
  837    HA   HIS 105           HA       HIS 105  -3.014   8.318 -25.027
  838   1HB   HIS 105          2HB       HIS 105  -4.928   6.467 -25.026
  839   2HB   HIS 105          1HB       HIS 105  -3.631   6.432 -23.832
  840    HD1  HIS 105           HD1      HIS 105  -5.205   5.288 -22.078
  841    HD2  HIS 105           HD2      HIS 105  -6.495   9.052 -23.321
  842    HE1  HIS 105           HE1      HIS 105  -7.012   5.999 -20.452
  843    H    LYS 106           HN       LYS 106  -6.477   7.808 -25.096
  844    HA   LYS 106           HA       LYS 106  -7.298   9.951 -26.711
  845   1HB   LYS 106          2HB       LYS 106  -5.451   8.581 -28.136
  846   2HB   LYS 106          1HB       LYS 106  -6.899   7.677 -28.579
  847   1HG   LYS 106          2HG       LYS 106  -8.003   9.889 -29.119
  848   2HG   LYS 106          1HG       LYS 106  -6.430  10.654 -28.892
  849   1HD   LYS 106          2HD       LYS 106  -5.811  10.057 -30.972
  850   2HD   LYS 106          1HD       LYS 106  -6.116   8.361 -30.598
  851   1HE   LYS 106          2HE       LYS 106  -8.024   8.375 -31.801
  852   2HE   LYS 106          1HE       LYS 106  -8.611   9.801 -30.946
  853   1HZ   LYS 106          3HZ       LYS 106  -6.487  10.197 -32.907
  854   2HZ   LYS 106          2HZ       LYS 106  -8.036   9.838 -33.509
  855   3HZ   LYS 106          1HZ       LYS 106  -7.801  11.196 -32.514
  856   1H    GLU 201          2HT       GLU 201   8.259  -5.479   5.745
  857   2H    GLU 201          1HT       GLU 201   9.609  -4.847   6.562
  858   3H    GLU 201          3HT       GLU 201   8.824  -6.224   7.163
  859    HA   GLU 201           HA       GLU 201   7.284  -5.052   8.232
  860   1HB   GLU 201          2HB       GLU 201   9.653  -3.466   7.908
  861   2HB   GLU 201          1HB       GLU 201   8.251  -2.395   7.920
  862   1HG   GLU 201          2HG       GLU 201   7.479  -3.338  10.019
  863   2HG   GLU 201          1HG       GLU 201   8.751  -4.560   9.982
  864    HA   PRO 202           HA       PRO 202   5.585  -1.871   5.102
  865   1HB   PRO 202          2HB       PRO 202   7.042  -1.430   2.813
  866   2HB   PRO 202          1HB       PRO 202   7.258  -0.500   4.306
  867   1HG   PRO 202          2HG       PRO 202   9.004  -2.621   3.148
  868   2HG   PRO 202          1HG       PRO 202   9.431  -1.278   4.221
  869   1HD   PRO 202          2HD       PRO 202   9.080  -3.977   4.996
  870   2HD   PRO 202          1HD       PRO 202   9.189  -2.581   6.089
  871    H    GLN 203           H        GLN 203   4.409  -2.100   2.964
  872    HA   GLN 203           HA       GLN 203   4.831  -4.588   1.467
  873   1HB   GLN 203          2HB       GLN 203   2.530  -5.435   1.931
  874   2HB   GLN 203          1HB       GLN 203   3.549  -5.432   3.371
  875   1HG   GLN 203          2HG       GLN 203   1.888  -3.009   2.772
  876   2HG   GLN 203          1HG       GLN 203   1.106  -4.428   3.473
  877   1HE2  GLN 203          2HE2      GLN 203   3.440  -4.220   6.389
  878   2HE2  GLN 203          1HE2      GLN 203   3.117  -5.382   5.195
  879   1HN   PTR 204          1HN       PTR 204   2.327  -4.709   0.220
  880    HA   PTR 204           HA       PTR 204   2.528  -2.520  -1.642
  881   1HB   PTR 204          1HB       PTR 204   0.144  -3.516  -2.285
  882    HD1  PTR 204           HD1      PTR 204   1.446  -2.903  -4.306
  883    HD2  PTR 204           HD2      PTR 204   2.477  -6.302  -1.892
  884    HE1  PTR 204           HE1      PTR 204   2.880  -3.771  -6.136
  885    HE2  PTR 204           HE2      PTR 204   3.915  -7.164  -3.716
  886    H    GLU 205           H        GLU 205   1.588  -0.533  -1.529
  887    HA   GLU 205           HA       GLU 205   0.210   0.378   0.784
  888   1HB   GLU 205          2HB       GLU 205   0.305   1.480  -2.038
  889   2HB   GLU 205          1HB       GLU 205  -0.440   2.334  -0.685
  890   1HG   GLU 205          2HG       GLU 205   2.315   1.302  -0.245
  891   2HG   GLU 205          1HG       GLU 205   2.151   2.664  -1.355
  892    H    GLU 206           H        GLU 206  -1.776  -0.295   1.426
  893    HA   GLU 206           HA       GLU 206  -3.707  -1.260  -0.598
  894   1HB   GLU 206          2HB       GLU 206  -3.915  -1.223   2.428
  895   2HB   GLU 206          1HB       GLU 206  -4.995  -2.069   1.320
  896   1HG   GLU 206          2HG       GLU 206  -2.034  -2.607   1.698
  897   2HG   GLU 206          1HG       GLU 206  -3.359  -3.646   2.223
  898    H    ILE 207           H        ILE 207  -5.522  -0.121  -1.170
  899    HA   ILE 207           HA       ILE 207  -5.776   2.617  -0.876
  900    HB   ILE 207           HB       ILE 207  -7.631   0.409  -1.534
  901   1HG1  ILE 207          2HG1      ILE 207  -8.204   2.479  -3.183
  902   2HG1  ILE 207          1HG1      ILE 207  -6.579   2.937  -2.671
  903   1HG2  ILE 207          1HG2      ILE 207  -8.597   2.978  -0.309
  904   2HG2  ILE 207          3HG2      ILE 207  -9.521   2.243  -1.619
  905   3HG2  ILE 207          2HG2      ILE 207  -9.242   1.346  -0.126
  906   1HD1  ILE 207          3HD1      ILE 207  -6.034   0.406  -3.176
  907   2HD1  ILE 207          2HD1      ILE 207  -7.474   0.508  -4.188
  908   3HD1  ILE 207          1HD1      ILE 207  -6.102   1.572  -4.497
  909    HA   PRO 208           HA       PRO 208  -8.354   2.093   3.113
  910   1HB   PRO 208          2HB       PRO 208  -8.551  -0.435   4.175
  911   2HB   PRO 208          1HB       PRO 208  -9.706   0.229   3.007
  912   1HG   PRO 208          2HG       PRO 208  -7.562  -1.799   2.581
  913   2HG   PRO 208          1HG       PRO 208  -9.079  -1.567   1.696
  914   1HD   PRO 208          2HD       PRO 208  -6.513  -0.749   0.831
  915   2HD   PRO 208          1HD       PRO 208  -8.064  -0.240   0.130
  916    H    ILE 209           H        ILE 209  -7.699   1.914   5.440
  917    HA   ILE 209           HA       ILE 209  -5.320   0.581   6.286
  918    HB   ILE 209           HB       ILE 209  -4.315   2.256   4.688
  919   1HG1  ILE 209          2HG1      ILE 209  -3.651   2.543   7.637
  920   2HG1  ILE 209          1HG1      ILE 209  -2.989   1.336   6.535
  921   1HG2  ILE 209          2HG2      ILE 209  -5.989   4.054   5.204
  922   2HG2  ILE 209          1HG2      ILE 209  -5.227   4.250   6.783
  923   3HG2  ILE 209          3HG2      ILE 209  -4.317   4.604   5.315
  924   1HD1  ILE 209          2HD1      ILE 209  -2.714   4.132   5.619
  925   2HD1  ILE 209          1HD1      ILE 209  -1.790   3.732   7.067
  926   3HD1  ILE 209          3HD1      ILE 209  -1.543   2.815   5.581
  927    H    TYR 210           H        TYR 210  -7.510   3.314   6.663
  928    HA   TYR 210           HA       TYR 210  -6.972   4.065   9.311
  929   1HB   TYR 210          2HB       TYR 210  -9.577   4.421   9.350
  930   2HB   TYR 210          1HB       TYR 210  -8.583   5.392   8.268
  931    HD1  TYR 210           HD1      TYR 210 -10.330   2.067   8.334
  932    HD2  TYR 210           HD2      TYR 210  -9.204   5.510   6.026
  933    HE1  TYR 210           HE1      TYR 210 -11.576   1.169   6.387
  934    HE2  TYR 210           HE2      TYR 210 -10.451   4.613   4.079
  935    HH   TYR 210           HH       TYR 210 -12.645   2.765   3.997
  936    H    LEU 211           HN       LEU 211  -8.800   3.536  11.108
  937    HA   LEU 211           HA       LEU 211  -8.581   0.613  11.524
  938   1HB   LEU 211          2HB       LEU 211  -8.884   2.998  13.244
  939   2HB   LEU 211          1HB       LEU 211  -9.795   1.583  13.774
  940    HG   LEU 211           HG       LEU 211  -7.528   1.589  14.752
  941   1HD1  LEU 211          3HD1      LEU 211  -8.740  -0.506  13.238
  942   2HD1  LEU 211          2HD1      LEU 211  -6.995  -0.617  13.008
  943   3HD1  LEU 211          1HD1      LEU 211  -7.674  -0.652  14.635
  944   1HD2  LEU 211          2HD2      LEU 211  -6.420   2.840  12.922
  945   2HD2  LEU 211          1HD2      LEU 211  -5.570   1.337  13.281
  946   3HD2  LEU 211          3HD2      LEU 211  -6.613   1.444  11.862
   
  No H/Q in entry =         946
  Start of MODEL   21
    1   1H    SER   1          2HT       SER   1  -7.206  -9.947 -24.941
    2   2H    SER   1          1HT       SER   1  -6.060 -11.153 -25.281
    3   3H    SER   1          3HT       SER   1  -6.418 -10.755 -23.671
    4    HA   SER   1           HA       SER   1  -4.400  -9.691 -24.053
    5   1HB   SER   1          2HB       SER   1  -5.226  -9.850 -26.737
    6   2HB   SER   1          1HB       SER   1  -5.059  -8.126 -26.405
    7    HG   SER   1           HG       SER   1  -2.976  -8.675 -25.480
    8    H    ILE   2           H        ILE   2  -4.401  -8.023 -22.638
    9    HA   ILE   2           HA       ILE   2  -6.707  -6.172 -22.603
   10    HB   ILE   2           HB       ILE   2  -5.235  -5.260 -20.565
   11   1HG1  ILE   2          2HG1      ILE   2  -4.401  -8.169 -20.777
   12   2HG1  ILE   2          1HG1      ILE   2  -3.339  -6.808 -21.136
   13   1HG2  ILE   2          2HG2      ILE   2  -7.502  -6.246 -20.442
   14   2HG2  ILE   2          1HG2      ILE   2  -6.793  -7.861 -20.495
   15   3HG2  ILE   2          3HG2      ILE   2  -6.481  -6.804 -19.118
   16   1HD1  ILE   2          2HD1      ILE   2  -3.732  -5.949 -18.818
   17   2HD1  ILE   2          1HD1      ILE   2  -4.682  -7.396 -18.477
   18   3HD1  ILE   2          3HD1      ILE   2  -2.960  -7.534 -18.833
   19    H    GLN   3           H        GLN   3  -5.576  -3.823 -21.686
   20    HA   GLN   3           HA       GLN   3  -4.338  -2.811 -24.144
   21   1HB   GLN   3          2HB       GLN   3  -5.259  -1.492 -21.578
   22   2HB   GLN   3          1HB       GLN   3  -4.526  -0.610 -22.913
   23   1HG   GLN   3          2HG       GLN   3  -7.028  -2.311 -23.105
   24   2HG   GLN   3          1HG       GLN   3  -6.994  -0.547 -23.052
   25   1HE2  GLN   3          2HE2      GLN   3  -7.121  -1.505 -26.646
   26   2HE2  GLN   3          1HE2      GLN   3  -8.152  -1.659 -25.306
   27    H    ALA   4           H        ALA   4  -2.481  -4.468 -23.249
   28    HA   ALA   4           HA       ALA   4  -0.725  -3.631 -21.202
   29   1HB   ALA   4          1HB       ALA   4  -0.723  -5.766 -22.764
   30   2HB   ALA   4          3HB       ALA   4   0.397  -4.795 -23.719
   31   3HB   ALA   4          2HB       ALA   4   0.777  -5.183 -22.043
   32    H    GLU   5           H        GLU   5  -0.307  -1.412 -21.182
   33    HA   GLU   5           HA       GLU   5   1.863  -0.333 -22.487
   34   1HB   GLU   5          2HB       GLU   5   0.624   1.102 -24.278
   35   2HB   GLU   5          1HB       GLU   5   1.027  -0.572 -24.662
   36   1HG   GLU   5          2HG       GLU   5  -1.160  -1.246 -24.622
   37   2HG   GLU   5          1HG       GLU   5  -1.577  -0.152 -23.303
   38    H    GLU   6           H        GLU   6  -1.207   0.157 -20.965
   39    HA   GLU   6           HA       GLU   6  -0.353   2.944 -20.303
   40   1HB   GLU   6          2HB       GLU   6  -3.211   1.971 -20.468
   41   2HB   GLU   6          1HB       GLU   6  -2.657   3.635 -20.273
   42   1HG   GLU   6          2HG       GLU   6  -1.328   2.777 -22.559
   43   2HG   GLU   6          1HG       GLU   6  -2.922   2.038 -22.712
   44    H    TRP   7           H        TRP   7  -2.759   0.613 -19.058
   45    HA   TRP   7           HA       TRP   7  -1.801   1.280 -16.314
   46   1HB   TRP   7          2HB       TRP   7  -4.024   0.247 -15.624
   47   2HB   TRP   7          1HB       TRP   7  -4.141   1.755 -16.523
   48    HD1  TRP   7           HD1      TRP   7  -5.390   1.717 -18.780
   49    HE1  TRP   7           HE1      TRP   7  -6.558  -0.120 -20.163
   50    HE3  TRP   7           HE3      TRP   7  -3.836  -2.425 -16.233
   51    HZ2  TRP   7           HZ2      TRP   7  -6.800  -2.972 -20.183
   52    HZ3  TRP   7           HZ3      TRP   7  -4.547  -4.687 -16.953
   53    HH2  TRP   7           HH2      TRP   7  -6.028  -4.964 -18.920
   54    H    TYR   8           H        TYR   8  -1.267  -1.000 -18.576
   55    HA   TYR   8           HA       TYR   8  -0.568  -3.009 -16.549
   56   1HB   TYR   8          2HB       TYR   8  -2.620  -3.953 -16.946
   57   2HB   TYR   8          1HB       TYR   8  -2.720  -3.337 -18.591
   58    HD1  TYR   8           HD1      TYR   8  -1.041  -5.882 -16.446
   59    HD2  TYR   8           HD2      TYR   8  -2.037  -4.654 -20.436
   60    HE1  TYR   8           HE1      TYR   8  -0.230  -8.055 -17.318
   61    HE2  TYR   8           HE2      TYR   8  -1.235  -6.831 -21.309
   62    HH   TYR   8           HH       TYR   8  -0.771  -9.027 -20.617
   63    H    PHE   9           H        PHE   9   1.319  -3.984 -17.068
   64    HA   PHE   9           HA       PHE   9   2.410  -3.420 -19.786
   65   1HB   PHE   9          2HB       PHE   9   3.586  -3.491 -17.048
   66   2HB   PHE   9          1HB       PHE   9   4.610  -4.038 -18.375
   67    HD1  PHE   9           HD1      PHE   9   1.916  -1.457 -18.596
   68    HD2  PHE   9           HD2      PHE   9   6.155  -2.204 -18.488
   69    HE1  PHE   9           HE1      PHE   9   2.354   0.897 -19.229
   70    HE2  PHE   9           HE2      PHE   9   6.582   0.153 -19.123
   71    HZ   PHE   9           HZ       PHE   9   4.683   1.702 -19.493
   72    H    GLY  10           H        GLY  10   1.947  -5.922 -17.336
   73   1HA   GLY  10          2HA       GLY  10   1.468  -8.132 -18.715
   74   2HA   GLY  10          1HA       GLY  10   3.159  -7.930 -19.158
   75    H    LYS  11           H        LYS  11   4.217  -9.481 -18.035
   76    HA   LYS  11           HA       LYS  11   3.629  -9.745 -15.129
   77   1HB   LYS  11          2HB       LYS  11   5.135 -11.836 -16.667
   78   2HB   LYS  11          1HB       LYS  11   4.113 -12.025 -15.243
   79   1HG   LYS  11          2HG       LYS  11   2.157 -11.322 -16.753
   80   2HG   LYS  11          1HG       LYS  11   3.256 -11.580 -18.108
   81   1HD   LYS  11          2HD       LYS  11   3.336 -13.801 -16.223
   82   2HD   LYS  11          1HD       LYS  11   1.707 -13.533 -16.844
   83   1HE   LYS  11          2HE       LYS  11   2.518 -14.863 -18.544
   84   2HE   LYS  11          1HE       LYS  11   3.051 -13.295 -19.150
   85   1HZ   LYS  11          3HZ       LYS  11   4.723 -15.002 -17.398
   86   2HZ   LYS  11          2HZ       LYS  11   4.789 -15.074 -19.094
   87   3HZ   LYS  11          1HZ       LYS  11   5.205 -13.639 -18.286
   88    H    LEU  12           H        LEU  12   5.052  -7.809 -15.032
   89    HA   LEU  12           HA       LEU  12   7.933  -8.591 -15.192
   90   1HB   LEU  12          2HB       LEU  12   8.338  -6.672 -16.297
   91   2HB   LEU  12          1HB       LEU  12   6.600  -6.468 -16.431
   92    HG   LEU  12           HG       LEU  12   8.421  -5.294 -14.325
   93   1HD1  LEU  12          2HD1      LEU  12   6.726  -4.216 -16.578
   94   2HD1  LEU  12          1HD1      LEU  12   7.247  -3.184 -15.243
   95   3HD1  LEU  12          3HD1      LEU  12   8.446  -3.956 -16.284
   96   1HD2  LEU  12          1HD2      LEU  12   5.566  -5.896 -14.226
   97   2HD2  LEU  12          3HD2      LEU  12   6.669  -5.415 -12.936
   98   3HD2  LEU  12          2HD2      LEU  12   5.927  -4.187 -13.958
   99    H    GLY  13           H        GLY  13   9.126  -6.754 -13.565
  100   1HA   GLY  13          2HA       GLY  13   8.011  -7.522 -10.929
  101   2HA   GLY  13          1HA       GLY  13   9.633  -6.894 -11.215
  102    H    ARG  14           H        ARG  14   7.561  -5.948  -9.298
  103    HA   ARG  14           HA       ARG  14   6.345  -3.529 -10.191
  104   1HB   ARG  14          2HB       ARG  14   6.099  -2.980  -7.869
  105   2HB   ARG  14          1HB       ARG  14   5.966  -4.734  -7.972
  106   1HG   ARG  14          2HG       ARG  14   7.491  -4.556  -6.239
  107   2HG   ARG  14          1HG       ARG  14   8.598  -4.606  -7.611
  108   1HD   ARG  14          2HD       ARG  14   9.080  -2.342  -7.479
  109   2HD   ARG  14          1HD       ARG  14   7.524  -1.948  -6.748
  110    HE   ARG  14           HE       ARG  14   9.932  -2.606  -5.304
  111   1HH1  ARG  14          1HH2      ARG  14   9.195  -4.538  -3.756
  112   2HH1  ARG  14          2HH2      ARG  14   7.874  -4.048  -2.748
  113   1HH2  ARG  14          2HH1      ARG  14   7.063  -1.295  -4.695
  114   2HH2  ARG  14          1HH1      ARG  14   6.667  -2.213  -3.280
  115    H    LYS  15           H        LYS  15   9.606  -4.353  -9.487
  116    HA   LYS  15           HA       LYS  15  10.569  -1.675  -9.036
  117   1HB   LYS  15          2HB       LYS  15  12.037  -4.207  -9.813
  118   2HB   LYS  15          1HB       LYS  15  12.809  -2.709  -9.293
  119   1HG   LYS  15          2HG       LYS  15  10.964  -3.146  -7.288
  120   2HG   LYS  15          1HG       LYS  15  11.479  -4.784  -7.689
  121   1HD   LYS  15          2HD       LYS  15  13.223  -2.453  -6.857
  122   2HD   LYS  15          1HD       LYS  15  12.994  -3.981  -6.006
  123   1HE   LYS  15          2HE       LYS  15  13.968  -5.140  -8.040
  124   2HE   LYS  15          1HE       LYS  15  14.391  -3.543  -8.659
  125   1HZ   LYS  15          2HZ       LYS  15  15.260  -3.603  -6.042
  126   2HZ   LYS  15          1HZ       LYS  15  15.713  -5.103  -6.699
  127   3HZ   LYS  15          3HZ       LYS  15  16.220  -3.665  -7.443
  128    H    ASP  16           H        ASP  16  10.089  -3.798 -11.780
  129    HA   ASP  16           HA       ASP  16  11.622  -2.244 -13.629
  130   1HB   ASP  16          2HB       ASP  16  10.517  -4.731 -13.622
  131   2HB   ASP  16          1HB       ASP  16   9.351  -3.838 -14.563
  132    H    ALA  17           H        ALA  17   8.394  -2.210 -12.348
  133    HA   ALA  17           HA       ALA  17   7.263  -0.502 -14.394
  134   1HB   ALA  17          3HB       ALA  17   6.349  -1.156 -11.582
  135   2HB   ALA  17          2HB       ALA  17   5.401  -0.221 -12.740
  136   3HB   ALA  17          1HB       ALA  17   5.788  -1.910 -13.076
  137    H    GLU  18           H        GLU  18   8.828  -0.011 -11.273
  138    HA   GLU  18           HA       GLU  18   8.223   2.794 -11.047
  139   1HB   GLU  18          2HB       GLU  18  10.811   1.710 -10.000
  140   2HB   GLU  18          1HB       GLU  18   9.668   2.813  -9.234
  141   1HG   GLU  18          2HG       GLU  18   8.059   0.736  -9.293
  142   2HG   GLU  18          1HG       GLU  18   9.559  -0.177  -9.453
  143    H    ARG  19           H        ARG  19  10.991   1.023 -12.440
  144    HA   ARG  19           HA       ARG  19  12.313   3.480 -13.294
  145   1HB   ARG  19          2HB       ARG  19  12.955   0.694 -13.166
  146   2HB   ARG  19          1HB       ARG  19  13.209   1.240 -14.823
  147   1HG   ARG  19          2HG       ARG  19  15.140   2.193 -14.167
  148   2HG   ARG  19          1HG       ARG  19  14.211   3.290 -13.145
  149   1HD   ARG  19          2HD       ARG  19  14.163   1.248 -11.487
  150   2HD   ARG  19          1HD       ARG  19  15.564   0.709 -12.414
  151    HE   ARG  19           HE       ARG  19  15.653   3.486 -11.410
  152   1HH1  ARG  19          2HH1      ARG  19  15.817   0.566  -9.866
  153   2HH1  ARG  19          1HH1      ARG  19  17.470   0.694  -9.368
  154   1HH2  ARG  19          1HH2      ARG  19  18.112   3.499 -11.304
  155   2HH2  ARG  19          2HH2      ARG  19  18.770   2.355 -10.182
  156    H    GLN  20           H        GLN  20   9.950   1.300 -14.649
  157    HA   GLN  20           HA       GLN  20  10.298   2.266 -17.391
  158   1HB   GLN  20          2HB       GLN  20   8.398   0.400 -15.999
  159   2HB   GLN  20          1HB       GLN  20   7.977   1.029 -17.592
  160   1HG   GLN  20          2HG       GLN  20  10.730  -0.075 -17.181
  161   2HG   GLN  20          1HG       GLN  20   9.389  -1.208 -17.343
  162   1HE2  GLN  20          2HE2      GLN  20   9.209  -0.786 -20.829
  163   2HE2  GLN  20          1HE2      GLN  20   8.813  -1.716 -19.465
  164    H    LEU  21           H        LEU  21   8.577   3.263 -14.575
  165    HA   LEU  21           HA       LEU  21   6.644   4.874 -16.121
  166   1HB   LEU  21          2HB       LEU  21   6.849   3.875 -13.401
  167   2HB   LEU  21          1HB       LEU  21   6.485   5.600 -13.418
  168    HG   LEU  21           HG       LEU  21   4.537   5.265 -14.773
  169   1HD1  LEU  21          1HD1      LEU  21   5.969   2.855 -15.541
  170   2HD1  LEU  21          3HD1      LEU  21   4.296   2.489 -15.118
  171   3HD1  LEU  21          2HD1      LEU  21   4.649   3.677 -16.373
  172   1HD2  LEU  21          2HD2      LEU  21   4.257   4.693 -12.385
  173   2HD2  LEU  21          1HD2      LEU  21   3.212   3.698 -13.400
  174   3HD2  LEU  21          3HD2      LEU  21   4.700   3.022 -12.735
  175    H    LEU  22           H        LEU  22   9.241   5.434 -13.742
  176    HA   LEU  22           HA       LEU  22   9.231   8.286 -13.993
  177   1HB   LEU  22          2HB       LEU  22  11.569   6.491 -13.275
  178   2HB   LEU  22          1HB       LEU  22  11.415   8.208 -12.904
  179    HG   LEU  22           HG       LEU  22   9.792   5.912 -11.793
  180   1HD1  LEU  22          2HD1      LEU  22  11.913   6.477 -10.659
  181   2HD1  LEU  22          1HD1      LEU  22  11.384   8.154 -10.510
  182   3HD1  LEU  22          3HD1      LEU  22  10.527   6.878  -9.645
  183   1HD2  LEU  22          1HD2      LEU  22   9.128   8.817 -12.045
  184   2HD2  LEU  22          3HD2      LEU  22   8.059   7.415 -12.101
  185   3HD2  LEU  22          2HD2      LEU  22   8.684   7.988 -10.554
  186    H    SER  23           H        SER  23  10.865   5.729 -15.810
  187    HA   SER  23           HA       SER  23  12.807   7.100 -17.227
  188   1HB   SER  23          2HB       SER  23  11.353   4.702 -17.591
  189   2HB   SER  23          1HB       SER  23  11.239   5.580 -19.115
  190    HG   SER  23           HG       SER  23  13.118   4.466 -19.217
  191    H    PHE  24           H        PHE  24  12.828   8.465 -19.070
  192    HA   PHE  24           HA       PHE  24  10.991  10.520 -19.282
  193   1HB   PHE  24          2HB       PHE  24  13.238   9.800 -20.687
  194   2HB   PHE  24          1HB       PHE  24  11.982   9.640 -21.916
  195    HD1  PHE  24           HD1      PHE  24  10.648  11.571 -22.620
  196    HD2  PHE  24           HD2      PHE  24  13.740  11.959 -19.664
  197    HE1  PHE  24           HE1      PHE  24  10.574  14.037 -22.867
  198    HE2  PHE  24           HE2      PHE  24  13.666  14.425 -19.911
  199    HZ   PHE  24           HZ       PHE  24  12.083  15.465 -21.513
  200    H    GLY  25           H        GLY  25   8.842  10.501 -19.689
  201   1HA   GLY  25          2HA       GLY  25   7.660   9.310 -21.985
  202   2HA   GLY  25          1HA       GLY  25   7.407   8.227 -20.619
  203    H    ASN  26           H        ASN  26   6.229   9.075 -18.765
  204    HA   ASN  26           HA       ASN  26   4.676  11.562 -19.326
  205   1HB   ASN  26          2HB       ASN  26   3.485   8.986 -18.258
  206   2HB   ASN  26          1HB       ASN  26   2.616  10.477 -18.621
  207   1HD2  ASN  26          2HD2      ASN  26   3.182  10.013 -22.240
  208   2HD2  ASN  26          1HD2      ASN  26   3.400  11.241 -21.089
  209    HA   PRO  27           HA       PRO  27   5.626  12.441 -15.126
  210   1HB   PRO  27          2HB       PRO  27   3.681  14.331 -14.678
  211   2HB   PRO  27          1HB       PRO  27   5.147  14.638 -15.621
  212   1HG   PRO  27          2HG       PRO  27   2.343  14.226 -16.568
  213   2HG   PRO  27          1HG       PRO  27   3.660  15.129 -17.331
  214   1HD   PRO  27          2HD       PRO  27   2.783  12.531 -18.052
  215   2HD   PRO  27          1HD       PRO  27   4.289  13.307 -18.580
  216    H    ARG  28           H        ARG  28   3.856  13.134 -13.098
  217    HA   ARG  28           HA       ARG  28   2.953  10.747 -12.025
  218   1HB   ARG  28          2HB       ARG  28   1.428  12.069 -10.620
  219   2HB   ARG  28          1HB       ARG  28   2.973  12.901 -10.794
  220   1HG   ARG  28          2HG       ARG  28   2.080  14.438 -12.381
  221   2HG   ARG  28          1HG       ARG  28   0.630  13.463 -12.621
  222   1HD   ARG  28          2HD       ARG  28   0.920  14.120  -9.823
  223   2HD   ARG  28          1HD       ARG  28   0.979  15.592 -10.792
  224    HE   ARG  28           HE       ARG  28  -1.208  14.772 -11.824
  225   1HH1  ARG  28          1HH2      ARG  28  -1.714  12.201 -10.746
  226   2HH1  ARG  28          2HH2      ARG  28  -2.577  12.486  -9.271
  227   1HH2  ARG  28          2HH1      ARG  28  -1.626  15.813  -9.047
  228   2HH2  ARG  28          1HH1      ARG  28  -2.527  14.530  -8.309
  229    H    GLY  29           H        GLY  29   0.588  10.060 -11.700
  230   1HA   GLY  29          2HA       GLY  29  -1.553   9.555 -12.574
  231   2HA   GLY  29          1HA       GLY  29  -1.284  10.762 -13.832
  232    H    THR  30           H        THR  30   1.309   8.582 -13.514
  233    HA   THR  30           HA       THR  30   0.442   7.206 -16.005
  234    HB   THR  30           HB       THR  30   3.188   7.158 -14.730
  235    HG1  THR  30           HG1      THR  30   1.908   9.045 -16.347
  236   1HG2  THR  30          3HG2      THR  30   2.387   5.483 -16.552
  237   2HG2  THR  30          2HG2      THR  30   2.492   6.865 -17.643
  238   3HG2  THR  30          1HG2      THR  30   3.930   6.305 -16.789
  239    H    PHE  31           H        PHE  31  -1.050   5.959 -14.456
  240    HA   PHE  31           HA       PHE  31   0.045   4.132 -12.546
  241   1HB   PHE  31          2HB       PHE  31  -2.549   4.389 -14.004
  242   2HB   PHE  31          1HB       PHE  31  -2.197   2.856 -13.207
  243    HD1  PHE  31           HD1      PHE  31  -2.314   6.548 -12.629
  244    HD2  PHE  31           HD2      PHE  31  -2.448   2.630 -10.873
  245    HE1  PHE  31           HE1      PHE  31  -2.912   7.549 -10.440
  246    HE2  PHE  31           HE2      PHE  31  -3.044   3.631  -8.684
  247    HZ   PHE  31           HZ       PHE  31  -3.277   6.091  -8.467
  248    H    LEU  32           H        LEU  32  -0.500   1.629 -13.014
  249    HA   LEU  32           HA       LEU  32  -0.053   0.593 -15.639
  250   1HB   LEU  32          2HB       LEU  32   2.153   1.392 -15.668
  251   2HB   LEU  32          1HB       LEU  32   2.359   1.173 -13.933
  252    HG   LEU  32           HG       LEU  32   1.942  -1.217 -15.714
  253   1HD1  LEU  32          1HD1      LEU  32   3.844   0.291 -16.555
  254   2HD1  LEU  32          3HD1      LEU  32   4.660  -0.086 -15.037
  255   3HD1  LEU  32          2HD1      LEU  32   4.270  -1.378 -16.173
  256   1HD2  LEU  32          2HD2      LEU  32   2.204  -0.842 -12.979
  257   2HD2  LEU  32          1HD2      LEU  32   2.455  -2.366 -13.828
  258   3HD2  LEU  32          3HD2      LEU  32   3.828  -1.318 -13.474
  259    H    ILE  33           H        ILE  33   0.227  -1.797 -15.521
  260    HA   ILE  33           HA       ILE  33  -0.334  -2.885 -12.795
  261    HB   ILE  33           HB       ILE  33  -1.809  -3.376 -15.376
  262   1HG1  ILE  33          2HG1      ILE  33  -2.705  -3.099 -12.498
  263   2HG1  ILE  33          1HG1      ILE  33  -2.663  -1.780 -13.667
  264   1HG2  ILE  33          3HG2      ILE  33  -1.033  -5.603 -14.613
  265   2HG2  ILE  33          2HG2      ILE  33  -1.748  -5.292 -13.033
  266   3HG2  ILE  33          1HG2      ILE  33  -2.779  -5.420 -14.456
  267   1HD1  ILE  33          3HD1      ILE  33  -4.030  -3.819 -14.995
  268   2HD1  ILE  33          2HD1      ILE  33  -4.642  -3.897 -13.342
  269   3HD1  ILE  33          1HD1      ILE  33  -4.756  -2.393 -14.255
  270    H    ARG  34           H        ARG  34   0.092  -5.353 -12.803
  271    HA   ARG  34           HA       ARG  34   1.702  -6.633 -14.733
  272   1HB   ARG  34          2HB       ARG  34   3.950  -6.373 -13.501
  273   2HB   ARG  34          1HB       ARG  34   3.423  -5.023 -14.506
  274   1HG   ARG  34          2HG       ARG  34   3.258  -3.645 -12.721
  275   2HG   ARG  34          1HG       ARG  34   2.373  -4.850 -11.785
  276   1HD   ARG  34          2HD       ARG  34   4.859  -5.961 -11.805
  277   2HD   ARG  34          1HD       ARG  34   5.273  -4.248 -11.829
  278    HE   ARG  34           HE       ARG  34   3.794  -4.050  -9.764
  279   1HH1  ARG  34          2HH1      ARG  34   5.964  -6.568 -10.439
  280   2HH1  ARG  34          1HH1      ARG  34   5.606  -7.474  -9.006
  281   1HH2  ARG  34          1HH2      ARG  34   2.994  -5.413  -8.033
  282   2HH2  ARG  34          2HH2      ARG  34   3.926  -6.820  -7.645
  283    H    GLU  35           H        GLU  35   2.423  -8.680 -14.010
  284    HA   GLU  35           HA       GLU  35   0.963  -9.845 -11.872
  285   1HB   GLU  35          2HB       GLU  35   3.138 -10.672 -13.705
  286   2HB   GLU  35          1HB       GLU  35   2.961 -11.616 -12.240
  287   1HG   GLU  35          2HG       GLU  35   0.451 -11.689 -12.800
  288   2HG   GLU  35          1HG       GLU  35   0.919 -11.100 -14.398
  289    H    SER  36           H        SER  36   1.363  -9.916  -9.721
  290    HA   SER  36           HA       SER  36   3.785  -8.690  -8.635
  291   1HB   SER  36          2HB       SER  36   1.459 -10.095  -7.285
  292   2HB   SER  36          1HB       SER  36   2.735  -9.220  -6.451
  293    HG   SER  36           HG       SER  36   1.364  -7.927  -8.503
  294    H    GLU  37           H        GLU  37   5.606  -9.828  -8.148
  295    HA   GLU  37           HA       GLU  37   5.528 -12.778  -8.285
  296   1HB   GLU  37          2HB       GLU  37   7.764 -10.774  -7.946
  297   2HB   GLU  37          1HB       GLU  37   8.019 -12.516  -7.899
  298   1HG   GLU  37          2HG       GLU  37   6.473 -12.114 -10.191
  299   2HG   GLU  37          1HG       GLU  37   7.615 -10.771 -10.203
  300    H    THR  38           H        THR  38   4.522 -10.824  -6.035
  301    HA   THR  38           HA       THR  38   6.099 -11.602  -3.717
  302    HB   THR  38           HB       THR  38   4.604  -9.493  -4.051
  303    HG1  THR  38           HG1      THR  38   5.142  -9.389  -2.045
  304   1HG2  THR  38          3HG2      THR  38   2.552 -11.504  -3.096
  305   2HG2  THR  38          2HG2      THR  38   2.308  -9.760  -3.186
  306   3HG2  THR  38          1HG2      THR  38   2.551 -10.693  -4.662
  307    H    THR  39           H        THR  39   2.990 -12.518  -5.129
  308    HA   THR  39           HA       THR  39   2.938 -14.843  -3.235
  309    HB   THR  39           HB       THR  39   0.965 -13.137  -3.429
  310    HG1  THR  39           HG1      THR  39  -0.325 -14.740  -2.756
  311   1HG2  THR  39          1HG2      THR  39   1.062 -13.654  -6.053
  312   2HG2  THR  39          3HG2      THR  39  -0.041 -14.944  -5.574
  313   3HG2  THR  39          2HG2      THR  39  -0.451 -13.264  -5.235
  314    H    LYS  40           H        LYS  40   1.397 -16.640  -4.557
  315    HA   LYS  40           HA       LYS  40   3.059 -18.053  -6.233
  316   1HB   LYS  40          2HB       LYS  40   0.119 -17.895  -6.860
  317   2HB   LYS  40          1HB       LYS  40   1.179 -19.301  -6.936
  318   1HG   LYS  40          2HG       LYS  40   0.072 -17.918  -4.490
  319   2HG   LYS  40          1HG       LYS  40  -0.122 -19.603  -4.967
  320   1HD   LYS  40          2HD       LYS  40   2.629 -19.317  -4.837
  321   2HD   LYS  40          1HD       LYS  40   2.067 -18.326  -3.491
  322   1HE   LYS  40          2HE       LYS  40   1.477 -20.147  -2.292
  323   2HE   LYS  40          1HE       LYS  40   0.605 -20.842  -3.658
  324   1HZ   LYS  40          2HZ       LYS  40   2.755 -21.560  -4.569
  325   2HZ   LYS  40          1HZ       LYS  40   3.530 -20.984  -3.170
  326   3HZ   LYS  40          3HZ       LYS  40   2.423 -22.264  -3.059
  327    H    GLY  41           H        GLY  41   0.865 -15.448  -7.110
  328   1HA   GLY  41          2HA       GLY  41   2.320 -14.250  -9.097
  329   2HA   GLY  41          1HA       GLY  41   1.509 -15.572  -9.945
  330    H    ALA  42           H        ALA  42   0.832 -12.874  -7.737
  331    HA   ALA  42           HA       ALA  42  -1.986 -12.758  -8.599
  332   1HB   ALA  42          1HB       ALA  42  -0.394 -11.800  -6.363
  333   2HB   ALA  42          3HB       ALA  42  -1.356 -10.496  -7.053
  334   3HB   ALA  42          2HB       ALA  42  -2.146 -11.966  -6.484
  335    H    TYR  43           H        TYR  43  -2.254  -9.929  -8.537
  336    HA   TYR  43           HA       TYR  43  -0.625  -9.193 -10.927
  337   1HB   TYR  43          2HB       TYR  43  -3.460  -9.337 -10.689
  338   2HB   TYR  43          1HB       TYR  43  -3.017  -7.634 -10.820
  339    HD1  TYR  43           HD1      TYR  43  -0.590  -7.683 -12.441
  340    HD2  TYR  43           HD2      TYR  43  -4.195  -9.998 -12.828
  341    HE1  TYR  43           HE1      TYR  43  -0.140  -7.995 -14.864
  342    HE2  TYR  43           HE2      TYR  43  -3.740 -10.308 -15.243
  343    HH   TYR  43           HH       TYR  43  -1.336 -10.242 -16.680
  344    H    SER  44           H        SER  44  -1.111  -6.523 -11.097
  345    HA   SER  44           HA       SER  44  -0.899  -5.277  -8.454
  346   1HB   SER  44          2HB       SER  44   1.348  -6.074  -8.624
  347   2HB   SER  44          1HB       SER  44   1.464  -5.520 -10.294
  348    HG   SER  44           HG       SER  44   1.439  -3.430  -9.609
  349    H    LEU  45           H        LEU  45  -0.508  -2.923  -8.667
  350    HA   LEU  45           HA       LEU  45  -1.161  -1.833 -11.351
  351   1HB   LEU  45          2HB       LEU  45  -3.342  -1.953 -10.394
  352   2HB   LEU  45          1HB       LEU  45  -2.768  -1.361  -8.836
  353    HG   LEU  45           HG       LEU  45  -2.528   0.844  -9.620
  354   1HD1  LEU  45          2HD1      LEU  45  -2.298  -0.471 -12.307
  355   2HD1  LEU  45          1HD1      LEU  45  -2.818   1.212 -12.220
  356   3HD1  LEU  45          3HD1      LEU  45  -1.253   0.737 -11.563
  357   1HD2  LEU  45          2HD2      LEU  45  -4.906  -0.572 -10.714
  358   2HD2  LEU  45          1HD2      LEU  45  -4.822   0.748  -9.546
  359   3HD2  LEU  45          3HD2      LEU  45  -4.630   1.080 -11.269
  360    H    SER  46           H        SER  46   1.087  -1.144 -11.211
  361    HA   SER  46           HA       SER  46   2.196   0.465  -9.174
  362   1HB   SER  46          2HB       SER  46   2.816   0.864 -12.095
  363   2HB   SER  46          1HB       SER  46   3.901   0.990 -10.715
  364    HG   SER  46           HG       SER  46   4.300  -1.038 -10.923
  365    H    ILE  47           H        ILE  47   2.544   2.805  -9.172
  366    HA   ILE  47           HA       ILE  47   0.638   4.399 -10.798
  367    HB   ILE  47           HB       ILE  47  -0.679   4.015  -8.845
  368   1HG1  ILE  47          2HG1      ILE  47   0.797   6.656  -8.660
  369   2HG1  ILE  47          1HG1      ILE  47  -0.743   6.343  -9.459
  370   1HG2  ILE  47          3HG2      ILE  47   1.190   3.117  -7.461
  371   2HG2  ILE  47          2HG2      ILE  47   1.749   4.769  -7.196
  372   3HG2  ILE  47          1HG2      ILE  47   0.177   4.260  -6.577
  373   1HD1  ILE  47          2HD1      ILE  47  -0.264   5.985  -6.487
  374   2HD1  ILE  47          1HD1      ILE  47  -0.978   7.430  -7.204
  375   3HD1  ILE  47          3HD1      ILE  47  -1.810   5.879  -7.328
  376    H    ARG  48           H        ARG  48   2.326   5.483 -11.836
  377    HA   ARG  48           HA       ARG  48   4.710   6.426 -10.609
  378   1HB   ARG  48          2HB       ARG  48   3.891   6.363 -13.148
  379   2HB   ARG  48          1HB       ARG  48   3.462   8.037 -12.795
  380   1HG   ARG  48          2HG       ARG  48   6.166   7.045 -11.969
  381   2HG   ARG  48          1HG       ARG  48   5.890   7.425 -13.669
  382   1HD   ARG  48          2HD       ARG  48   4.858   9.445 -11.778
  383   2HD   ARG  48          1HD       ARG  48   6.613   9.269 -11.775
  384    HE   ARG  48           HE       ARG  48   5.047   9.846 -14.260
  385   1HH1  ARG  48          1HH2      ARG  48   7.762   9.123 -14.911
  386   2HH1  ARG  48          2HH2      ARG  48   8.640  10.611 -14.792
  387   1HH2  ARG  48          2HH1      ARG  48   6.190  12.216 -12.937
  388   2HH2  ARG  48          1HH1      ARG  48   7.751  12.362 -13.674
  389    H    ASP  49           H        ASP  49   5.150   8.243  -9.392
  390    HA   ASP  49           HA       ASP  49   3.275  10.489  -9.315
  391   1HB   ASP  49          2HB       ASP  49   2.129   8.994  -7.783
  392   2HB   ASP  49          1HB       ASP  49   3.629   8.678  -6.910
  393    H    TRP  50           H        TRP  50   4.771  12.095  -9.482
  394    HA   TRP  50           HA       TRP  50   7.383  11.853  -8.117
  395   1HB   TRP  50          2HB       TRP  50   7.627  12.796 -10.273
  396   2HB   TRP  50          1HB       TRP  50   6.180  13.785 -10.099
  397    HD1  TRP  50           HD1      TRP  50   9.864  13.938  -9.685
  398    HE1  TRP  50           HE1      TRP  50  10.539  16.143  -8.524
  399    HE3  TRP  50           HE3      TRP  50   5.308  15.499  -8.175
  400    HZ2  TRP  50           HZ2      TRP  50   9.262  18.322  -7.156
  401    HZ3  TRP  50           HZ3      TRP  50   5.024  17.639  -6.945
  402    HH2  TRP  50           HH2      TRP  50   7.000  19.054  -6.433
  403    H    ASP  51           H        ASP  51   8.125  13.646  -6.709
  404    HA   ASP  51           HA       ASP  51   5.974  15.233  -5.430
  405   1HB   ASP  51          2HB       ASP  51   7.073  12.867  -4.282
  406   2HB   ASP  51          1HB       ASP  51   7.700  14.238  -3.366
  407    H    ASP  52           H        ASP  52   6.845  17.054  -4.210
  408    HA   ASP  52           HA       ASP  52   9.408  17.999  -5.320
  409   1HB   ASP  52          2HB       ASP  52   7.015  19.237  -4.513
  410   2HB   ASP  52          1HB       ASP  52   8.225  19.751  -3.335
  411    H    MET  53           H        MET  53   9.703  15.807  -3.563
  412    HA   MET  53           HA       MET  53  11.368  17.065  -1.501
  413   1HB   MET  53          2HB       MET  53   9.210  15.020  -0.947
  414   2HB   MET  53          1HB       MET  53  10.522  15.356   0.179
  415   1HG   MET  53          2HG       MET  53   9.410  17.142   0.965
  416   2HG   MET  53          1HG       MET  53   9.381  17.850  -0.648
  417   1HE   MET  53          3HE       MET  53   8.080  15.706  -2.266
  418   2HE   MET  53          2HE       MET  53   6.339  15.983  -2.241
  419   3HE   MET  53          1HE       MET  53   7.436  17.343  -2.465
  420    H    LYS  54           H        LYS  54  11.388  15.217  -4.061
  421    HA   LYS  54           HA       LYS  54  13.774  13.828  -3.383
  422   1HB   LYS  54          2HB       LYS  54  12.691  11.478  -3.656
  423   2HB   LYS  54          1HB       LYS  54  12.565  12.283  -2.092
  424   1HG   LYS  54          2HG       LYS  54  10.339  13.232  -2.907
  425   2HG   LYS  54          1HG       LYS  54  10.458  12.109  -4.261
  426   1HD   LYS  54          2HD       LYS  54   9.447  10.611  -2.893
  427   2HD   LYS  54          1HD       LYS  54  11.007  10.497  -2.078
  428   1HE   LYS  54          2HE       LYS  54  10.120  11.400  -0.219
  429   2HE   LYS  54          1HE       LYS  54   9.653  12.839  -1.128
  430   1HZ   LYS  54          2HZ       LYS  54   7.724  11.381  -1.938
  431   2HZ   LYS  54          1HZ       LYS  54   8.089  10.396  -0.603
  432   3HZ   LYS  54          3HZ       LYS  54   7.648  12.016  -0.364
  433    H    GLY  55           H        GLY  55  11.028  14.194  -5.544
  434   1HA   GLY  55          2HA       GLY  55  11.657  14.626  -7.917
  435   2HA   GLY  55          1HA       GLY  55  12.759  13.268  -7.751
  436    H    ASP  56           H        ASP  56  11.495  12.358  -9.622
  437    HA   ASP  56           HA       ASP  56   8.718  11.718  -9.317
  438   1HB   ASP  56          2HB       ASP  56  10.583  10.036 -10.976
  439   2HB   ASP  56          1HB       ASP  56   8.937  10.552 -11.330
  440    H    HIS  57           H        HIS  57   7.987   9.329  -9.289
  441    HA   HIS  57           HA       HIS  57   9.665   7.398  -7.933
  442   1HB   HIS  57          2HB       HIS  57   7.874   9.160  -6.358
  443   2HB   HIS  57          1HB       HIS  57   7.738   7.439  -6.009
  444    HD1  HIS  57           HD1      HIS  57   8.894   8.878  -3.734
  445    HD2  HIS  57           HD2      HIS  57  11.300   7.702  -6.929
  446    HE1  HIS  57           HE1      HIS  57  11.269   8.814  -2.857
  447    H    VAL  58           H        VAL  58   7.838   5.669  -6.967
  448    HA   VAL  58           HA       VAL  58   5.506   5.529  -8.718
  449    HB   VAL  58           HB       VAL  58   8.017   4.091  -9.303
  450   1HG1  VAL  58          3HG1      VAL  58   5.344   2.670  -9.206
  451   2HG1  VAL  58          2HG1      VAL  58   6.623   2.163 -10.310
  452   3HG1  VAL  58          1HG1      VAL  58   6.894   2.119  -8.568
  453   1HG2  VAL  58          1HG2      VAL  58   5.517   4.786 -10.851
  454   2HG2  VAL  58          3HG2      VAL  58   7.031   5.686 -10.841
  455   3HG2  VAL  58          2HG2      VAL  58   6.969   4.076 -11.559
  456    H    LYS  59           H        LYS  59   3.967   4.800  -7.403
  457    HA   LYS  59           HA       LYS  59   4.674   3.039  -5.115
  458   1HB   LYS  59          2HB       LYS  59   2.818   5.150  -5.470
  459   2HB   LYS  59          1HB       LYS  59   1.862   3.676  -5.312
  460   1HG   LYS  59          2HG       LYS  59   2.703   3.207  -3.177
  461   2HG   LYS  59          1HG       LYS  59   4.146   4.190  -3.424
  462   1HD   LYS  59          2HD       LYS  59   1.518   5.592  -3.548
  463   2HD   LYS  59          1HD       LYS  59   2.062   5.051  -1.959
  464   1HE   LYS  59          2HE       LYS  59   3.775   6.557  -1.895
  465   2HE   LYS  59          1HE       LYS  59   4.135   6.367  -3.612
  466   1HZ   LYS  59          3HZ       LYS  59   1.765   7.820  -2.576
  467   2HZ   LYS  59          2HZ       LYS  59   3.229   8.578  -2.987
  468   3HZ   LYS  59          1HZ       LYS  59   2.322   7.772  -4.178
  469    H    HIS  60           H        HIS  60   2.345   1.563  -4.854
  470    HA   HIS  60           HA       HIS  60   1.651   0.391  -7.440
  471   1HB   HIS  60          2HB       HIS  60   3.096  -1.378  -5.467
  472   2HB   HIS  60          1HB       HIS  60   2.575  -1.792  -7.096
  473    HD1  HIS  60           HD1      HIS  60   4.050  -1.074  -9.048
  474    HD2  HIS  60           HD2      HIS  60   5.396   0.388  -5.383
  475    HE1  HIS  60           HE1      HIS  60   6.351  -0.102  -9.469
  476    H    TYR  61           H        TYR  61   0.006  -1.188  -7.292
  477    HA   TYR  61           HA       TYR  61  -1.309  -1.411  -4.620
  478   1HB   TYR  61          2HB       TYR  61  -2.460  -0.467  -7.224
  479   2HB   TYR  61          1HB       TYR  61  -3.498  -1.399  -6.141
  480    HD1  TYR  61           HD1      TYR  61  -3.266  -0.667  -3.561
  481    HD2  TYR  61           HD2      TYR  61  -2.421   1.843  -6.942
  482    HE1  TYR  61           HE1      TYR  61  -3.578   1.344  -2.144
  483    HE2  TYR  61           HE2      TYR  61  -2.734   3.856  -5.525
  484    HH   TYR  61           HH       TYR  61  -2.512   4.315  -2.913
  485    H    LYS  62           H        LYS  62  -0.532  -3.524  -4.386
  486    HA   LYS  62           HA       LYS  62  -0.436  -5.554  -6.306
  487   1HB   LYS  62          2HB       LYS  62   0.479  -5.704  -3.988
  488   2HB   LYS  62          1HB       LYS  62  -1.162  -5.912  -3.385
  489   1HG   LYS  62          2HG       LYS  62  -0.450  -7.716  -5.604
  490   2HG   LYS  62          1HG       LYS  62   0.498  -7.964  -4.137
  491   1HD   LYS  62          2HD       LYS  62  -2.532  -7.827  -4.220
  492   2HD   LYS  62          1HD       LYS  62  -1.601  -9.324  -4.181
  493   1HE   LYS  62          2HE       LYS  62  -0.962  -9.031  -1.984
  494   2HE   LYS  62          1HE       LYS  62  -0.979  -7.272  -2.106
  495   1HZ   LYS  62          3HZ       LYS  62  -3.536  -8.631  -2.413
  496   2HZ   LYS  62          2HZ       LYS  62  -2.859  -8.637  -0.854
  497   3HZ   LYS  62          1HZ       LYS  62  -3.171  -7.165  -1.642
  498    H    ILE  63           H        ILE  63  -2.043  -6.260  -7.575
  499    HA   ILE  63           HA       ILE  63  -4.847  -6.050  -6.698
  500    HB   ILE  63           HB       ILE  63  -3.457  -6.711  -9.285
  501   1HG1  ILE  63          2HG1      ILE  63  -5.256  -4.948  -9.982
  502   2HG1  ILE  63          1HG1      ILE  63  -5.385  -4.650  -8.251
  503   1HG2  ILE  63          3HG2      ILE  63  -6.233  -7.477  -8.446
  504   2HG2  ILE  63          2HG2      ILE  63  -5.964  -6.941 -10.105
  505   3HG2  ILE  63          1HG2      ILE  63  -5.100  -8.346  -9.481
  506   1HD1  ILE  63          3HD1      ILE  63  -2.657  -4.689  -8.634
  507   2HD1  ILE  63          2HD1      ILE  63  -3.233  -3.932 -10.119
  508   3HD1  ILE  63          1HD1      ILE  63  -3.641  -3.229  -8.554
  509    H    ARG  64           H        ARG  64  -6.120  -7.794  -6.150
  510    HA   ARG  64           HA       ARG  64  -4.812 -10.485  -6.215
  511   1HB   ARG  64          2HB       ARG  64  -5.726  -9.023  -3.966
  512   2HB   ARG  64          1HB       ARG  64  -6.915 -10.297  -4.239
  513   1HG   ARG  64          2HG       ARG  64  -4.983 -10.967  -2.749
  514   2HG   ARG  64          1HG       ARG  64  -5.218 -12.004  -4.156
  515   1HD   ARG  64          2HD       ARG  64  -3.305 -11.256  -5.197
  516   2HD   ARG  64          1HD       ARG  64  -3.420  -9.648  -4.483
  517    HE   ARG  64           HE       ARG  64  -2.048 -10.426  -2.737
  518   1HH1  ARG  64          2HH1      ARG  64  -3.339 -13.024  -4.583
  519   2HH1  ARG  64          1HH1      ARG  64  -2.697 -14.257  -3.550
  520   1HH2  ARG  64          1HH2      ARG  64  -1.349 -12.020  -1.271
  521   2HH2  ARG  64          2HH2      ARG  64  -1.572 -13.690  -1.675
  522    H    LYS  65           H        LYS  65  -6.783 -12.202  -5.932
  523    HA   LYS  65           HA       LYS  65  -9.043 -11.206  -7.563
  524   1HB   LYS  65          2HB       LYS  65  -7.733 -12.272  -9.231
  525   2HB   LYS  65          1HB       LYS  65  -7.348 -13.626  -8.171
  526   1HG   LYS  65          2HG       LYS  65  -9.767 -14.274  -8.161
  527   2HG   LYS  65          1HG       LYS  65 -10.106 -12.964  -9.287
  528   1HD   LYS  65          2HD       LYS  65  -9.081 -14.034 -11.059
  529   2HD   LYS  65          1HD       LYS  65  -7.930 -14.877 -10.021
  530   1HE   LYS  65          2HE       LYS  65 -10.813 -15.571  -9.699
  531   2HE   LYS  65          1HE       LYS  65 -10.008 -16.139 -11.163
  532   1HZ   LYS  65          3HZ       LYS  65  -8.245 -17.059  -9.719
  533   2HZ   LYS  65          2HZ       LYS  65  -9.171 -16.636  -8.359
  534   3HZ   LYS  65          1HZ       LYS  65  -9.759 -17.780  -9.468
  535    H    LEU  66           H        LEU  66 -10.883 -11.660  -6.575
  536    HA   LEU  66           HA       LEU  66 -10.941 -13.796  -4.527
  537   1HB   LEU  66          2HB       LEU  66 -13.381 -12.239  -5.226
  538   2HB   LEU  66          1HB       LEU  66 -12.761 -12.690  -3.638
  539    HG   LEU  66           HG       LEU  66 -10.810 -11.012  -4.589
  540   1HD1  LEU  66          3HD1      LEU  66 -13.454 -10.263  -5.761
  541   2HD1  LEU  66          2HD1      LEU  66 -12.386  -8.979  -5.196
  542   3HD1  LEU  66          1HD1      LEU  66 -11.837 -10.092  -6.446
  543   1HD2  LEU  66          2HD2      LEU  66 -13.249 -10.410  -2.918
  544   2HD2  LEU  66          1HD2      LEU  66 -11.670 -10.943  -2.343
  545   3HD2  LEU  66          3HD2      LEU  66 -11.855  -9.336  -3.043
  546    H    ASP  67           H        ASP  67 -12.048 -15.711  -4.877
  547    HA   ASP  67           HA       ASP  67 -12.848 -16.368  -7.589
  548   1HB   ASP  67          2HB       ASP  67 -12.544 -17.709  -5.034
  549   2HB   ASP  67          1HB       ASP  67 -14.020 -18.217  -5.845
  550    H    ASN  68           H        ASN  68 -14.245 -14.743  -4.990
  551    HA   ASN  68           HA       ASN  68 -17.032 -15.409  -5.596
  552   1HB   ASN  68          2HB       ASN  68 -15.863 -13.231  -3.843
  553   2HB   ASN  68          1HB       ASN  68 -17.535 -13.801  -3.830
  554   1HD2  ASN  68          2HD2      ASN  68 -14.785 -15.759  -1.639
  555   2HD2  ASN  68          1HD2      ASN  68 -14.471 -14.270  -2.391
  556    H    GLY  69           H        GLY  69 -14.656 -13.372  -6.928
  557   1HA   GLY  69          2HA       GLY  69 -16.778 -11.957  -8.376
  558   2HA   GLY  69          1HA       GLY  69 -15.741 -10.930  -7.400
  559    H    GLY  70           H        GLY  70 -13.533 -10.701  -8.023
  560   1HA   GLY  70          2HA       GLY  70 -12.421 -12.102 -10.275
  561   2HA   GLY  70          1HA       GLY  70 -13.048 -10.538 -10.767
  562    H    TYR  71           H        TYR  71 -11.847  -8.704 -10.322
  563    HA   TYR  71           HA       TYR  71  -9.330  -9.202  -8.767
  564   1HB   TYR  71          2HB       TYR  71  -9.819  -7.391 -11.147
  565   2HB   TYR  71          1HB       TYR  71  -8.324  -7.399 -10.211
  566    HD1  TYR  71           HD1      TYR  71  -8.683 -10.533  -9.685
  567    HD2  TYR  71           HD2      TYR  71  -8.522  -8.048 -13.192
  568    HE1  TYR  71           HE1      TYR  71  -7.869 -12.462 -11.034
  569    HE2  TYR  71           HE2      TYR  71  -7.713  -9.964 -14.522
  570    HH   TYR  71           HH       TYR  71  -7.203 -13.163 -13.022
  571    H    TYR  72           H        TYR  72  -8.672  -7.714  -7.276
  572    HA   TYR  72           HA       TYR  72 -10.133  -5.146  -7.036
  573   1HB   TYR  72          2HB       TYR  72 -10.912  -5.524  -4.800
  574   2HB   TYR  72          1HB       TYR  72 -11.459  -6.885  -5.765
  575    HD1  TYR  72           HD1      TYR  72 -10.300  -9.079  -5.623
  576    HD2  TYR  72           HD2      TYR  72  -9.266  -5.799  -3.061
  577    HE1  TYR  72           HE1      TYR  72  -9.061 -10.630  -4.127
  578    HE2  TYR  72           HE2      TYR  72  -8.030  -7.332  -1.574
  579    HH   TYR  72           HH       TYR  72  -7.330  -9.418  -1.255
  580    H    ILE  73           H        ILE  73  -8.641  -3.599  -6.439
  581    HA   ILE  73           HA       ILE  73  -6.019  -4.446  -5.391
  582    HB   ILE  73           HB       ILE  73  -7.239  -1.737  -6.016
  583   1HG1  ILE  73          2HG1      ILE  73  -4.781  -3.156  -7.073
  584   2HG1  ILE  73          1HG1      ILE  73  -6.345  -3.114  -7.886
  585   1HG2  ILE  73          2HG2      ILE  73  -5.878  -1.605  -3.934
  586   2HG2  ILE  73          1HG2      ILE  73  -4.510  -2.272  -4.825
  587   3HG2  ILE  73          3HG2      ILE  73  -5.171  -0.698  -5.272
  588   1HD1  ILE  73          1HD1      ILE  73  -4.894  -0.589  -7.080
  589   2HD1  ILE  73          3HD1      ILE  73  -4.626  -1.365  -8.640
  590   3HD1  ILE  73          2HD1      ILE  73  -6.228  -0.761  -8.220
  591    H    THR  74           H        THR  74  -9.069  -3.191  -4.371
  592    HA   THR  74           HA       THR  74  -8.278  -3.542  -1.535
  593    HB   THR  74           HB       THR  74  -8.461  -1.301  -1.271
  594    HG1  THR  74           HG1      THR  74 -10.308  -1.586  -0.276
  595   1HG2  THR  74          1HG2      THR  74  -8.417  -1.019  -3.774
  596   2HG2  THR  74          3HG2      THR  74 -10.179  -1.096  -3.755
  597   3HG2  THR  74          2HG2      THR  74  -9.344   0.221  -2.932
  598    H    THR  75           H        THR  75  -9.845  -4.571  -0.349
  599    HA   THR  75           HA       THR  75 -11.743  -6.171  -1.755
  600    HB   THR  75           HB       THR  75 -12.540  -6.843   0.456
  601    HG1  THR  75           HG1      THR  75 -11.754  -5.725   2.271
  602   1HG2  THR  75          2HG2      THR  75  -9.840  -6.851  -0.465
  603   2HG2  THR  75          1HG2      THR  75  -9.815  -6.675   1.293
  604   3HG2  THR  75          3HG2      THR  75 -10.647  -8.046   0.556
  605    H    ARG  76           H        ARG  76 -11.929  -2.912  -0.916
  606    HA   ARG  76           HA       ARG  76 -14.701  -2.638  -0.313
  607   1HB   ARG  76          2HB       ARG  76 -12.479  -0.909  -0.802
  608   2HB   ARG  76          1HB       ARG  76 -13.812  -0.385  -1.832
  609   1HG   ARG  76          2HG       ARG  76 -14.350   0.746   0.117
  610   2HG   ARG  76          1HG       ARG  76 -15.217  -0.763   0.397
  611   1HD   ARG  76          2HD       ARG  76 -12.359  -0.651   1.247
  612   2HD   ARG  76          1HD       ARG  76 -13.527   0.250   2.214
  613    HE   ARG  76           HE       ARG  76 -13.520  -2.699   1.831
  614   1HH1  ARG  76          1HH2      ARG  76 -16.280  -2.232   2.103
  615   2HH1  ARG  76          2HH2      ARG  76 -16.552  -2.001   3.797
  616   1HH2  ARG  76          2HH1      ARG  76 -13.219  -1.364   4.515
  617   2HH2  ARG  76          1HH1      ARG  76 -14.819  -1.511   5.164
  618    H    ALA  77           H        ALA  77 -13.034  -3.318  -3.317
  619    HA   ALA  77           HA       ALA  77 -15.576  -3.745  -4.652
  620   1HB   ALA  77          1HB       ALA  77 -14.180  -1.155  -4.959
  621   2HB   ALA  77          3HB       ALA  77 -14.754  -1.900  -6.452
  622   3HB   ALA  77          2HB       ALA  77 -15.890  -1.544  -5.150
  623    H    GLN  78           H        GLN  78 -15.140  -5.446  -5.938
  624    HA   GLN  78           HA       GLN  78 -12.462  -5.675  -7.210
  625   1HB   GLN  78          2HB       GLN  78 -14.056  -8.036  -7.587
  626   2HB   GLN  78          1HB       GLN  78 -12.558  -7.872  -6.696
  627   1HG   GLN  78          2HG       GLN  78 -15.262  -7.200  -5.528
  628   2HG   GLN  78          1HG       GLN  78 -14.469  -8.753  -5.319
  629   1HE2  GLN  78          2HE2      GLN  78 -12.905  -7.445  -2.443
  630   2HE2  GLN  78          1HE2      GLN  78 -13.876  -8.661  -3.110
  631    H    PHE  79           H        PHE  79 -12.920  -7.172  -9.387
  632    HA   PHE  79           HA       PHE  79 -15.267  -6.153 -10.853
  633   1HB   PHE  79          2HB       PHE  79 -12.397  -5.509 -11.566
  634   2HB   PHE  79          1HB       PHE  79 -13.697  -5.461 -12.758
  635    HD1  PHE  79           HD1      PHE  79 -12.707  -4.168  -9.410
  636    HD2  PHE  79           HD2      PHE  79 -15.113  -3.577 -12.912
  637    HE1  PHE  79           HE1      PHE  79 -13.394  -1.960  -8.556
  638    HE2  PHE  79           HE2      PHE  79 -15.806  -1.352 -12.059
  639    HZ   PHE  79           HZ       PHE  79 -14.945  -0.537  -9.880
  640    H    GLU  80           H        GLU  80 -14.412  -7.046 -13.381
  641    HA   GLU  80           HA       GLU  80 -14.235  -9.942 -12.769
  642   1HB   GLU  80          2HB       GLU  80 -15.140 -10.238 -15.075
  643   2HB   GLU  80          1HB       GLU  80 -16.193  -9.266 -14.048
  644   1HG   GLU  80          2HG       GLU  80 -15.754  -7.319 -15.193
  645   2HG   GLU  80          1HG       GLU  80 -14.129  -7.827 -15.646
  646    H    THR  81           H        THR  81 -12.609  -7.382 -14.610
  647    HA   THR  81           HA       THR  81 -10.310  -9.230 -14.910
  648    HB   THR  81           HB       THR  81 -10.893  -9.733 -17.053
  649    HG1  THR  81           HG1      THR  81 -10.708  -7.148 -17.983
  650   1HG2  THR  81          3HG2      THR  81 -12.736  -7.371 -16.806
  651   2HG2  THR  81          2HG2      THR  81 -12.595  -8.311 -18.295
  652   3HG2  THR  81          1HG2      THR  81 -13.170  -9.082 -16.814
  653    H    LEU  82           H        LEU  82  -8.604  -7.797 -16.361
  654    HA   LEU  82           HA       LEU  82  -8.115  -5.466 -14.663
  655   1HB   LEU  82          2HB       LEU  82  -6.528  -6.587 -16.987
  656   2HB   LEU  82          1HB       LEU  82  -5.977  -5.322 -15.886
  657    HG   LEU  82           HG       LEU  82  -6.998  -7.810 -14.624
  658   1HD1  LEU  82          3HD1      LEU  82  -5.455  -8.326 -16.718
  659   2HD1  LEU  82          2HD1      LEU  82  -4.172  -7.865 -15.596
  660   3HD1  LEU  82          1HD1      LEU  82  -5.258  -9.201 -15.201
  661   1HD2  LEU  82          2HD2      LEU  82  -5.789  -5.590 -13.695
  662   2HD2  LEU  82          1HD2      LEU  82  -5.629  -7.161 -12.908
  663   3HD2  LEU  82          3HD2      LEU  82  -4.364  -6.586 -13.993
  664    H    GLN  83           H        GLN  83  -9.210  -6.132 -17.910
  665    HA   GLN  83           HA       GLN  83  -8.942  -3.389 -18.820
  666   1HB   GLN  83          2HB       GLN  83  -9.510  -5.879 -20.018
  667   2HB   GLN  83          1HB       GLN  83 -10.954  -4.895 -20.256
  668   1HG   GLN  83          2HG       GLN  83  -9.275  -3.027 -20.962
  669   2HG   GLN  83          1HG       GLN  83  -8.134  -4.357 -21.168
  670   1HE2  GLN  83          2HE2      GLN  83 -11.135  -3.833 -23.865
  671   2HE2  GLN  83          1HE2      GLN  83 -11.001  -2.829 -22.503
  672    H    GLN  84           H        GLN  84 -11.504  -5.404 -17.440
  673    HA   GLN  84           HA       GLN  84 -13.567  -3.402 -17.730
  674   1HB   GLN  84          2HB       GLN  84 -13.362  -5.865 -15.997
  675   2HB   GLN  84          1HB       GLN  84 -14.778  -4.829 -16.019
  676   1HG   GLN  84          2HG       GLN  84 -13.751  -6.660 -18.151
  677   2HG   GLN  84          1HG       GLN  84 -15.403  -6.390 -17.617
  678   1HE2  GLN  84          2HE2      GLN  84 -13.775  -4.038 -20.539
  679   2HE2  GLN  84          1HE2      GLN  84 -12.791  -5.081 -19.634
  680    H    LEU  85           H        LEU  85 -11.258  -4.212 -15.193
  681    HA   LEU  85           HA       LEU  85 -12.437  -2.251 -13.340
  682   1HB   LEU  85          2HB       LEU  85 -11.058  -3.148 -11.762
  683   2HB   LEU  85          1HB       LEU  85 -10.885  -4.455 -12.927
  684    HG   LEU  85           HG       LEU  85  -8.992  -2.723 -13.839
  685   1HD1  LEU  85          3HD1      LEU  85  -9.363  -2.276 -10.888
  686   2HD1  LEU  85          2HD1      LEU  85  -7.762  -2.140 -11.617
  687   3HD1  LEU  85          1HD1      LEU  85  -9.071  -1.088 -12.158
  688   1HD2  LEU  85          3HD2      LEU  85  -9.014  -5.221 -13.040
  689   2HD2  LEU  85          2HD2      LEU  85  -7.499  -4.331 -13.169
  690   3HD2  LEU  85          1HD2      LEU  85  -8.267  -4.543 -11.594
  691    H    VAL  86           H        VAL  86  -9.823  -2.288 -15.706
  692    HA   VAL  86           HA       VAL  86  -8.813   0.253 -14.808
  693    HB   VAL  86           HB       VAL  86  -7.731   0.391 -17.045
  694   1HG1  VAL  86          1HG1      VAL  86  -7.513  -1.869 -15.178
  695   2HG1  VAL  86          3HG1      VAL  86  -6.858  -2.211 -16.780
  696   3HG1  VAL  86          2HG1      VAL  86  -6.246  -0.843 -15.851
  697   1HG2  VAL  86          2HG2      VAL  86  -9.351  -2.114 -17.539
  698   2HG2  VAL  86          1HG2      VAL  86  -9.539  -0.571 -18.369
  699   3HG2  VAL  86          3HG2      VAL  86  -8.074  -1.527 -18.602
  700    H    GLN  87           H        GLN  87 -11.506  -0.900 -16.514
  701    HA   GLN  87           HA       GLN  87 -12.208   1.502 -17.948
  702   1HB   GLN  87          2HB       GLN  87 -13.023  -0.804 -18.500
  703   2HB   GLN  87          1HB       GLN  87 -13.988  -0.761 -17.035
  704   1HG   GLN  87          2HG       GLN  87 -15.413  -0.084 -18.863
  705   2HG   GLN  87          1HG       GLN  87 -15.065   1.338 -17.880
  706   1HE2  GLN  87          2HE2      GLN  87 -12.871   1.080 -21.355
  707   2HE2  GLN  87          1HE2      GLN  87 -13.046  -0.299 -20.381
  708    H    HIS  88           H        HIS  88 -13.159   0.019 -14.898
  709    HA   HIS  88           HA       HIS  88 -15.078   2.042 -14.199
  710   1HB   HIS  88          2HB       HIS  88 -14.812  -0.403 -13.322
  711   2HB   HIS  88          1HB       HIS  88 -13.659   0.310 -12.201
  712    HD1  HIS  88           HD1      HIS  88 -17.291   0.024 -12.903
  713    HD2  HIS  88           HD2      HIS  88 -14.831   2.273 -10.400
  714    HE1  HIS  88           HE1      HIS  88 -18.807   1.092 -11.179
  715    H    TYR  89           H        TYR  89 -11.725   1.386 -13.434
  716    HA   TYR  89           HA       TYR  89 -11.457   3.618 -11.622
  717   1HB   TYR  89          2HB       TYR  89  -9.454   1.841 -13.015
  718   2HB   TYR  89          1HB       TYR  89  -8.972   3.148 -11.943
  719    HD1  TYR  89           HD1      TYR  89 -11.557   0.434 -11.923
  720    HD2  TYR  89           HD2      TYR  89  -8.440   2.450  -9.777
  721    HE1  TYR  89           HE1      TYR  89 -11.902  -1.084 -10.030
  722    HE2  TYR  89           HE2      TYR  89  -8.795   0.930  -7.849
  723    HH   TYR  89           HH       TYR  89 -11.127  -0.574  -7.100
  724    H    SER  90           H        SER  90 -11.501   3.267 -15.015
  725    HA   SER  90           HA       SER  90  -9.776   5.434 -15.733
  726   1HB   SER  90          2HB       SER  90 -11.472   3.550 -17.082
  727   2HB   SER  90          1HB       SER  90 -11.813   5.171 -17.688
  728    HG   SER  90           HG       SER  90  -9.744   3.624 -18.240
  729    H    GLU  91           H        GLU  91 -13.186   5.169 -14.924
  730    HA   GLU  91           HA       GLU  91 -13.552   8.075 -15.406
  731   1HB   GLU  91          2HB       GLU  91 -15.587   5.994 -14.551
  732   2HB   GLU  91          1HB       GLU  91 -15.929   7.639 -15.086
  733   1HG   GLU  91          2HG       GLU  91 -14.339   6.538 -17.119
  734   2HG   GLU  91          1HG       GLU  91 -15.463   5.252 -16.678
  735    H    ARG  92           H        ARG  92 -12.845   5.864 -12.891
  736    HA   ARG  92           HA       ARG  92 -13.163   8.067 -10.921
  737   1HB   ARG  92          2HB       ARG  92 -14.107   5.331 -10.126
  738   2HB   ARG  92          1HB       ARG  92 -14.543   6.900  -9.448
  739   1HG   ARG  92          2HG       ARG  92 -15.805   7.442 -11.492
  740   2HG   ARG  92          1HG       ARG  92 -15.348   5.891 -12.195
  741   1HD   ARG  92          2HD       ARG  92 -16.385   5.042  -9.841
  742   2HD   ARG  92          1HD       ARG  92 -17.346   6.500 -10.083
  743    HE   ARG  92           HE       ARG  92 -17.165   4.655 -12.383
  744   1HH1  ARG  92          2HH1      ARG  92 -18.742   5.007  -9.398
  745   2HH1  ARG  92          1HH1      ARG  92 -20.339   4.814 -10.039
  746   1HH2  ARG  92          1HH2      ARG  92 -19.294   4.777 -13.345
  747   2HH2  ARG  92          2HH2      ARG  92 -20.652   4.683 -12.274
  748    H    ALA  93           H        ALA  93 -12.000   7.523  -8.845
  749    HA   ALA  93           HA       ALA  93  -9.460   6.208  -9.483
  750   1HB   ALA  93          1HB       ALA  93  -9.510   8.275  -8.116
  751   2HB   ALA  93          3HB       ALA  93 -10.437   7.426  -6.879
  752   3HB   ALA  93          2HB       ALA  93  -8.778   6.937  -7.228
  753    H    ALA  94           H        ALA  94 -12.296   5.591  -7.494
  754    HA   ALA  94           HA       ALA  94 -13.120   3.399  -6.969
  755   1HB   ALA  94          1HB       ALA  94 -11.056   2.548  -8.407
  756   2HB   ALA  94          3HB       ALA  94 -10.356   2.264  -6.813
  757   3HB   ALA  94          2HB       ALA  94 -11.868   1.477  -7.265
  758    H    GLY  95           H        GLY  95 -10.416   5.084  -5.559
  759   1HA   GLY  95          2HA       GLY  95 -11.122   5.607  -3.096
  760   2HA   GLY  95          1HA       GLY  95 -11.047   3.857  -2.921
  761    H    LEU  96           H        LEU  96  -8.669   4.252  -5.037
  762    HA   LEU  96           HA       LEU  96  -6.623   4.181  -2.966
  763   1HB   LEU  96          2HB       LEU  96  -5.123   3.569  -4.691
  764   2HB   LEU  96          1HB       LEU  96  -6.652   2.823  -5.145
  765    HG   LEU  96           HG       LEU  96  -5.604   5.457  -6.203
  766   1HD1  LEU  96          1HD1      LEU  96  -5.446   2.632  -7.100
  767   2HD1  LEU  96          3HD1      LEU  96  -5.765   3.844  -8.340
  768   3HD1  LEU  96          2HD1      LEU  96  -4.305   3.954  -7.356
  769   1HD2  LEU  96          1HD2      LEU  96  -8.089   3.848  -6.756
  770   2HD2  LEU  96          3HD2      LEU  96  -7.982   5.540  -6.270
  771   3HD2  LEU  96          2HD2      LEU  96  -7.479   5.054  -7.890
  772    H    SER  97           H        SER  97  -4.492   5.516  -4.280
  773    HA   SER  97           HA       SER  97  -5.043   8.236  -3.424
  774   1HB   SER  97          2HB       SER  97  -2.763   8.578  -3.597
  775   2HB   SER  97          1HB       SER  97  -2.787   6.821  -3.457
  776    HG   SER  97           HG       SER  97  -2.258   8.434  -5.651
  777    H    SER  98           H        SER  98  -4.442   6.686  -6.559
  778    HA   SER  98           HA       SER  98  -5.842   8.967  -7.850
  779   1HB   SER  98          2HB       SER  98  -3.083   7.950  -8.570
  780   2HB   SER  98          1HB       SER  98  -4.064   8.915  -9.671
  781    HG   SER  98           HG       SER  98  -2.924   9.621  -7.204
  782    H    ARG  99           H        ARG  99  -6.769   8.391  -9.914
  783    HA   ARG  99           HA       ARG  99  -7.751   5.719 -10.062
  784   1HB   ARG  99          2HB       ARG  99  -8.629   6.374 -12.263
  785   2HB   ARG  99          1HB       ARG  99  -8.903   7.653 -11.084
  786   1HG   ARG  99          2HG       ARG  99  -6.882   8.826 -11.897
  787   2HG   ARG  99          1HG       ARG  99  -6.631   7.552 -13.091
  788   1HD   ARG  99          2HD       ARG  99  -8.796   8.066 -14.127
  789   2HD   ARG  99          1HD       ARG  99  -9.106   9.298 -12.903
  790    HE   ARG  99           HE       ARG  99  -7.296   9.565 -15.196
  791   1HH1  ARG  99          2HH1      ARG  99  -5.723  10.373 -12.782
  792   2HH1  ARG  99          1HH1      ARG  99  -6.116  12.054 -12.636
  793   1HH2  ARG  99          1HH2      ARG  99  -8.891  11.858 -14.706
  794   2HH2  ARG  99          2HH2      ARG  99  -7.909  12.894 -13.725
  795    H    LEU 100           H        LEU 100  -7.134   5.695 -13.139
  796    HA   LEU 100           HA       LEU 100  -4.482   4.355 -12.818
  797   1HB   LEU 100          2HB       LEU 100  -5.426   3.258 -15.095
  798   2HB   LEU 100          1HB       LEU 100  -5.772   2.585 -13.504
  799    HG   LEU 100           HG       LEU 100  -7.845   4.044 -13.452
  800   1HD1  LEU 100          2HD1      LEU 100  -6.627   4.907 -15.952
  801   2HD1  LEU 100          1HD1      LEU 100  -8.294   4.381 -16.185
  802   3HD1  LEU 100          3HD1      LEU 100  -7.925   5.659 -15.025
  803   1HD2  LEU 100          1HD2      LEU 100  -7.739   1.589 -14.146
  804   2HD2  LEU 100          3HD2      LEU 100  -9.143   2.499 -14.699
  805   3HD2  LEU 100          2HD2      LEU 100  -7.816   2.164 -15.812
  806    H    VAL 101           H        VAL 101  -3.838   4.082 -15.520
  807    HA   VAL 101           HA       VAL 101  -2.431   6.328 -16.197
  808    HB   VAL 101           HB       VAL 101  -3.684   5.439 -18.650
  809   1HG1  VAL 101          1HG1      VAL 101  -1.035   5.719 -17.409
  810   2HG1  VAL 101          3HG1      VAL 101  -1.145   4.376 -18.552
  811   3HG1  VAL 101          2HG1      VAL 101  -1.539   6.018 -19.075
  812   1HG2  VAL 101          2HG2      VAL 101  -4.278   3.460 -17.227
  813   2HG2  VAL 101          1HG2      VAL 101  -3.190   3.078 -18.559
  814   3HG2  VAL 101          3HG2      VAL 101  -2.558   3.225 -16.919
  815    H    VAL 102           H        VAL 102  -3.235   8.377 -15.939
  816    HA   VAL 102           HA       VAL 102  -5.825   9.329 -16.332
  817    HB   VAL 102           HB       VAL 102  -4.143  10.814 -15.452
  818   1HG1  VAL 102          1HG1      VAL 102  -2.610   9.740 -17.660
  819   2HG1  VAL 102          3HG1      VAL 102  -2.525  11.502 -17.651
  820   3HG1  VAL 102          2HG1      VAL 102  -2.040  10.589 -16.223
  821   1HG2  VAL 102          3HG2      VAL 102  -5.216  11.624 -18.150
  822   2HG2  VAL 102          2HG2      VAL 102  -5.733  12.155 -16.551
  823   3HG2  VAL 102          1HG2      VAL 102  -4.203  12.723 -17.216
  824    HA   PRO 103           HA       PRO 103  -6.500   8.718 -20.631
  825   1HB   PRO 103          2HB       PRO 103  -8.516  10.557 -20.991
  826   2HB   PRO 103          1HB       PRO 103  -8.747   8.966 -20.249
  827   1HG   PRO 103          2HG       PRO 103  -8.589  11.658 -18.942
  828   2HG   PRO 103          1HG       PRO 103  -9.478  10.216 -18.427
  829   1HD   PRO 103          2HD       PRO 103  -7.041  11.082 -17.336
  830   2HD   PRO 103          1HD       PRO 103  -7.694   9.439 -17.183
  831    H    SER 104           H        SER 104  -6.264   9.855 -22.691
  832    HA   SER 104           HA       SER 104  -4.936  11.267 -24.030
  833   1HB   SER 104          2HB       SER 104  -5.738  13.474 -24.078
  834   2HB   SER 104          1HB       SER 104  -7.084  12.599 -23.349
  835    HG   SER 104           HG       SER 104  -6.842  13.903 -21.740
  836    H    HIS 105           H        HIS 105  -3.404  10.154 -22.018
  837    HA   HIS 105           HA       HIS 105  -2.064  11.878 -20.249
  838   1HB   HIS 105          2HB       HIS 105  -0.221  10.305 -20.314
  839   2HB   HIS 105          1HB       HIS 105  -1.724   9.389 -20.438
  840    HD1  HIS 105           HD1      HIS 105   1.336   8.899 -21.722
  841    HD2  HIS 105           HD2      HIS 105  -2.243   9.737 -23.688
  842    HE1  HIS 105           HE1      HIS 105   1.614   8.073 -24.101
  843    H    LYS 106           HN       LYS 106  -1.930  11.755 -23.718
  844    HA   LYS 106           HA       LYS 106  -0.602  12.931 -25.268
  845   1HB   LYS 106          2HB       LYS 106  -1.887  14.798 -24.443
  846   2HB   LYS 106          1HB       LYS 106  -0.888  14.912 -22.994
  847   1HG   LYS 106          2HG       LYS 106   0.867  15.904 -24.114
  848   2HG   LYS 106          1HG       LYS 106   0.492  15.092 -25.635
  849   1HD   LYS 106          2HD       LYS 106  -0.026  17.468 -25.848
  850   2HD   LYS 106          1HD       LYS 106  -1.528  16.545 -25.863
  851   1HE   LYS 106          2HE       LYS 106  -2.159  17.275 -23.758
  852   2HE   LYS 106          1HE       LYS 106  -0.494  17.508 -23.226
  853   1HZ   LYS 106          3HZ       LYS 106  -0.728  19.263 -25.264
  854   2HZ   LYS 106          2HZ       LYS 106  -2.270  19.339 -24.554
  855   3HZ   LYS 106          1HZ       LYS 106  -0.885  19.653 -23.622
  856   1H    GLU 201          1HT       GLU 201   8.873   1.092   2.168
  857   2H    GLU 201          3HT       GLU 201   9.658   1.190   0.668
  858   3H    GLU 201          2HT       GLU 201   8.516   2.370   1.106
  859    HA   GLU 201           HA       GLU 201   6.853   1.186   0.287
  860   1HB   GLU 201          2HB       GLU 201   7.440  -0.755  -1.141
  861   2HB   GLU 201          1HB       GLU 201   8.523   0.609  -1.424
  862   1HG   GLU 201          2HG       GLU 201   9.708  -0.818   0.678
  863   2HG   GLU 201          1HG       GLU 201   9.153  -2.054  -0.452
  864    HA   PRO 202           HA       PRO 202   6.754  -1.673   3.932
  865   1HB   PRO 202          2HB       PRO 202   4.802  -0.294   5.289
  866   2HB   PRO 202          1HB       PRO 202   6.535   0.016   5.485
  867   1HG   PRO 202          2HG       PRO 202   4.493   1.634   4.032
  868   2HG   PRO 202          1HG       PRO 202   6.010   2.155   4.784
  869   1HD   PRO 202          2HD       PRO 202   5.589   1.739   2.015
  870   2HD   PRO 202          1HD       PRO 202   7.164   1.933   2.815
  871    H    GLN 203           H        GLN 203   5.756  -3.195   2.439
  872    HA   GLN 203           HA       GLN 203   3.959  -4.479   1.649
  873   1HB   GLN 203          2HB       GLN 203   2.456  -2.840   3.712
  874   2HB   GLN 203          1HB       GLN 203   1.807  -4.255   2.884
  875   1HG   GLN 203          2HG       GLN 203   4.404  -4.376   4.419
  876   2HG   GLN 203          1HG       GLN 203   2.849  -4.642   5.208
  877   1HE2  GLN 203          2HE2      GLN 203   2.208  -7.687   3.318
  878   2HE2  GLN 203          1HE2      GLN 203   1.394  -6.310   3.886
  879   1HN   PTR 204          1HN       PTR 204   1.936  -4.265   0.342
  880    HA   PTR 204           HA       PTR 204   2.086  -1.969  -1.406
  881   1HB   PTR 204          1HB       PTR 204  -0.188  -3.009  -2.217
  882    HD1  PTR 204           HD1      PTR 204   1.206  -2.405  -4.161
  883    HD2  PTR 204           HD2      PTR 204   2.152  -5.775  -1.671
  884    HE1  PTR 204           HE1      PTR 204   2.757  -3.260  -5.902
  885    HE2  PTR 204           HE2      PTR 204   3.702  -6.627  -3.408
  886    H    GLU 205           H        GLU 205   0.562  -0.260  -1.629
  887    HA   GLU 205           HA       GLU 205  -0.735   0.530   0.870
  888   1HB   GLU 205          2HB       GLU 205  -0.213   1.778  -1.787
  889   2HB   GLU 205          1HB       GLU 205  -1.585   2.397  -0.867
  890   1HG   GLU 205          2HG       GLU 205   0.340   2.221   1.078
  891   2HG   GLU 205          1HG       GLU 205   1.303   2.657  -0.334
  892    H    GLU 206           H        GLU 206  -2.971   0.605   1.246
  893    HA   GLU 206           HA       GLU 206  -4.681  -0.615  -0.885
  894   1HB   GLU 206          2HB       GLU 206  -4.476  -1.222   2.048
  895   2HB   GLU 206          1HB       GLU 206  -6.029  -1.421   1.236
  896   1HG   GLU 206          2HG       GLU 206  -4.390  -2.638  -0.556
  897   2HG   GLU 206          1HG       GLU 206  -3.532  -2.989   0.945
  898    H    ILE 207           H        ILE 207  -7.127  -0.196  -0.173
  899    HA   ILE 207           HA       ILE 207  -7.322   2.738   0.253
  900    HB   ILE 207           HB       ILE 207  -9.134   0.667  -0.983
  901   1HG1  ILE 207          2HG1      ILE 207  -9.102   2.490  -2.795
  902   2HG1  ILE 207          1HG1      ILE 207  -7.803   3.235  -1.865
  903   1HG2  ILE 207          2HG2      ILE 207  -9.897   3.132   0.423
  904   2HG2  ILE 207          1HG2      ILE 207 -10.470   3.073  -1.244
  905   3HG2  ILE 207          3HG2      ILE 207 -10.905   1.789  -0.116
  906   1HD1  ILE 207          1HD1      ILE 207  -7.465   0.341  -2.327
  907   2HD1  ILE 207          3HD1      ILE 207  -7.416   1.326  -3.790
  908   3HD1  ILE 207          2HD1      ILE 207  -6.291   1.648  -2.470
  909    HA   PRO 208           HA       PRO 208  -8.734   1.465   4.346
  910   1HB   PRO 208          2HB       PRO 208  -8.348   3.944   5.470
  911   2HB   PRO 208          1HB       PRO 208  -7.055   2.750   5.265
  912   1HG   PRO 208          2HG       PRO 208  -7.570   5.245   3.712
  913   2HG   PRO 208          1HG       PRO 208  -6.042   4.393   3.993
  914   1HD   PRO 208          2HD       PRO 208  -7.582   4.284   1.624
  915   2HD   PRO 208          1HD       PRO 208  -6.253   3.187   2.055
  916    H    ILE 209           H        ILE 209 -10.232   3.070   5.932
  917    HA   ILE 209           HA       ILE 209 -12.203   4.606   4.426
  918    HB   ILE 209           HB       ILE 209 -12.819   2.180   3.995
  919   1HG1  ILE 209          2HG1      ILE 209 -15.167   2.962   5.452
  920   2HG1  ILE 209          1HG1      ILE 209 -14.429   4.406   4.757
  921   1HG2  ILE 209          2HG2      ILE 209 -12.209   1.796   6.604
  922   2HG2  ILE 209          1HG2      ILE 209 -13.952   2.027   6.738
  923   3HG2  ILE 209          3HG2      ILE 209 -13.309   0.745   5.713
  924   1HD1  ILE 209          3HD1      ILE 209 -14.241   3.025   2.579
  925   2HD1  ILE 209          2HD1      ILE 209 -15.396   1.927   3.335
  926   3HD1  ILE 209          1HD1      ILE 209 -15.842   3.607   3.037
  927    H    TYR 210           H        TYR 210 -10.410   4.704   6.871
  928    HA   TYR 210           HA       TYR 210 -12.497   5.182   8.947
  929   1HB   TYR 210          2HB       TYR 210 -10.256   5.418  10.359
  930   2HB   TYR 210          1HB       TYR 210 -10.944   3.836  10.011
  931    HD1  TYR 210           HD1      TYR 210  -8.435   6.335   8.845
  932    HD2  TYR 210           HD2      TYR 210  -9.767   2.253   8.688
  933    HE1  TYR 210           HE1      TYR 210  -6.359   5.704   7.642
  934    HE2  TYR 210           HE2      TYR 210  -7.690   1.623   7.486
  935    HH   TYR 210           HH       TYR 210  -5.200   2.739   7.412
  936    H    LEU 211           HN       LEU 211 -12.014   7.141  10.369
  937    HA   LEU 211           HA       LEU 211 -11.043   9.377   8.636
  938   1HB   LEU 211          2HB       LEU 211 -13.306   9.113  10.564
  939   2HB   LEU 211          1HB       LEU 211 -12.490  10.675  10.483
  940    HG   LEU 211           HG       LEU 211 -13.382   9.252   7.978
  941   1HD1  LEU 211          1HD1      LEU 211 -15.233   9.740   9.800
  942   2HD1  LEU 211          3HD1      LEU 211 -15.040  11.405   9.251
  943   3HD1  LEU 211          2HD1      LEU 211 -15.526  10.151   8.110
  944   1HD2  LEU 211          2HD2      LEU 211 -11.772  11.359   8.230
  945   2HD2  LEU 211          1HD2      LEU 211 -12.967  11.278   6.935
  946   3HD2  LEU 211          3HD2      LEU 211 -13.306  12.215   8.390
   
  No H/Q in entry =         946
  Start of MODEL   22
    1   1H    SER   1          3HT       SER   1  -9.874  -7.581 -24.516
    2   2H    SER   1          2HT       SER   1  -9.475  -8.054 -26.100
    3   3H    SER   1          1HT       SER   1  -9.880  -9.225 -24.937
    4    HA   SER   1           HA       SER   1  -7.811  -9.351 -24.185
    5   1HB   SER   1          2HB       SER   1  -6.078  -8.595 -25.689
    6   2HB   SER   1          1HB       SER   1  -7.456  -9.086 -26.674
    7    HG   SER   1           HG       SER   1  -6.856  -7.120 -27.428
    8    H    ILE   2           H        ILE   2  -6.937  -8.482 -22.369
    9    HA   ILE   2           HA       ILE   2  -7.604  -6.063 -21.207
   10    HB   ILE   2           HB       ILE   2  -6.344  -7.622 -19.908
   11   1HG1  ILE   2          2HG1      ILE   2  -4.350  -5.415 -20.442
   12   2HG1  ILE   2          1HG1      ILE   2  -5.875  -5.106 -19.612
   13   1HG2  ILE   2          3HG2      ILE   2  -5.145  -8.632 -21.853
   14   2HG2  ILE   2          2HG2      ILE   2  -4.069  -7.236 -21.875
   15   3HG2  ILE   2          1HG2      ILE   2  -4.080  -8.320 -20.484
   16   1HD1  ILE   2          2HD1      ILE   2  -5.249  -6.979 -18.010
   17   2HD1  ILE   2          1HD1      ILE   2  -3.648  -6.968 -18.749
   18   3HD1  ILE   2          3HD1      ILE   2  -4.240  -5.537 -17.905
   19    H    GLN   3           H        GLN   3  -6.900  -3.929 -21.361
   20    HA   GLN   3           HA       GLN   3  -5.996  -2.900 -23.798
   21   1HB   GLN   3          2HB       GLN   3  -6.813  -1.763 -21.491
   22   2HB   GLN   3          1HB       GLN   3  -5.078  -1.464 -21.362
   23   1HG   GLN   3          2HG       GLN   3  -5.606  -0.825 -24.000
   24   2HG   GLN   3          1HG       GLN   3  -7.057  -0.260 -23.171
   25   1HE2  GLN   3          2HE2      GLN   3  -5.004   2.659 -22.707
   26   2HE2  GLN   3          1HE2      GLN   3  -6.166   1.974 -23.738
   27    H    ALA   4           H        ALA   4  -4.019  -3.386 -20.884
   28    HA   ALA   4           HA       ALA   4  -1.673  -3.461 -20.668
   29   1HB   ALA   4          2HB       ALA   4  -2.434  -5.740 -21.556
   30   2HB   ALA   4          1HB       ALA   4  -1.857  -5.195 -23.131
   31   3HB   ALA   4          3HB       ALA   4  -0.731  -5.336 -21.781
   32    H    GLU   5           H        GLU   5  -0.990  -1.372 -21.200
   33    HA   GLU   5           HA       GLU   5   0.813  -0.985 -23.283
   34   1HB   GLU   5          2HB       GLU   5  -0.638   0.486 -24.827
   35   2HB   GLU   5          1HB       GLU   5  -0.830  -1.261 -24.972
   36   1HG   GLU   5          2HG       GLU   5  -2.845  -1.235 -23.671
   37   2HG   GLU   5          1HG       GLU   5  -2.579   0.436 -23.176
   38    H    GLU   6           H        GLU   6  -1.625   0.391 -21.190
   39    HA   GLU   6           HA       GLU   6   0.142   2.771 -20.847
   40   1HB   GLU   6          2HB       GLU   6  -2.801   2.684 -21.414
   41   2HB   GLU   6          1HB       GLU   6  -2.168   3.968 -20.383
   42   1HG   GLU   6          2HG       GLU   6  -0.670   4.722 -22.111
   43   2HG   GLU   6          1HG       GLU   6  -1.022   3.311 -23.108
   44    H    TRP   7           H        TRP   7  -2.350   0.665 -19.474
   45    HA   TRP   7           HA       TRP   7  -1.415   1.523 -16.768
   46   1HB   TRP   7          2HB       TRP   7  -3.692   0.837 -15.959
   47   2HB   TRP   7          1HB       TRP   7  -3.719   2.214 -17.056
   48    HD1  TRP   7           HD1      TRP   7  -4.754   1.877 -19.455
   49    HE1  TRP   7           HE1      TRP   7  -6.237   0.025 -20.466
   50    HE3  TRP   7           HE3      TRP   7  -4.162  -1.760 -15.922
   51    HZ2  TRP   7           HZ2      TRP   7  -7.061  -2.643 -19.859
   52    HZ3  TRP   7           HZ3      TRP   7  -5.308  -3.946 -16.163
   53    HH2  TRP   7           HH2      TRP   7  -6.754  -4.390 -18.125
   54    H    TYR   8           H        TYR   8  -0.803  -0.767 -18.803
   55    HA   TYR   8           HA       TYR   8  -0.393  -2.808 -16.743
   56   1HB   TYR   8          2HB       TYR   8  -2.590  -3.452 -17.241
   57   2HB   TYR   8          1HB       TYR   8  -2.394  -3.159 -18.968
   58    HD1  TYR   8           HD1      TYR   8  -0.401  -4.663 -20.067
   59    HD2  TYR   8           HD2      TYR   8  -2.597  -5.608 -16.504
   60    HE1  TYR   8           HE1      TYR   8   0.147  -7.062 -20.364
   61    HE2  TYR   8           HE2      TYR   8  -2.048  -7.998 -16.796
   62    HH   TYR   8           HH       TYR   8  -0.750  -9.247 -19.684
   63    H    PHE   9           H        PHE   9   1.547  -3.677 -17.136
   64    HA   PHE   9           HA       PHE   9   2.688  -3.370 -19.869
   65   1HB   PHE   9          2HB       PHE   9   3.833  -3.491 -17.105
   66   2HB   PHE   9          1HB       PHE   9   4.838  -4.011 -18.458
   67    HD1  PHE   9           HD1      PHE   9   2.184  -1.400 -18.564
   68    HD2  PHE   9           HD2      PHE   9   6.410  -2.195 -18.535
   69    HE1  PHE   9           HE1      PHE   9   2.638   0.971 -19.130
   70    HE2  PHE   9           HE2      PHE   9   6.858   0.176 -19.100
   71    HZ   PHE   9           HZ       PHE   9   4.973   1.759 -19.398
   72    H    GLY  10           H        GLY  10   1.868  -5.760 -17.427
   73   1HA   GLY  10          2HA       GLY  10   1.368  -7.984 -18.702
   74   2HA   GLY  10          1HA       GLY  10   3.065  -7.881 -19.146
   75    H    LYS  11           H        LYS  11   4.119  -9.366 -17.960
   76    HA   LYS  11           HA       LYS  11   3.485  -9.561 -15.058
   77   1HB   LYS  11          2HB       LYS  11   4.934 -11.739 -16.525
   78   2HB   LYS  11          1HB       LYS  11   3.884 -11.857 -15.112
   79   1HG   LYS  11          2HG       LYS  11   1.944 -11.240 -16.588
   80   2HG   LYS  11          1HG       LYS  11   3.031 -11.330 -17.974
   81   1HD   LYS  11          2HD       LYS  11   3.563 -13.694 -17.332
   82   2HD   LYS  11          1HD       LYS  11   2.343 -13.583 -16.062
   83   1HE   LYS  11          2HE       LYS  11   0.594 -13.630 -17.552
   84   2HE   LYS  11          1HE       LYS  11   1.499 -12.775 -18.802
   85   1HZ   LYS  11          1HZ       LYS  11   2.782 -14.786 -19.195
   86   2HZ   LYS  11          3HZ       LYS  11   1.903 -15.606 -17.998
   87   3HZ   LYS  11          2HZ       LYS  11   1.122 -15.077 -19.412
   88    H    LEU  12           H        LEU  12   4.957  -7.679 -14.987
   89    HA   LEU  12           HA       LEU  12   7.821  -8.497 -15.228
   90   1HB   LEU  12          2HB       LEU  12   8.228  -6.498 -16.191
   91   2HB   LEU  12          1HB       LEU  12   6.488  -6.309 -16.313
   92    HG   LEU  12           HG       LEU  12   8.315  -5.214 -14.174
   93   1HD1  LEU  12          1HD1      LEU  12   6.443  -4.024 -16.231
   94   2HD1  LEU  12          3HD1      LEU  12   7.118  -3.082 -14.897
   95   3HD1  LEU  12          2HD1      LEU  12   8.188  -3.799 -16.107
   96   1HD2  LEU  12          3HD2      LEU  12   5.626  -6.088 -13.859
   97   2HD2  LEU  12          2HD2      LEU  12   6.660  -5.238 -12.704
   98   3HD2  LEU  12          1HD2      LEU  12   5.648  -4.322 -13.822
   99    H    GLY  13           H        GLY  13   9.062  -6.724 -13.566
  100   1HA   GLY  13          2HA       GLY  13   8.023  -7.586 -10.914
  101   2HA   GLY  13          1HA       GLY  13   9.676  -7.065 -11.239
  102    H    ARG  14           H        ARG  14   7.797  -6.032  -9.197
  103    HA   ARG  14           HA       ARG  14   6.668  -3.530  -9.934
  104   1HB   ARG  14          2HB       ARG  14   7.119  -2.954  -7.465
  105   2HB   ARG  14          1HB       ARG  14   6.109  -4.365  -7.779
  106   1HG   ARG  14          2HG       ARG  14   7.563  -5.609  -6.588
  107   2HG   ARG  14          1HG       ARG  14   8.792  -5.276  -7.807
  108   1HD   ARG  14          2HD       ARG  14   9.481  -4.609  -5.485
  109   2HD   ARG  14          1HD       ARG  14   9.490  -3.269  -6.632
  110    HE   ARG  14           HE       ARG  14   6.946  -3.225  -5.470
  111   1HH1  ARG  14          2HH1      ARG  14   9.490  -4.085  -3.558
  112   2HH1  ARG  14          1HH1      ARG  14   9.495  -2.662  -2.569
  113   1HH2  ARG  14          1HH2      ARG  14   7.259  -0.937  -4.581
  114   2HH2  ARG  14          2HH2      ARG  14   8.231  -0.879  -3.150
  115    H    LYS  15           H        LYS  15   9.949  -4.507  -9.517
  116    HA   LYS  15           HA       LYS  15  11.027  -1.863  -9.093
  117   1HB   LYS  15          2HB       LYS  15  12.131  -4.082  -8.440
  118   2HB   LYS  15          1HB       LYS  15  12.520  -4.263 -10.151
  119   1HG   LYS  15          2HG       LYS  15  13.798  -2.207 -10.141
  120   2HG   LYS  15          1HG       LYS  15  13.275  -1.836  -8.499
  121   1HD   LYS  15          2HD       LYS  15  14.335  -4.202  -7.969
  122   2HD   LYS  15          1HD       LYS  15  15.247  -3.887  -9.445
  123   1HE   LYS  15          2HE       LYS  15  15.468  -1.478  -8.169
  124   2HE   LYS  15          1HE       LYS  15  15.435  -2.586  -6.797
  125   1HZ   LYS  15          2HZ       LYS  15  17.079  -3.651  -8.816
  126   2HZ   LYS  15          1HZ       LYS  15  17.563  -2.053  -8.504
  127   3HZ   LYS  15          3HZ       LYS  15  17.505  -3.181  -7.240
  128    H    ASP  16           H        ASP  16  10.285  -3.933 -11.815
  129    HA   ASP  16           HA       ASP  16  11.751  -2.454 -13.765
  130   1HB   ASP  16          2HB       ASP  16  10.442  -4.843 -13.702
  131   2HB   ASP  16          1HB       ASP  16   9.287  -3.831 -14.531
  132    H    ALA  17           H        ALA  17   8.665  -2.196 -12.197
  133    HA   ALA  17           HA       ALA  17   7.461  -0.381 -14.081
  134   1HB   ALA  17          3HB       ALA  17   6.847  -0.889 -11.163
  135   2HB   ALA  17          2HB       ALA  17   5.828   0.046 -12.261
  136   3HB   ALA  17          1HB       ALA  17   6.078  -1.677 -12.542
  137    H    GLU  18           H        GLU  18   9.104   0.069 -10.959
  138    HA   GLU  18           HA       GLU  18   8.930   2.913 -10.917
  139   1HB   GLU  18          2HB       GLU  18  10.868   2.825  -9.385
  140   2HB   GLU  18          1HB       GLU  18   9.699   1.574  -8.967
  141   1HG   GLU  18          2HG       GLU  18  11.025  -0.145  -9.829
  142   2HG   GLU  18          1HG       GLU  18  11.936   0.948 -10.872
  143    H    ARG  19           H        ARG  19  10.973   0.713 -12.662
  144    HA   ARG  19           HA       ARG  19  12.740   2.897 -13.592
  145   1HB   ARG  19          2HB       ARG  19  13.117   0.174 -13.206
  146   2HB   ARG  19          1HB       ARG  19  12.996   0.321 -14.960
  147   1HG   ARG  19          2HG       ARG  19  14.619   2.448 -13.785
  148   2HG   ARG  19          1HG       ARG  19  15.265   0.846 -13.430
  149   1HD   ARG  19          2HD       ARG  19  15.436   0.289 -15.735
  150   2HD   ARG  19          1HD       ARG  19  14.404   1.635 -16.217
  151    HE   ARG  19           HE       ARG  19  16.328   2.984 -16.227
  152   1HH1  ARG  19          1HH2      ARG  19  17.053   3.006 -13.436
  153   2HH1  ARG  19          2HH2      ARG  19  18.559   2.151 -13.379
  154   1HH2  ARG  19          2HH1      ARG  19  18.146   0.679 -16.491
  155   2HH2  ARG  19          1HH1      ARG  19  19.178   0.835 -15.109
  156    H    GLN  20           H        GLN  20   9.866   1.270 -14.581
  157    HA   GLN  20           HA       GLN  20  10.193   1.848 -17.432
  158   1HB   GLN  20          2HB       GLN  20   7.875   0.853 -15.760
  159   2HB   GLN  20          1HB       GLN  20   7.727   1.177 -17.486
  160   1HG   GLN  20          2HG       GLN  20  10.065  -0.463 -16.703
  161   2HG   GLN  20          1HG       GLN  20   8.494  -1.229 -16.465
  162   1HE2  GLN  20          2HE2      GLN  20   8.757  -2.151 -19.888
  163   2HE2  GLN  20          1HE2      GLN  20   8.794  -2.702 -18.284
  164    H    LEU  21           H        LEU  21   8.803   3.424 -14.632
  165    HA   LEU  21           HA       LEU  21   7.520   5.465 -16.357
  166   1HB   LEU  21          2HB       LEU  21   7.537   5.476 -13.342
  167   2HB   LEU  21          1HB       LEU  21   6.351   6.187 -14.437
  168    HG   LEU  21           HG       LEU  21   6.820   3.243 -13.902
  169   1HD1  LEU  21          3HD1      LEU  21   5.397   4.674 -12.329
  170   2HD1  LEU  21          2HD1      LEU  21   4.280   4.871 -13.678
  171   3HD1  LEU  21          1HD1      LEU  21   4.598   3.264 -13.025
  172   1HD2  LEU  21          3HD2      LEU  21   5.142   4.628 -16.011
  173   2HD2  LEU  21          2HD2      LEU  21   6.446   3.470 -16.275
  174   3HD2  LEU  21          1HD2      LEU  21   4.928   2.938 -15.553
  175    H    LEU  22           H        LEU  22   9.943   5.241 -13.753
  176    HA   LEU  22           HA       LEU  22  10.674   8.018 -13.872
  177   1HB   LEU  22          2HB       LEU  22  12.315   5.646 -12.929
  178   2HB   LEU  22          1HB       LEU  22  12.654   7.339 -12.575
  179    HG   LEU  22           HG       LEU  22  10.365   5.635 -11.597
  180   1HD1  LEU  22          1HD1      LEU  22  12.704   6.166 -10.436
  181   2HD1  LEU  22          3HD1      LEU  22  11.868   7.650  -9.980
  182   3HD1  LEU  22          2HD1      LEU  22  11.215   6.085  -9.494
  183   1HD2  LEU  22          3HD2      LEU  22  10.424   8.580 -12.089
  184   2HD2  LEU  22          2HD2      LEU  22   9.070   7.456 -12.172
  185   3HD2  LEU  22          1HD2      LEU  22   9.662   8.007 -10.605
  186    H    SER  23           H        SER  23  11.972   5.109 -15.489
  187    HA   SER  23           HA       SER  23  14.232   6.348 -16.689
  188   1HB   SER  23          2HB       SER  23  12.468   4.106 -17.718
  189   2HB   SER  23          1HB       SER  23  14.017   4.556 -18.430
  190    HG   SER  23           HG       SER  23  13.883   4.081 -15.680
  191    H    PHE  24           H        PHE  24  10.887   6.836 -17.238
  192    HA   PHE  24           HA       PHE  24  11.377   7.993 -19.935
  193   1HB   PHE  24          2HB       PHE  24   9.021   6.935 -18.483
  194   2HB   PHE  24          1HB       PHE  24   8.715   8.351 -19.488
  195    HD1  PHE  24           HD1      PHE  24  10.529   8.059 -21.726
  196    HD2  PHE  24           HD2      PHE  24   8.282   5.044 -19.650
  197    HE1  PHE  24           HE1      PHE  24  10.574   6.630 -23.752
  198    HE2  PHE  24           HE2      PHE  24   8.326   3.615 -21.677
  199    HZ   PHE  24           HZ       PHE  24   9.473   4.408 -23.729
  200    H    GLY  25           H        GLY  25   9.460   9.998 -19.965
  201   1HA   GLY  25          2HA       GLY  25  10.429  11.856 -17.827
  202   2HA   GLY  25          1HA       GLY  25  10.218  12.370 -19.500
  203    H    ASN  26           H        ASN  26   8.002  10.207 -17.819
  204    HA   ASN  26           HA       ASN  26   5.840  12.174 -18.296
  205   1HB   ASN  26          2HB       ASN  26   5.373   9.463 -17.098
  206   2HB   ASN  26          1HB       ASN  26   4.351  10.386 -18.199
  207   1HD2  ASN  26          2HD2      ASN  26   6.567   9.533 -21.044
  208   2HD2  ASN  26          1HD2      ASN  26   5.939  10.948 -20.349
  209    HA   PRO  27           HA       PRO  27   5.797  13.316 -14.033
  210   1HB   PRO  27          2HB       PRO  27   3.359  14.584 -14.053
  211   2HB   PRO  27          1HB       PRO  27   4.836  15.293 -14.722
  212   1HG   PRO  27          2HG       PRO  27   2.491  14.121 -16.152
  213   2HG   PRO  27          1HG       PRO  27   3.635  15.354 -16.703
  214   1HD   PRO  27          2HD       PRO  27   3.651  12.609 -17.430
  215   2HD   PRO  27          1HD       PRO  27   4.957  13.777 -17.724
  216    H    ARG  28           H        ARG  28   3.840  13.348 -12.242
  217    HA   ARG  28           HA       ARG  28   3.254  10.654 -11.623
  218   1HB   ARG  28          2HB       ARG  28   1.565  11.612 -10.028
  219   2HB   ARG  28          1HB       ARG  28   3.152  12.374  -9.909
  220   1HG   ARG  28          2HG       ARG  28   1.888  14.288 -10.053
  221   2HG   ARG  28          1HG       ARG  28   2.053  13.970 -11.780
  222   1HD   ARG  28          2HD       ARG  28  -0.172  13.683 -11.969
  223   2HD   ARG  28          1HD       ARG  28  -0.138  12.420 -10.738
  224    HE   ARG  28           HE       ARG  28  -0.901  15.211 -10.315
  225   1HH1  ARG  28          2HH1      ARG  28   1.126  14.881  -8.241
  226   2HH1  ARG  28          1HH1      ARG  28   0.263  14.122  -6.945
  227   1HH2  ARG  28          1HH2      ARG  28  -2.383  13.112  -8.947
  228   2HH2  ARG  28          2HH2      ARG  28  -1.724  13.121  -7.345
  229    H    GLY  29           H        GLY  29   0.665  10.173 -11.178
  230   1HA   GLY  29          2HA       GLY  29  -1.426   9.732 -12.175
  231   2HA   GLY  29          1HA       GLY  29  -1.078  10.999 -13.350
  232    H    THR  30           H        THR  30   1.549   8.973 -13.323
  233    HA   THR  30           HA       THR  30   0.547   7.552 -15.738
  234    HB   THR  30           HB       THR  30   3.413   7.672 -14.780
  235    HG1  THR  30           HG1      THR  30   1.826   9.598 -16.004
  236   1HG2  THR  30          2HG2      THR  30   2.298   6.183 -16.734
  237   2HG2  THR  30          1HG2      THR  30   2.620   7.661 -17.641
  238   3HG2  THR  30          3HG2      THR  30   3.941   6.816 -16.835
  239    H    PHE  31           H        PHE  31  -0.658   6.057 -14.287
  240    HA   PHE  31           HA       PHE  31   0.888   4.329 -12.520
  241   1HB   PHE  31          2HB       PHE  31  -1.887   3.681 -13.463
  242   2HB   PHE  31          1HB       PHE  31  -1.152   3.389 -11.888
  243    HD1  PHE  31           HD1      PHE  31   0.135   6.170 -11.621
  244    HD2  PHE  31           HD2      PHE  31  -3.828   4.899 -12.682
  245    HE1  PHE  31           HE1      PHE  31  -0.777   8.323 -10.794
  246    HE2  PHE  31           HE2      PHE  31  -4.739   7.053 -11.856
  247    HZ   PHE  31           HZ       PHE  31  -3.214   8.764 -10.911
  248    H    LEU  32           H        LEU  32  -0.188   1.846 -13.022
  249    HA   LEU  32           HA       LEU  32  -0.025   0.916 -15.697
  250   1HB   LEU  32          2HB       LEU  32   2.219   1.367 -15.996
  251   2HB   LEU  32          1HB       LEU  32   2.555   1.361 -14.270
  252    HG   LEU  32           HG       LEU  32   1.937  -1.192 -15.764
  253   1HD1  LEU  32          2HD1      LEU  32   3.930   0.148 -16.710
  254   2HD1  LEU  32          1HD1      LEU  32   4.717  -0.182 -15.167
  255   3HD1  LEU  32          3HD1      LEU  32   4.240  -1.517 -16.216
  256   1HD2  LEU  32          2HD2      LEU  32   2.453  -0.464 -13.046
  257   2HD2  LEU  32          1HD2      LEU  32   2.171  -2.075 -13.705
  258   3HD2  LEU  32          3HD2      LEU  32   3.811  -1.431 -13.621
  259    H    ILE  33           H        ILE  33   0.150  -1.525 -15.680
  260    HA   ILE  33           HA       ILE  33  -0.494  -2.604 -12.968
  261    HB   ILE  33           HB       ILE  33  -1.817  -3.109 -15.623
  262   1HG1  ILE  33          2HG1      ILE  33  -2.677  -2.551 -12.779
  263   2HG1  ILE  33          1HG1      ILE  33  -2.959  -1.561 -14.209
  264   1HG2  ILE  33          3HG2      ILE  33  -1.088  -5.337 -14.817
  265   2HG2  ILE  33          2HG2      ILE  33  -1.869  -5.015 -13.267
  266   3HG2  ILE  33          1HG2      ILE  33  -2.840  -5.155 -14.729
  267   1HD1  ILE  33          1HD1      ILE  33  -4.069  -4.090 -14.794
  268   2HD1  ILE  33          3HD1      ILE  33  -4.569  -3.714 -13.146
  269   3HD1  ILE  33          2HD1      ILE  33  -4.946  -2.596 -14.457
  270    H    ARG  34           H        ARG  34  -0.073  -5.080 -12.943
  271    HA   ARG  34           HA       ARG  34   1.696  -6.363 -14.732
  272   1HB   ARG  34          2HB       ARG  34   3.843  -6.057 -13.359
  273   2HB   ARG  34          1HB       ARG  34   3.354  -4.692 -14.362
  274   1HG   ARG  34          2HG       ARG  34   2.826  -3.387 -12.554
  275   2HG   ARG  34          1HG       ARG  34   2.226  -4.753 -11.616
  276   1HD   ARG  34          2HD       ARG  34   5.116  -3.964 -12.072
  277   2HD   ARG  34          1HD       ARG  34   4.241  -3.984 -10.542
  278    HE   ARG  34           HE       ARG  34   5.107  -6.414 -12.037
  279   1HH1  ARG  34          2HH1      ARG  34   3.175  -5.169  -9.522
  280   2HH1  ARG  34          1HH1      ARG  34   3.627  -6.380  -8.369
  281   1HH2  ARG  34          1HH2      ARG  34   5.998  -7.840 -10.436
  282   2HH2  ARG  34          2HH2      ARG  34   5.225  -7.894  -8.887
  283    H    GLU  35           H        GLU  35   2.238  -8.431 -13.980
  284    HA   GLU  35           HA       GLU  35   0.689  -9.544 -11.880
  285   1HB   GLU  35          2HB       GLU  35   2.912 -10.428 -13.628
  286   2HB   GLU  35          1HB       GLU  35   2.661 -11.361 -12.167
  287   1HG   GLU  35          2HG       GLU  35   0.187 -11.435 -12.813
  288   2HG   GLU  35          1HG       GLU  35   0.686 -10.796 -14.382
  289    H    SER  36           H        SER  36   1.072  -9.797  -9.702
  290    HA   SER  36           HA       SER  36   3.501  -8.576  -8.571
  291   1HB   SER  36          2HB       SER  36   1.064  -9.810  -7.246
  292   2HB   SER  36          1HB       SER  36   2.358  -8.966  -6.412
  293    HG   SER  36           HG       SER  36   1.184  -7.273  -6.778
  294    H    GLU  37           H        GLU  37   5.238  -9.824  -8.051
  295    HA   GLU  37           HA       GLU  37   4.950 -12.768  -8.068
  296   1HB   GLU  37          2HB       GLU  37   7.343 -10.948  -7.743
  297   2HB   GLU  37          1HB       GLU  37   7.431 -12.707  -7.748
  298   1HG   GLU  37          2HG       GLU  37   6.341 -12.688 -10.015
  299   2HG   GLU  37          1HG       GLU  37   6.469 -10.930 -10.008
  300    H    THR  38           H        THR  38   4.064 -10.674  -5.912
  301    HA   THR  38           HA       THR  38   5.599 -11.440  -3.561
  302    HB   THR  38           HB       THR  38   4.257  -9.251  -3.980
  303    HG1  THR  38           HG1      THR  38   3.600  -9.384  -1.631
  304   1HG2  THR  38          2HG2      THR  38   2.057 -11.074  -2.974
  305   2HG2  THR  38          1HG2      THR  38   1.938  -9.323  -3.142
  306   3HG2  THR  38          3HG2      THR  38   2.131 -10.335  -4.573
  307    H    THR  39           H        THR  39   2.408 -12.187  -4.900
  308    HA   THR  39           HA       THR  39   2.187 -14.394  -2.885
  309    HB   THR  39           HB       THR  39   0.332 -12.666  -3.145
  310    HG1  THR  39           HG1      THR  39  -0.020 -14.707  -2.210
  311   1HG2  THR  39          2HG2      THR  39   0.588 -13.527  -5.866
  312   2HG2  THR  39          1HG2      THR  39  -1.031 -13.922  -5.291
  313   3HG2  THR  39          3HG2      THR  39  -0.442 -12.264  -5.204
  314    H    LYS  40           H        LYS  40   0.574 -16.184  -4.130
  315    HA   LYS  40           HA       LYS  40   2.203 -17.791  -5.673
  316   1HB   LYS  40          2HB       LYS  40  -0.729 -17.543  -6.322
  317   2HB   LYS  40          1HB       LYS  40   0.270 -18.996  -6.314
  318   1HG   LYS  40          2HG       LYS  40   0.574 -18.518  -3.787
  319   2HG   LYS  40          1HG       LYS  40  -0.806 -17.435  -3.970
  320   1HD   LYS  40          2HD       LYS  40  -1.687 -19.574  -3.303
  321   2HD   LYS  40          1HD       LYS  40  -2.057 -19.382  -5.016
  322   1HE   LYS  40          2HE       LYS  40  -1.091 -21.648  -4.334
  323   2HE   LYS  40          1HE       LYS  40  -0.265 -20.830  -5.660
  324   1HZ   LYS  40          3HZ       LYS  40   0.607 -20.420  -2.875
  325   2HZ   LYS  40          2HZ       LYS  40   1.121 -21.788  -3.742
  326   3HZ   LYS  40          1HZ       LYS  40   1.493 -20.231  -4.309
  327    H    GLY  41           H        GLY  41   0.168 -15.130  -6.735
  328   1HA   GLY  41          2HA       GLY  41   1.693 -14.166  -8.795
  329   2HA   GLY  41          1HA       GLY  41   0.799 -15.489  -9.553
  330    H    ALA  42           H        ALA  42   0.252 -12.671  -7.464
  331    HA   ALA  42           HA       ALA  42  -2.532 -12.390  -8.397
  332   1HB   ALA  42          1HB       ALA  42  -0.788 -10.789  -6.500
  333   2HB   ALA  42          3HB       ALA  42  -2.475 -10.402  -6.846
  334   3HB   ALA  42          2HB       ALA  42  -2.066 -11.921  -6.053
  335    H    TYR  43           H        TYR  43  -2.612  -9.547  -8.445
  336    HA   TYR  43           HA       TYR  43  -0.809  -8.985 -10.750
  337   1HB   TYR  43          2HB       TYR  43  -3.678  -9.004 -10.741
  338   2HB   TYR  43          1HB       TYR  43  -3.111  -7.352 -11.014
  339    HD1  TYR  43           HD1      TYR  43  -0.721  -7.453 -12.443
  340    HD2  TYR  43           HD2      TYR  43  -4.059 -10.145 -12.753
  341    HE1  TYR  43           HE1      TYR  43  -0.007  -8.085 -14.740
  342    HE2  TYR  43           HE2      TYR  43  -3.343 -10.778 -15.041
  343    HH   TYR  43           HH       TYR  43  -0.334 -10.184 -16.249
  344    H    SER  44           H        SER  44  -1.217  -6.299 -11.069
  345    HA   SER  44           HA       SER  44  -1.130  -4.989  -8.444
  346   1HB   SER  44          2HB       SER  44   1.074  -5.868  -8.430
  347   2HB   SER  44          1HB       SER  44   1.323  -5.418 -10.118
  348    HG   SER  44           HG       SER  44   2.069  -4.008  -8.167
  349    H    LEU  45           H        LEU  45  -0.561  -2.681  -8.665
  350    HA   LEU  45           HA       LEU  45  -1.018  -1.565 -11.380
  351   1HB   LEU  45          2HB       LEU  45  -3.238  -1.679 -10.265
  352   2HB   LEU  45          1HB       LEU  45  -2.600  -0.696  -8.950
  353    HG   LEU  45           HG       LEU  45  -2.335   0.268 -11.776
  354   1HD1  LEU  45          2HD1      LEU  45  -4.783  -0.456 -10.978
  355   2HD1  LEU  45          1HD1      LEU  45  -4.704   1.114 -10.174
  356   3HD1  LEU  45          3HD1      LEU  45  -4.513   1.008 -11.925
  357   1HD2  LEU  45          3HD2      LEU  45  -2.168   1.350  -9.024
  358   2HD2  LEU  45          2HD2      LEU  45  -1.269   1.810 -10.469
  359   3HD2  LEU  45          1HD2      LEU  45  -2.908   2.411 -10.220
  360    H    SER  46           H        SER  46   1.170  -0.837 -11.312
  361    HA   SER  46           HA       SER  46   2.300   0.632  -9.141
  362   1HB   SER  46          2HB       SER  46   3.135   1.069 -11.982
  363   2HB   SER  46          1HB       SER  46   4.129   0.980 -10.536
  364    HG   SER  46           HG       SER  46   4.223  -0.916 -11.866
  365    H    ILE  47           H        ILE  47   2.665   2.904  -8.965
  366    HA   ILE  47           HA       ILE  47   1.100   4.647 -10.783
  367    HB   ILE  47           HB       ILE  47  -0.315   5.491  -9.210
  368   1HG1  ILE  47          2HG1      ILE  47   1.684   4.938  -6.994
  369   2HG1  ILE  47          1HG1      ILE  47   1.594   6.459  -7.882
  370   1HG2  ILE  47          2HG2      ILE  47  -0.480   2.960  -9.113
  371   2HG2  ILE  47          1HG2      ILE  47   0.461   3.037  -7.624
  372   3HG2  ILE  47          3HG2      ILE  47  -1.120   3.813  -7.709
  373   1HD1  ILE  47          3HD1      ILE  47  -0.912   5.367  -6.662
  374   2HD1  ILE  47          2HD1      ILE  47   0.265   6.159  -5.614
  375   3HD1  ILE  47          1HD1      ILE  47  -0.451   7.043  -6.963
  376    H    ARG  48           H        ARG  48   2.626   5.980 -11.599
  377    HA   ARG  48           HA       ARG  48   5.076   6.575 -10.140
  378   1HB   ARG  48          2HB       ARG  48   4.522   6.511 -12.768
  379   2HB   ARG  48          1HB       ARG  48   4.265   8.233 -12.483
  380   1HG   ARG  48          2HG       ARG  48   6.738   6.838 -11.464
  381   2HG   ARG  48          1HG       ARG  48   6.659   7.463 -13.111
  382   1HD   ARG  48          2HD       ARG  48   5.777   9.299 -10.940
  383   2HD   ARG  48          1HD       ARG  48   7.505   8.961 -11.040
  384    HE   ARG  48           HE       ARG  48   5.903  10.394 -13.063
  385   1HH1  ARG  48          2HH1      ARG  48   7.787   8.367 -14.329
  386   2HH1  ARG  48          1HH1      ARG  48   9.201   9.335 -14.585
  387   1HH2  ARG  48          1HH2      ARG  48   8.180  11.865 -12.447
  388   2HH2  ARG  48          2HH2      ARG  48   9.423  11.315 -13.519
  389    H    ASP  49           H        ASP  49   5.491   8.376  -8.882
  390    HA   ASP  49           HA       ASP  49   3.637  10.679  -9.064
  391   1HB   ASP  49          2HB       ASP  49   2.518   9.356  -7.404
  392   2HB   ASP  49          1HB       ASP  49   4.034   9.004  -6.574
  393    H    TRP  50           H        TRP  50   5.715  11.588  -9.893
  394    HA   TRP  50           HA       TRP  50   8.054  11.802  -8.230
  395   1HB   TRP  50          2HB       TRP  50   8.400  12.307 -10.521
  396   2HB   TRP  50          1HB       TRP  50   6.988  13.355 -10.592
  397    HD1  TRP  50           HD1      TRP  50  10.665  13.428  -9.952
  398    HE1  TRP  50           HE1      TRP  50  11.387  15.807  -9.260
  399    HE3  TRP  50           HE3      TRP  50   6.111  15.503  -9.250
  400    HZ2  TRP  50           HZ2      TRP  50  10.154  18.297  -8.551
  401    HZ3  TRP  50           HZ3      TRP  50   5.879  17.882  -8.577
  402    HH2  TRP  50           HH2      TRP  50   7.898  19.282  -8.230
  403    H    ASP  51           H        ASP  51   8.769  13.947  -7.242
  404    HA   ASP  51           HA       ASP  51   6.521  15.649  -6.327
  405   1HB   ASP  51          2HB       ASP  51   7.496  13.566  -4.738
  406   2HB   ASP  51          1HB       ASP  51   8.293  15.007  -4.107
  407    H    ASP  52           H        ASP  52   7.275  17.681  -5.387
  408    HA   ASP  52           HA       ASP  52   9.789  18.580  -6.616
  409   1HB   ASP  52          2HB       ASP  52   9.063  20.787  -6.092
  410   2HB   ASP  52          1HB       ASP  52   7.597  19.916  -6.536
  411    H    MET  53           H        MET  53  10.100  16.664  -4.442
  412    HA   MET  53           HA       MET  53  11.992  18.174  -2.867
  413   1HB   MET  53          2HB       MET  53  10.904  17.390  -0.666
  414   2HB   MET  53          1HB       MET  53  10.164  18.764  -1.486
  415   1HG   MET  53          2HG       MET  53   8.231  17.593  -1.403
  416   2HG   MET  53          1HG       MET  53   8.924  16.564  -2.656
  417   1HE   MET  53          1HE       MET  53   9.483  14.632  -2.672
  418   2HE   MET  53          3HE       MET  53   9.810  13.449  -1.397
  419   3HE   MET  53          2HE       MET  53   8.150  13.811  -1.863
  420    H    LYS  54           H        LYS  54  12.086  15.856  -4.631
  421    HA   LYS  54           HA       LYS  54  13.789  14.184  -3.127
  422   1HB   LYS  54          2HB       LYS  54  12.475  12.223  -2.715
  423   2HB   LYS  54          1HB       LYS  54  11.555  13.579  -2.065
  424   1HG   LYS  54          2HG       LYS  54   9.865  12.656  -3.304
  425   2HG   LYS  54          1HG       LYS  54  10.625  13.564  -4.611
  426   1HD   LYS  54          2HD       LYS  54  10.506  11.426  -5.543
  427   2HD   LYS  54          1HD       LYS  54  12.125  11.411  -4.842
  428   1HE   LYS  54          2HE       LYS  54  11.085   9.369  -4.148
  429   2HE   LYS  54          1HE       LYS  54  11.063  10.430  -2.740
  430   1HZ   LYS  54          1HZ       LYS  54   8.798  10.258  -4.639
  431   2HZ   LYS  54          3HZ       LYS  54   8.921   9.255  -3.276
  432   3HZ   LYS  54          2HZ       LYS  54   8.811  10.939  -3.081
  433    H    GLY  55           H        GLY  55  11.654  14.535  -5.905
  434   1HA   GLY  55          2HA       GLY  55  12.793  14.263  -8.108
  435   2HA   GLY  55          1HA       GLY  55  13.535  12.828  -7.415
  436    H    ASP  56           H        ASP  56  12.447  11.851  -9.407
  437    HA   ASP  56           HA       ASP  56   9.539  11.607  -9.290
  438   1HB   ASP  56          2HB       ASP  56  11.265   9.777 -10.930
  439   2HB   ASP  56          1HB       ASP  56   9.723  10.522 -11.337
  440    H    HIS  57           H        HIS  57   8.563   9.334  -9.229
  441    HA   HIS  57           HA       HIS  57  10.080   7.221  -7.948
  442   1HB   HIS  57          2HB       HIS  57   9.364   9.053  -6.143
  443   2HB   HIS  57          1HB       HIS  57   7.842   8.176  -6.218
  444    HD1  HIS  57           HD1      HIS  57   8.462   7.393  -3.712
  445    HD2  HIS  57           HD2      HIS  57  10.930   5.912  -6.728
  446    HE1  HIS  57           HE1      HIS  57   9.734   5.446  -2.707
  447    H    VAL  58           H        VAL  58   8.121   5.718  -6.887
  448    HA   VAL  58           HA       VAL  58   5.719   5.720  -8.541
  449    HB   VAL  58           HB       VAL  58   7.387   4.819 -10.127
  450   1HG1  VAL  58          3HG1      VAL  58   8.012   3.142  -7.757
  451   2HG1  VAL  58          2HG1      VAL  58   8.095   2.357  -9.338
  452   3HG1  VAL  58          1HG1      VAL  58   9.085   3.783  -9.003
  453   1HG2  VAL  58          2HG2      VAL  58   5.396   2.819  -9.027
  454   2HG2  VAL  58          1HG2      VAL  58   5.159   3.935 -10.373
  455   3HG2  VAL  58          3HG2      VAL  58   6.285   2.584 -10.536
  456    H    LYS  59           H        LYS  59   4.277   3.935  -7.919
  457    HA   LYS  59           HA       LYS  59   5.035   2.532  -5.402
  458   1HB   LYS  59          2HB       LYS  59   3.107   4.681  -5.668
  459   2HB   LYS  59          1HB       LYS  59   2.303   3.193  -5.169
  460   1HG   LYS  59          2HG       LYS  59   3.872   2.931  -3.311
  461   2HG   LYS  59          1HG       LYS  59   4.770   4.354  -3.837
  462   1HD   LYS  59          2HD       LYS  59   2.754   5.746  -3.481
  463   2HD   LYS  59          1HD       LYS  59   1.874   4.320  -2.930
  464   1HE   LYS  59          2HE       LYS  59   3.221   4.102  -0.991
  465   2HE   LYS  59          1HE       LYS  59   4.467   5.170  -1.637
  466   1HZ   LYS  59          1HZ       LYS  59   2.768   6.971  -1.588
  467   2HZ   LYS  59          3HZ       LYS  59   1.744   5.921  -0.738
  468   3HZ   LYS  59          2HZ       LYS  59   3.226   6.396  -0.056
  469    H    HIS  60           H        HIS  60   2.622   1.206  -5.000
  470    HA   HIS  60           HA       HIS  60   1.688   0.129  -7.550
  471   1HB   HIS  60          2HB       HIS  60   2.956  -1.907  -5.769
  472   2HB   HIS  60          1HB       HIS  60   2.608  -2.003  -7.489
  473    HD1  HIS  60           HD1      HIS  60   4.345  -1.080  -9.122
  474    HD2  HIS  60           HD2      HIS  60   5.356  -0.417  -5.132
  475    HE1  HIS  60           HE1      HIS  60   6.741  -0.258  -9.118
  476    H    TYR  61           H        TYR  61  -0.171  -1.020  -7.376
  477    HA   TYR  61           HA       TYR  61  -1.275  -1.394  -4.618
  478   1HB   TYR  61          2HB       TYR  61  -2.653  -0.464  -7.150
  479   2HB   TYR  61          1HB       TYR  61  -3.546  -1.080  -5.766
  480    HD1  TYR  61           HD1      TYR  61  -2.556  -0.038  -3.421
  481    HD2  TYR  61           HD2      TYR  61  -2.517   1.840  -7.279
  482    HE1  TYR  61           HE1      TYR  61  -2.397   2.188  -2.335
  483    HE2  TYR  61           HE2      TYR  61  -2.361   4.064  -6.200
  484    HH   TYR  61           HH       TYR  61  -1.489   4.520  -3.050
  485    H    LYS  62           H        LYS  62  -0.763  -3.582  -4.477
  486    HA   LYS  62           HA       LYS  62  -0.810  -5.499  -6.505
  487   1HB   LYS  62          2HB       LYS  62   0.016  -5.815  -4.149
  488   2HB   LYS  62          1HB       LYS  62  -1.657  -6.008  -3.641
  489   1HG   LYS  62          2HG       LYS  62  -0.841  -7.661  -5.955
  490   2HG   LYS  62          1HG       LYS  62  -0.054  -8.066  -4.429
  491   1HD   LYS  62          2HD       LYS  62  -3.010  -7.604  -4.410
  492   2HD   LYS  62          1HD       LYS  62  -2.412  -9.122  -5.080
  493   1HE   LYS  62          2HE       LYS  62  -2.288  -9.879  -2.956
  494   2HE   LYS  62          1HE       LYS  62  -0.931  -8.775  -2.736
  495   1HZ   LYS  62          2HZ       LYS  62  -3.485  -7.480  -2.552
  496   2HZ   LYS  62          1HZ       LYS  62  -3.271  -8.685  -1.374
  497   3HZ   LYS  62          3HZ       LYS  62  -2.156  -7.413  -1.495
  498    H    ILE  63           H        ILE  63  -2.448  -5.939  -7.854
  499    HA   ILE  63           HA       ILE  63  -5.242  -5.523  -7.095
  500    HB   ILE  63           HB       ILE  63  -3.803  -6.427  -9.582
  501   1HG1  ILE  63          2HG1      ILE  63  -5.285  -4.547 -10.501
  502   2HG1  ILE  63          1HG1      ILE  63  -5.684  -4.184  -8.824
  503   1HG2  ILE  63          2HG2      ILE  63  -6.707  -6.833  -8.893
  504   2HG2  ILE  63          1HG2      ILE  63  -6.226  -6.526 -10.561
  505   3HG2  ILE  63          3HG2      ILE  63  -5.599  -7.936  -9.707
  506   1HD1  ILE  63          2HD1      ILE  63  -2.890  -4.448  -8.861
  507   2HD1  ILE  63          1HD1      ILE  63  -3.280  -3.540 -10.321
  508   3HD1  ILE  63          3HD1      ILE  63  -3.801  -2.942  -8.745
  509    H    ARG  64           H        ARG  64  -6.009  -7.018  -5.649
  510    HA   ARG  64           HA       ARG  64  -5.136  -9.792  -5.658
  511   1HB   ARG  64          2HB       ARG  64  -6.304  -8.179  -3.777
  512   2HB   ARG  64          1HB       ARG  64  -7.685  -9.135  -4.314
  513   1HG   ARG  64          2HG       ARG  64  -6.555 -10.264  -2.449
  514   2HG   ARG  64          1HG       ARG  64  -6.374 -11.209  -3.927
  515   1HD   ARG  64          2HD       ARG  64  -4.121 -10.623  -4.179
  516   2HD   ARG  64          1HD       ARG  64  -4.287  -9.175  -3.186
  517    HE   ARG  64           HE       ARG  64  -3.915 -10.510  -1.270
  518   1HH1  ARG  64          1HH2      ARG  64  -5.677 -12.568  -0.979
  519   2HH1  ARG  64          2HH2      ARG  64  -4.901 -14.007  -1.551
  520   1HH2  ARG  64          2HH1      ARG  64  -2.466 -12.301  -3.335
  521   2HH2  ARG  64          1HH1      ARG  64  -3.082 -13.856  -2.884
  522    H    LYS  65           H        LYS  65  -7.260 -11.411  -5.566
  523    HA   LYS  65           HA       LYS  65  -9.111 -10.698  -7.752
  524   1HB   LYS  65          2HB       LYS  65  -7.126 -11.686  -8.873
  525   2HB   LYS  65          1HB       LYS  65  -7.334 -13.147  -7.909
  526   1HG   LYS  65          2HG       LYS  65  -9.675 -13.327  -8.844
  527   2HG   LYS  65          1HG       LYS  65  -9.272 -12.006  -9.940
  528   1HD   LYS  65          2HD       LYS  65  -7.575 -13.289 -11.021
  529   2HD   LYS  65          1HD       LYS  65  -7.595 -14.515  -9.754
  530   1HE   LYS  65          2HE       LYS  65  -8.832 -15.485 -11.530
  531   2HE   LYS  65          1HE       LYS  65 -10.061 -14.892 -10.413
  532   1HZ   LYS  65          2HZ       LYS  65  -9.153 -12.987 -12.400
  533   2HZ   LYS  65          1HZ       LYS  65 -10.018 -14.314 -13.014
  534   3HZ   LYS  65          3HZ       LYS  65 -10.724 -13.313 -11.842
  535    H    LEU  66           H        LEU  66 -11.077 -11.558  -7.417
  536    HA   LEU  66           HA       LEU  66 -11.568 -13.182  -5.042
  537   1HB   LEU  66          2HB       LEU  66 -13.287 -12.069  -7.251
  538   2HB   LEU  66          1HB       LEU  66 -13.941 -13.259  -6.130
  539    HG   LEU  66           HG       LEU  66 -14.504 -11.171  -5.175
  540   1HD1  LEU  66          2HD1      LEU  66 -12.935 -12.895  -3.796
  541   2HD1  LEU  66          1HD1      LEU  66 -11.953 -11.432  -3.687
  542   3HD1  LEU  66          3HD1      LEU  66 -13.610 -11.429  -3.087
  543   1HD2  LEU  66          3HD2      LEU  66 -11.670 -10.346  -5.842
  544   2HD2  LEU  66          2HD2      LEU  66 -13.158  -9.713  -6.547
  545   3HD2  LEU  66          1HD2      LEU  66 -12.768  -9.377  -4.860
  546    H    ASP  67           H        ASP  67 -12.396 -15.329  -5.037
  547    HA   ASP  67           HA       ASP  67 -11.290 -17.030  -7.115
  548   1HB   ASP  67          2HB       ASP  67 -12.574 -17.353  -4.518
  549   2HB   ASP  67          1HB       ASP  67 -13.172 -18.528  -5.687
  550    H    ASN  68           H        ASN  68 -14.161 -15.264  -6.627
  551    HA   ASN  68           HA       ASN  68 -15.771 -16.898  -8.495
  552   1HB   ASN  68          2HB       ASN  68 -16.348 -14.253  -7.122
  553   2HB   ASN  68          1HB       ASN  68 -17.508 -15.174  -8.081
  554   1HD2  ASN  68          2HD2      ASN  68 -17.350 -16.034  -4.253
  555   2HD2  ASN  68          1HD2      ASN  68 -17.004 -14.534  -4.969
  556    H    GLY  69           H        GLY  69 -13.377 -14.588  -8.702
  557   1HA   GLY  69          2HA       GLY  69 -12.547 -13.777 -10.810
  558   2HA   GLY  69          1HA       GLY  69 -14.173 -13.937 -11.460
  559    H    GLY  70           H        GLY  70 -12.128 -11.959  -9.374
  560   1HA   GLY  70          2HA       GLY  70 -13.550  -9.576 -10.146
  561   2HA   GLY  70          1HA       GLY  70 -13.848 -10.011  -8.467
  562    H    TYR  71           H        TYR  71 -11.533  -8.747 -10.715
  563    HA   TYR  71           HA       TYR  71  -9.238  -8.846  -8.937
  564   1HB   TYR  71          2HB       TYR  71  -9.862  -7.337 -11.485
  565   2HB   TYR  71          1HB       TYR  71  -8.390  -7.013 -10.573
  566    HD1  TYR  71           HD1      TYR  71  -7.729  -9.749  -9.581
  567    HD2  TYR  71           HD2      TYR  71  -9.086  -8.407 -13.430
  568    HE1  TYR  71           HE1      TYR  71  -6.641 -11.706 -10.658
  569    HE2  TYR  71           HE2      TYR  71  -8.012 -10.356 -14.501
  570    HH   TYR  71           HH       TYR  71  -7.040 -13.043 -12.872
  571    H    TYR  72           H        TYR  72  -9.024  -7.534  -7.152
  572    HA   TYR  72           HA       TYR  72 -10.147  -4.775  -7.319
  573   1HB   TYR  72          2HB       TYR  72 -11.199  -4.984  -5.141
  574   2HB   TYR  72          1HB       TYR  72 -11.813  -6.254  -6.195
  575    HD1  TYR  72           HD1      TYR  72 -10.980  -8.592  -5.956
  576    HD2  TYR  72           HD2      TYR  72  -9.814  -5.494  -3.235
  577    HE1  TYR  72           HE1      TYR  72 -10.143 -10.299  -4.367
  578    HE2  TYR  72           HE2      TYR  72  -8.982  -7.173  -1.649
  579    HH   TYR  72           HH       TYR  72  -8.880 -10.609  -2.498
  580    H    ILE  73           H        ILE  73  -8.649  -3.316  -6.540
  581    HA   ILE  73           HA       ILE  73  -6.278  -4.327  -5.116
  582    HB   ILE  73           HB       ILE  73  -7.163  -1.573  -6.037
  583   1HG1  ILE  73          2HG1      ILE  73  -4.513  -2.259  -6.780
  584   2HG1  ILE  73          1HG1      ILE  73  -5.504  -3.687  -7.058
  585   1HG2  ILE  73          3HG2      ILE  73  -6.094  -1.459  -3.757
  586   2HG2  ILE  73          2HG2      ILE  73  -4.654  -2.192  -4.463
  587   3HG2  ILE  73          1HG2      ILE  73  -5.202  -0.610  -5.021
  588   1HD1  ILE  73          3HD1      ILE  73  -6.642  -1.075  -7.922
  589   2HD1  ILE  73          2HD1      ILE  73  -5.295  -1.706  -8.869
  590   3HD1  ILE  73          1HD1      ILE  73  -6.767  -2.660  -8.683
  591    H    THR  74           H        THR  74  -9.361  -2.949  -4.532
  592    HA   THR  74           HA       THR  74  -8.900  -3.112  -1.606
  593    HB   THR  74           HB       THR  74  -9.205  -0.873  -1.489
  594    HG1  THR  74           HG1      THR  74 -11.182  -0.695  -0.901
  595   1HG2  THR  74          1HG2      THR  74  -8.815  -0.783  -4.005
  596   2HG2  THR  74          3HG2      THR  74 -10.570  -0.810  -4.186
  597   3HG2  THR  74          2HG2      THR  74  -9.789   0.530  -3.343
  598    H    THR  75           H        THR  75 -10.565  -4.159  -0.571
  599    HA   THR  75           HA       THR  75 -12.209  -5.888  -2.114
  600    HB   THR  75           HB       THR  75 -13.302  -6.442   0.030
  601    HG1  THR  75           HG1      THR  75 -13.314  -4.270   0.828
  602   1HG2  THR  75          1HG2      THR  75 -10.528  -6.530  -0.637
  603   2HG2  THR  75          3HG2      THR  75 -10.663  -6.285   1.108
  604   3HG2  THR  75          2HG2      THR  75 -11.450  -7.671   0.350
  605    H    ARG  76           H        ARG  76 -12.657  -2.599  -1.609
  606    HA   ARG  76           HA       ARG  76 -15.537  -2.551  -1.406
  607   1HB   ARG  76          2HB       ARG  76 -14.071  -0.636  -0.758
  608   2HB   ARG  76          1HB       ARG  76 -13.672  -0.407  -2.461
  609   1HG   ARG  76          2HG       ARG  76 -15.748   0.441  -2.972
  610   2HG   ARG  76          1HG       ARG  76 -16.566  -0.558  -1.771
  611   1HD   ARG  76          2HD       ARG  76 -15.048   1.024  -0.153
  612   2HD   ARG  76          1HD       ARG  76 -15.360   2.133  -1.488
  613    HE   ARG  76           HE       ARG  76 -17.280   1.367   0.484
  614   1HH1  ARG  76          1HH2      ARG  76 -18.851  -0.037  -1.333
  615   2HH1  ARG  76          2HH2      ARG  76 -19.646   1.152  -2.311
  616   1HH2  ARG  76          2HH1      ARG  76 -17.457   3.703  -1.459
  617   2HH2  ARG  76          1HH1      ARG  76 -18.857   3.269  -2.382
  618    H    ALA  77           H        ALA  77 -13.359  -3.191  -4.023
  619    HA   ALA  77           HA       ALA  77 -15.653  -3.438  -5.835
  620   1HB   ALA  77          2HB       ALA  77 -13.748  -1.155  -6.011
  621   2HB   ALA  77          1HB       ALA  77 -14.265  -1.901  -7.523
  622   3HB   ALA  77          3HB       ALA  77 -15.462  -1.224  -6.418
  623    H    GLN  78           H        GLN  78 -15.280  -5.122  -7.161
  624    HA   GLN  78           HA       GLN  78 -12.489  -5.821  -7.914
  625   1HB   GLN  78          2HB       GLN  78 -13.720  -8.232  -7.977
  626   2HB   GLN  78          1HB       GLN  78 -12.841  -7.652  -6.573
  627   1HG   GLN  78          2HG       GLN  78 -15.774  -7.069  -6.963
  628   2HG   GLN  78          1HG       GLN  78 -15.216  -8.536  -6.160
  629   1HE2  GLN  78          2HE2      GLN  78 -13.548  -6.397  -3.568
  630   2HE2  GLN  78          1HE2      GLN  78 -12.997  -7.523  -4.712
  631    H    PHE  79           H        PHE  79 -12.398  -6.994 -10.010
  632    HA   PHE  79           HA       PHE  79 -14.864  -6.877 -11.637
  633   1HB   PHE  79          2HB       PHE  79 -12.325  -5.373 -12.211
  634   2HB   PHE  79          1HB       PHE  79 -13.515  -5.743 -13.470
  635    HD1  PHE  79           HD1      PHE  79 -15.991  -5.249 -12.887
  636    HD2  PHE  79           HD2      PHE  79 -12.650  -3.509 -10.845
  637    HE1  PHE  79           HE1      PHE  79 -17.462  -3.447 -12.017
  638    HE2  PHE  79           HE2      PHE  79 -14.109  -1.716  -9.973
  639    HZ   PHE  79           HZ       PHE  79 -16.520  -1.675 -10.558
  640    H    GLU  80           H        GLU  80 -15.072  -8.782 -12.495
  641    HA   GLU  80           HA       GLU  80 -13.596 -10.998 -12.556
  642   1HB   GLU  80          2HB       GLU  80 -14.454 -11.287 -15.056
  643   2HB   GLU  80          1HB       GLU  80 -15.574 -11.289 -13.694
  644   1HG   GLU  80          2HG       GLU  80 -14.958  -8.591 -14.666
  645   2HG   GLU  80          1HG       GLU  80 -15.725  -9.604 -15.886
  646    H    THR  81           H        THR  81 -12.865  -8.281 -14.778
  647    HA   THR  81           HA       THR  81 -10.300  -9.719 -15.322
  648    HB   THR  81           HB       THR  81 -11.242  -9.991 -17.411
  649    HG1  THR  81           HG1      THR  81 -10.790  -7.425 -18.155
  650   1HG2  THR  81          3HG2      THR  81 -13.330  -8.678 -16.545
  651   2HG2  THR  81          2HG2      THR  81 -12.575  -7.321 -17.376
  652   3HG2  THR  81          1HG2      THR  81 -13.024  -8.765 -18.278
  653    H    LEU  82           H        LEU  82  -8.733  -8.064 -16.437
  654    HA   LEU  82           HA       LEU  82  -8.473  -5.832 -14.557
  655   1HB   LEU  82          2HB       LEU  82  -6.714  -6.598 -16.906
  656   2HB   LEU  82          1HB       LEU  82  -6.293  -5.486 -15.601
  657    HG   LEU  82           HG       LEU  82  -7.229  -7.987 -14.501
  658   1HD1  LEU  82          3HD1      LEU  82  -5.939  -8.369 -16.940
  659   2HD1  LEU  82          2HD1      LEU  82  -4.666  -8.603 -15.742
  660   3HD1  LEU  82          1HD1      LEU  82  -6.138  -9.574 -15.666
  661   1HD2  LEU  82          3HD2      LEU  82  -5.663  -6.092 -13.607
  662   2HD2  LEU  82          2HD2      LEU  82  -5.332  -7.764 -13.152
  663   3HD2  LEU  82          1HD2      LEU  82  -4.392  -6.995 -14.431
  664    H    GLN  83           H        GLN  83  -9.337  -6.361 -17.909
  665    HA   GLN  83           HA       GLN  83  -9.259  -3.559 -18.655
  666   1HB   GLN  83          2HB       GLN  83  -9.424  -5.840 -20.101
  667   2HB   GLN  83          1HB       GLN  83 -11.133  -5.410 -20.045
  668   1HG   GLN  83          2HG       GLN  83  -9.948  -2.986 -20.596
  669   2HG   GLN  83          1HG       GLN  83  -8.919  -4.109 -21.484
  670   1HE2  GLN  83          2HE2      GLN  83 -11.553  -5.139 -23.710
  671   2HE2  GLN  83          1HE2      GLN  83 -10.114  -5.672 -22.982
  672    H    GLN  84           H        GLN  84 -11.554  -5.761 -17.194
  673    HA   GLN  84           HA       GLN  84 -13.855  -4.006 -17.432
  674   1HB   GLN  84          2HB       GLN  84 -13.240  -6.533 -15.948
  675   2HB   GLN  84          1HB       GLN  84 -14.655  -5.594 -15.500
  676   1HG   GLN  84          2HG       GLN  84 -14.914  -7.461 -17.314
  677   2HG   GLN  84          1HG       GLN  84 -15.695  -5.912 -17.564
  678   1HE2  GLN  84          2HE2      GLN  84 -13.415  -7.151 -20.480
  679   2HE2  GLN  84          1HE2      GLN  84 -14.309  -8.105 -19.398
  680    H    LEU  85           H        LEU  85 -11.301  -4.532 -15.079
  681    HA   LEU  85           HA       LEU  85 -12.578  -2.866 -13.050
  682   1HB   LEU  85          2HB       LEU  85 -10.905  -3.582 -11.692
  683   2HB   LEU  85          1HB       LEU  85 -10.543  -4.717 -12.985
  684    HG   LEU  85           HG       LEU  85  -9.188  -2.456 -13.798
  685   1HD1  LEU  85          1HD1      LEU  85  -9.790  -2.106 -11.049
  686   2HD1  LEU  85          3HD1      LEU  85  -8.072  -2.495 -11.167
  687   3HD1  LEU  85          2HD1      LEU  85  -8.730  -1.123 -12.061
  688   1HD2  LEU  85          2HD2      LEU  85  -8.609  -5.075 -12.707
  689   2HD2  LEU  85          1HD2      LEU  85  -7.795  -4.186 -13.995
  690   3HD2  LEU  85          3HD2      LEU  85  -7.352  -3.901 -12.310
  691    H    VAL  86           H        VAL  86 -10.091  -2.367 -15.538
  692    HA   VAL  86           HA       VAL  86  -9.560   0.321 -14.802
  693    HB   VAL  86           HB       VAL  86  -8.765   0.616 -17.117
  694   1HG1  VAL  86          2HG1      VAL  86  -7.886  -1.363 -15.292
  695   2HG1  VAL  86          1HG1      VAL  86  -7.809  -2.098 -16.893
  696   3HG1  VAL  86          3HG1      VAL  86  -6.944  -0.595 -16.570
  697   1HG2  VAL  86          3HG2      VAL  86 -10.787  -0.696 -18.007
  698   2HG2  VAL  86          2HG2      VAL  86  -9.246  -0.954 -18.831
  699   3HG2  VAL  86          1HG2      VAL  86  -9.839  -2.142 -17.671
  700    H    GLN  87           H        GLN  87 -12.129  -1.286 -16.423
  701    HA   GLN  87           HA       GLN  87 -13.397   0.908 -17.701
  702   1HB   GLN  87          2HB       GLN  87 -13.913  -1.551 -17.992
  703   2HB   GLN  87          1HB       GLN  87 -14.776  -1.468 -16.464
  704   1HG   GLN  87          2HG       GLN  87 -16.433  -0.091 -17.301
  705   2HG   GLN  87          1HG       GLN  87 -15.405   0.548 -18.582
  706   1HE2  GLN  87          2HE2      GLN  87 -15.810  -2.562 -20.545
  707   2HE2  GLN  87          1HE2      GLN  87 -14.525  -1.609 -19.977
  708    H    HIS  88           H        HIS  88 -13.905  -0.518 -14.483
  709    HA   HIS  88           HA       HIS  88 -15.892   1.482 -13.800
  710   1HB   HIS  88          2HB       HIS  88 -15.676  -0.960 -12.936
  711   2HB   HIS  88          1HB       HIS  88 -14.504  -0.282 -11.811
  712    HD1  HIS  88           HD1      HIS  88 -15.389   1.163  -9.895
  713    HD2  HIS  88           HD2      HIS  88 -18.367   0.062 -12.597
  714    HE1  HIS  88           HE1      HIS  88 -17.594   1.827  -8.841
  715    H    TYR  89           H        TYR  89 -12.572   0.778 -12.852
  716    HA   TYR  89           HA       TYR  89 -12.341   2.969 -11.038
  717   1HB   TYR  89          2HB       TYR  89 -10.323   1.287 -12.502
  718   2HB   TYR  89          1HB       TYR  89  -9.847   2.561 -11.387
  719    HD1  TYR  89           HD1      TYR  89 -11.998  -0.479 -11.624
  720    HD2  TYR  89           HD2      TYR  89  -9.708   2.102  -9.080
  721    HE1  TYR  89           HE1      TYR  89 -12.330  -2.046  -9.762
  722    HE2  TYR  89           HE2      TYR  89 -10.045   0.530  -7.189
  723    HH   TYR  89           HH       TYR  89 -10.537  -2.020  -6.989
  724    H    SER  90           H        SER  90 -12.534   2.886 -14.404
  725    HA   SER  90           HA       SER  90 -10.778   5.073 -15.038
  726   1HB   SER  90          2HB       SER  90 -12.601   3.333 -16.456
  727   2HB   SER  90          1HB       SER  90 -12.856   5.009 -16.938
  728    HG   SER  90           HG       SER  90 -11.201   3.879 -18.134
  729    H    GLU  91           H        GLU  91 -14.072   4.708 -14.012
  730    HA   GLU  91           HA       GLU  91 -14.633   7.595 -14.365
  731   1HB   GLU  91          2HB       GLU  91 -16.907   6.972 -13.595
  732   2HB   GLU  91          1HB       GLU  91 -16.395   5.987 -14.965
  733   1HG   GLU  91          2HG       GLU  91 -16.310   4.077 -13.723
  734   2HG   GLU  91          1HG       GLU  91 -15.668   4.911 -12.308
  735    H    ARG  92           H        ARG  92 -13.682   5.286 -11.978
  736    HA   ARG  92           HA       ARG  92 -13.640   7.481  -9.961
  737   1HB   ARG  92          2HB       ARG  92 -14.664   4.751  -9.190
  738   2HB   ARG  92          1HB       ARG  92 -14.795   6.265  -8.296
  739   1HG   ARG  92          2HG       ARG  92 -16.099   7.022 -10.498
  740   2HG   ARG  92          1HG       ARG  92 -16.395   5.289 -10.625
  741   1HD   ARG  92          2HD       ARG  92 -18.145   5.727  -9.232
  742   2HD   ARG  92          1HD       ARG  92 -16.909   5.713  -7.975
  743    HE   ARG  92           HE       ARG  92 -17.527   8.290  -9.322
  744   1HH1  ARG  92          1HH2      ARG  92 -15.902   8.749  -7.087
  745   2HH1  ARG  92          2HH2      ARG  92 -16.979   8.902  -5.739
  746   1HH2  ARG  92          2HH1      ARG  92 -19.649   7.396  -7.361
  747   2HH2  ARG  92          1HH1      ARG  92 -19.101   8.137  -5.894
  748    H    ALA  93           H        ALA  93 -12.181   7.000  -8.152
  749    HA   ALA  93           HA       ALA  93  -9.885   5.394  -9.041
  750   1HB   ALA  93          3HB       ALA  93  -9.917   7.718  -7.761
  751   2HB   ALA  93          2HB       ALA  93 -10.018   6.681  -6.339
  752   3HB   ALA  93          1HB       ALA  93  -8.647   6.538  -7.440
  753    H    ALA  94           H        ALA  94 -12.066   5.490  -6.238
  754    HA   ALA  94           HA       ALA  94 -13.054   3.576  -5.189
  755   1HB   ALA  94          2HB       ALA  94 -11.897   2.226  -7.167
  756   2HB   ALA  94          1HB       ALA  94 -10.741   1.820  -5.898
  757   3HB   ALA  94          3HB       ALA  94 -12.445   1.409  -5.703
  758    H    GLY  95           H        GLY  95 -10.052   5.060  -4.867
  759   1HA   GLY  95          2HA       GLY  95  -9.746   5.492  -2.307
  760   2HA   GLY  95          1HA       GLY  95  -9.562   3.742  -2.239
  761    H    LEU  96           H        LEU  96  -8.164   3.900  -4.968
  762    HA   LEU  96           HA       LEU  96  -5.487   4.183  -3.862
  763   1HB   LEU  96          2HB       LEU  96  -4.708   3.291  -5.904
  764   2HB   LEU  96          1HB       LEU  96  -6.245   2.479  -5.627
  765    HG   LEU  96           HG       LEU  96  -5.768   4.854  -7.444
  766   1HD1  LEU  96          1HD1      LEU  96  -6.130   1.907  -7.818
  767   2HD1  LEU  96          3HD1      LEU  96  -6.710   3.007  -9.069
  768   3HD1  LEU  96          2HD1      LEU  96  -5.002   2.999  -8.625
  769   1HD2  LEU  96          1HD2      LEU  96  -8.284   3.346  -6.733
  770   2HD2  LEU  96          3HD2      LEU  96  -7.973   5.066  -6.499
  771   3HD2  LEU  96          2HD2      LEU  96  -8.152   4.416  -8.129
  772    H    SER  97           H        SER  97  -3.828   5.437  -5.245
  773    HA   SER  97           HA       SER  97  -4.062   8.143  -4.967
  774   1HB   SER  97          2HB       SER  97  -2.479   6.399  -6.718
  775   2HB   SER  97          1HB       SER  97  -2.692   8.029  -7.356
  776    HG   SER  97           HG       SER  97  -2.086   7.787  -4.658
  777    H    SER  98           H        SER  98  -5.000   6.405  -7.941
  778    HA   SER  98           HA       SER  98  -7.225   8.223  -8.375
  779   1HB   SER  98          2HB       SER  98  -5.098   8.392 -10.496
  780   2HB   SER  98          1HB       SER  98  -6.444   9.488 -10.187
  781    HG   SER  98           HG       SER  98  -5.303  10.496  -8.742
  782    H    ARG  99           H        ARG  99  -8.050   7.845 -10.769
  783    HA   ARG  99           HA       ARG  99  -8.772   5.137 -11.035
  784   1HB   ARG  99          2HB       ARG  99  -9.344   5.802 -13.438
  785   2HB   ARG  99          1HB       ARG  99 -10.087   6.772 -12.170
  786   1HG   ARG  99          2HG       ARG  99  -7.691   8.077 -12.582
  787   2HG   ARG  99          1HG       ARG  99  -8.120   7.548 -14.209
  788   1HD   ARG  99          2HD       ARG  99 -10.489   8.462 -13.638
  789   2HD   ARG  99          1HD       ARG  99  -9.673   9.329 -12.336
  790    HE   ARG  99           HE       ARG  99  -8.511   9.657 -15.030
  791   1HH1  ARG  99          2HH1      ARG  99  -8.147  11.541 -12.683
  792   2HH1  ARG  99          1HH1      ARG  99  -9.168  12.863 -13.142
  793   1HH2  ARG  99          1HH2      ARG  99 -10.874  11.053 -15.559
  794   2HH2  ARG  99          2HH2      ARG  99 -10.712  12.586 -14.770
  795    H    LEU 100           H        LEU 100  -8.246   4.352 -13.653
  796    HA   LEU 100           HA       LEU 100  -5.713   3.081 -13.388
  797   1HB   LEU 100          2HB       LEU 100  -6.838   3.539 -16.125
  798   2HB   LEU 100          1HB       LEU 100  -6.088   2.098 -15.458
  799    HG   LEU 100           HG       LEU 100  -8.275   1.400 -15.498
  800   1HD1  LEU 100          3HD1      LEU 100  -7.396   2.114 -12.954
  801   2HD1  LEU 100          2HD1      LEU 100  -9.036   2.758 -13.046
  802   3HD1  LEU 100          1HD1      LEU 100  -8.742   1.040 -13.331
  803   1HD2  LEU 100          3HD2      LEU 100  -8.773   4.247 -15.676
  804   2HD2  LEU 100          2HD2      LEU 100  -9.735   2.902 -16.291
  805   3HD2  LEU 100          1HD2      LEU 100  -9.948   3.454 -14.631
  806    H    VAL 101           H        VAL 101  -4.691   3.511 -16.089
  807    HA   VAL 101           HA       VAL 101  -3.083   5.917 -15.530
  808    HB   VAL 101           HB       VAL 101  -2.926   3.781 -17.677
  809   1HG1  VAL 101          1HG1      VAL 101  -2.026   6.057 -18.354
  810   2HG1  VAL 101          3HG1      VAL 101  -0.866   5.903 -17.030
  811   3HG1  VAL 101          2HG1      VAL 101  -0.845   4.744 -18.365
  812   1HG2  VAL 101          1HG2      VAL 101  -1.405   4.335 -15.124
  813   2HG2  VAL 101          3HG2      VAL 101  -2.334   2.893 -15.532
  814   3HG2  VAL 101          2HG2      VAL 101  -0.818   3.233 -16.367
  815    H    VAL 102           H        VAL 102  -3.456   7.852 -16.510
  816    HA   VAL 102           HA       VAL 102  -5.702   8.533 -17.970
  817    HB   VAL 102           HB       VAL 102  -4.193  10.249 -17.162
  818   1HG1  VAL 102          1HG1      VAL 102  -2.249   8.932 -19.063
  819   2HG1  VAL 102          3HG1      VAL 102  -2.001  10.574 -18.469
  820   3HG1  VAL 102          2HG1      VAL 102  -2.055   9.225 -17.334
  821   1HG2  VAL 102          2HG2      VAL 102  -4.530  10.139 -20.161
  822   2HG2  VAL 102          1HG2      VAL 102  -5.470  11.061 -18.989
  823   3HG2  VAL 102          3HG2      VAL 102  -3.815  11.538 -19.361
  824    HA   PRO 103           HA       PRO 103  -5.143   6.549 -21.871
  825   1HB   PRO 103          2HB       PRO 103  -7.104   7.917 -23.228
  826   2HB   PRO 103          1HB       PRO 103  -7.435   6.612 -22.080
  827   1HG   PRO 103          2HG       PRO 103  -7.781   9.559 -21.739
  828   2HG   PRO 103          1HG       PRO 103  -8.645   8.233 -20.947
  829   1HD   PRO 103          2HD       PRO 103  -6.555   9.775 -19.811
  830   2HD   PRO 103          1HD       PRO 103  -7.198   8.253 -19.163
  831    H    SER 104           H        SER 104  -5.819  10.059 -22.233
  832    HA   SER 104           HA       SER 104  -3.933  10.197 -24.489
  833   1HB   SER 104          2HB       SER 104  -4.608  12.727 -24.258
  834   2HB   SER 104          1HB       SER 104  -5.783  11.570 -24.886
  835    HG   SER 104           HG       SER 104  -6.843  11.583 -23.005
  836    H    HIS 105           H        HIS 105  -2.376   9.436 -22.494
  837    HA   HIS 105           HA       HIS 105  -1.399  11.313 -20.636
  838   1HB   HIS 105          2HB       HIS 105   0.788  10.051 -20.854
  839   2HB   HIS 105          1HB       HIS 105  -0.620   9.035 -20.542
  840    HD1  HIS 105           HD1      HIS 105  -0.061   6.936 -21.823
  841    HD2  HIS 105           HD2      HIS 105   0.502  10.371 -24.119
  842    HE1  HIS 105           HE1      HIS 105   0.450   6.150 -24.176
  843    H    LYS 106           HN       LYS 106   1.193  11.955 -21.079
  844    HA   LYS 106           HA       LYS 106   1.948  12.910 -23.607
  845   1HB   LYS 106          2HB       LYS 106  -0.254  14.309 -22.884
  846   2HB   LYS 106          1HB       LYS 106   0.994  15.302 -22.132
  847   1HG   LYS 106          2HG       LYS 106   2.211  15.215 -24.383
  848   2HG   LYS 106          1HG       LYS 106   0.718  14.556 -25.051
  849   1HD   LYS 106          2HD       LYS 106  -0.509  16.527 -24.518
  850   2HD   LYS 106          1HD       LYS 106   0.768  17.126 -23.459
  851   1HE   LYS 106          2HE       LYS 106   2.232  17.529 -25.330
  852   2HE   LYS 106          1HE       LYS 106   1.141  16.692 -26.434
  853   1HZ   LYS 106          1HZ       LYS 106  -0.555  18.420 -25.765
  854   2HZ   LYS 106          3HZ       LYS 106   0.728  19.286 -25.072
  855   3HZ   LYS 106          2HZ       LYS 106   0.727  18.961 -26.740
  856   1H    GLU 201          3HT       GLU 201  10.350  -5.419   2.120
  857   2H    GLU 201          2HT       GLU 201  11.061  -6.609   3.101
  858   3H    GLU 201          1HT       GLU 201  11.152  -6.734   1.410
  859    HA   GLU 201           HA       GLU 201   9.467  -8.201   1.824
  860   1HB   GLU 201          2HB       GLU 201   7.708  -7.651   3.588
  861   2HB   GLU 201          1HB       GLU 201   9.331  -7.963   4.206
  862   1HG   GLU 201          2HG       GLU 201   9.028  -5.165   3.518
  863   2HG   GLU 201          1HG       GLU 201   7.772  -5.663   4.651
  864    HA   PRO 202           HA       PRO 202   6.725  -6.076  -0.869
  865   1HB   PRO 202          2HB       PRO 202   4.719  -7.954  -0.975
  866   2HB   PRO 202          1HB       PRO 202   6.275  -8.134  -1.806
  867   1HG   PRO 202          2HG       PRO 202   5.296  -9.494   0.662
  868   2HG   PRO 202          1HG       PRO 202   6.488 -10.046  -0.526
  869   1HD   PRO 202          2HD       PRO 202   7.070  -8.945   2.016
  870   2HD   PRO 202          1HD       PRO 202   8.232  -9.194   0.694
  871    H    GLN 203           H        GLN 203   5.539  -4.326  -0.186
  872    HA   GLN 203           HA       GLN 203   3.248  -4.828   1.655
  873   1HB   GLN 203          2HB       GLN 203   3.793  -2.702   2.843
  874   2HB   GLN 203          1HB       GLN 203   5.046  -3.927   3.045
  875   1HG   GLN 203          2HG       GLN 203   6.076  -2.794   0.896
  876   2HG   GLN 203          1HG       GLN 203   5.102  -1.415   1.408
  877   1HE2  GLN 203          2HE2      GLN 203   6.914  -1.361   4.666
  878   2HE2  GLN 203          1HE2      GLN 203   5.294  -1.530   4.188
  879   1HN   PTR 204          1HN       PTR 204   1.585  -4.405   0.246
  880    HA   PTR 204           HA       PTR 204   1.817  -2.091  -1.595
  881   1HB   PTR 204          1HB       PTR 204  -0.402  -2.996  -2.460
  882    HD1  PTR 204           HD1      PTR 204   1.142  -2.636  -4.350
  883    HD2  PTR 204           HD2      PTR 204   1.527  -6.032  -1.747
  884    HE1  PTR 204           HE1      PTR 204   2.645  -3.729  -5.994
  885    HE2  PTR 204           HE2      PTR 204   3.033  -7.120  -3.388
  886    H    GLU 205           H        GLU 205   0.810  -0.183  -1.154
  887    HA   GLU 205           HA       GLU 205  -0.254   0.553   1.291
  888   1HB   GLU 205          2HB       GLU 205  -0.633   1.554  -1.493
  889   2HB   GLU 205          1HB       GLU 205  -1.753   2.147  -0.265
  890   1HG   GLU 205          2HG       GLU 205   1.275   2.268  -0.118
  891   2HG   GLU 205          1HG       GLU 205   0.197   3.632  -0.416
  892    H    GLU 206           H        GLU 206  -2.411   0.723   2.141
  893    HA   GLU 206           HA       GLU 206  -4.342  -1.177   0.870
  894   1HB   GLU 206          2HB       GLU 206  -3.951  -0.514   3.806
  895   2HB   GLU 206          1HB       GLU 206  -5.203  -1.581   3.167
  896   1HG   GLU 206          2HG       GLU 206  -2.777  -2.475   2.033
  897   2HG   GLU 206          1HG       GLU 206  -2.436  -2.182   3.739
  898    H    ILE 207           H        ILE 207  -6.591  -0.570   0.981
  899    HA   ILE 207           HA       ILE 207  -6.986   2.362   1.429
  900    HB   ILE 207           HB       ILE 207  -8.300   0.448  -0.514
  901   1HG1  ILE 207          2HG1      ILE 207  -7.319   3.056  -1.430
  902   2HG1  ILE 207          1HG1      ILE 207  -6.048   2.055  -0.727
  903   1HG2  ILE 207          1HG2      ILE 207  -9.958   1.977   0.604
  904   2HG2  ILE 207          3HG2      ILE 207  -9.024   3.347   0.003
  905   3HG2  ILE 207          2HG2      ILE 207  -9.803   2.245  -1.133
  906   1HD1  ILE 207          1HD1      ILE 207  -7.607   0.322  -2.324
  907   2HD1  ILE 207          3HD1      ILE 207  -7.357   1.779  -3.287
  908   3HD1  ILE 207          2HD1      ILE 207  -5.971   0.893  -2.653
  909    HA   PRO 208           HA       PRO 208  -9.595   0.348   4.574
  910   1HB   PRO 208          2HB       PRO 208  -9.118   2.278   6.473
  911   2HB   PRO 208          1HB       PRO 208  -8.070   0.871   6.222
  912   1HG   PRO 208          2HG       PRO 208  -7.608   3.716   5.454
  913   2HG   PRO 208          1HG       PRO 208  -6.427   2.441   5.805
  914   1HD   PRO 208          2HD       PRO 208  -7.174   3.346   3.227
  915   2HD   PRO 208          1HD       PRO 208  -6.255   1.869   3.592
  916    H    ILE 209           H        ILE 209 -11.659   1.093   5.436
  917    HA   ILE 209           HA       ILE 209 -12.617   3.778   5.158
  918    HB   ILE 209           HB       ILE 209 -12.445   3.190   2.735
  919   1HG1  ILE 209          2HG1      ILE 209 -15.369   3.237   3.119
  920   2HG1  ILE 209          1HG1      ILE 209 -14.500   4.448   4.061
  921   1HG2  ILE 209          3HG2      ILE 209 -14.456   1.062   3.530
  922   2HG2  ILE 209          2HG2      ILE 209 -14.076   1.506   1.865
  923   3HG2  ILE 209          1HG2      ILE 209 -12.834   0.788   2.892
  924   1HD1  ILE 209          2HD1      ILE 209 -13.957   4.023   1.120
  925   2HD1  ILE 209          1HD1      ILE 209 -15.207   5.130   1.688
  926   3HD1  ILE 209          3HD1      ILE 209 -13.519   5.409   2.120
  927    H    TYR 210           H        TYR 210 -12.687   1.431   6.965
  928    HA   TYR 210           HA       TYR 210 -15.331   0.303   6.977
  929   1HB   TYR 210          2HB       TYR 210 -13.730   0.668   9.492
  930   2HB   TYR 210          1HB       TYR 210 -14.707  -0.706   8.982
  931    HD1  TYR 210           HD1      TYR 210 -13.868  -1.622   6.511
  932    HD2  TYR 210           HD2      TYR 210 -11.444   0.251   9.522
  933    HE1  TYR 210           HE1      TYR 210 -11.851  -2.713   5.566
  934    HE2  TYR 210           HE2      TYR 210  -9.427  -0.840   8.577
  935    HH   TYR 210           HH       TYR 210  -8.641  -1.866   6.622
  936    H    LEU 211           HN       LEU 211 -16.710   0.709   9.116
  937    HA   LEU 211           HA       LEU 211 -16.889   3.664   9.539
  938   1HB   LEU 211          2HB       LEU 211 -18.692   2.393   8.045
  939   2HB   LEU 211          1HB       LEU 211 -19.359   1.981   9.626
  940    HG   LEU 211           HG       LEU 211 -19.235   4.448  10.205
  941   1HD1  LEU 211          2HD1      LEU 211 -18.341   4.480   7.345
  942   2HD1  LEU 211          1HD1      LEU 211 -19.309   5.826   7.944
  943   3HD1  LEU 211          3HD1      LEU 211 -17.765   5.442   8.706
  944   1HD2  LEU 211          1HD2      LEU 211 -21.204   3.014   8.997
  945   2HD2  LEU 211          3HD2      LEU 211 -21.388   4.701   9.480
  946   3HD2  LEU 211          2HD2      LEU 211 -20.979   4.301   7.811
   
  No H/Q in entry =         946