*HEADER    CHLORIDE CHANNEL                        26-APR-99   1CKW              
*TITLE     CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR:                  
*TITLE    2 SOLUTION STRUCTURES OF PEPTIDES BASED ON THE PHE508 REGION,          
*TITLE    3 THE MOST COMMON SITE OF DISEASE-CAUSING DELTA-F508 MUTATION          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE                  
*COMPND   3 REGULATOR (CFTR);                                                    
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 FRAGMENT: F508 MUTATION REGION;                                      
*COMPND   6 SYNONYM: P25;                                                        
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 OTHER_DETAILS: P25 PEPTIDE IN TRIFLUROETHANOL                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE PEPTIDE WAS CHEMICALLY SYNTHESIZED. THE           
*SOURCE   4 SEQUENCE IS BASED ON THE PHE508 REGION OF CF TRANSMEMBRANE           
*SOURCE   5 REGULATOR NUCLEOTIDE BINDING DOMAIN 1.                               
*KEYWDS    P25_TFE, CYSTIC FIBROSIS, PEPTIDES, NMR                               
*EXPDTA    NMR, 13 STRUCTURES                                                    
*AUTHOR    M.A.MASSIAH, Y.H.KO, P.L.PEDERSEN, A.S.MILDVAN                        
*REVDAT   1   04-MAY-99 1CKW    0                                                
set message=off echo=off end
!cf_p25peptide in TFE  
! 43% TFE (deuterated), 57%H2O, pH=4.0
!       Strong=1.8-2.8, Medium=1.8-3.2, weak=1.8-5.0, 
!               1.0 added for methyls, 2.1A for aromatic.
!......................................................................!
!                      Cystic Fibrosis P25peptide                      !
!......................................................................!
!                               HELIX 
!.............................(NH-NHi+1)........................
assign (resid 3 and name hn   ) (resid 4 and name hn   ) 1.8 0 3.2  {}
assign (resid 4 and name hn   ) (resid 5 and name hn   ) 1.8 0 1.0  {}
assign (resid 5 and name hn   ) (resid 6 and name hn   ) 1.8 0 1.0  {}
assign (resid 6 and name hn   ) (resid 7 and name hn   ) 1.8 0 1.0  {}
assign (resid 7 and name hn   ) (resid 8 and name hn   ) 1.8 0 1.0  {}
assign (resid 8 and name hn   ) (resid 9 and name hn   ) 1.8 0 1.0  {}
assign (resid 9 and name hn   ) (resid 10 and name hn  ) 1.8 0 1.0  {}
assign (resid 10 and name hn  ) (resid 11 and name hn  ) 1.8 0 1.0  {}
assign (resid 11 and name hn  ) (resid 12 and name hn  ) 1.8 0 1.0  {}
assign (resid 12 and name hn  ) (resid 13 and name hn  ) 1.8 0 1.0  {}
assign (resid 13 and name hn  ) (resid 14 and name hn  ) 1.8 0 1.0  {}
assign (resid 14 and name hn  ) (resid 15 and name hn  ) 1.8 0 1.0  {}
assign (resid 15 and name hn  ) (resid 16 and name hn  ) 1.8 0 1.0  {}
assign (resid 16 and name hn  ) (resid 17 and name hn  ) 1.8 0 1.0  {}
assign (resid 17 and name hn  ) (resid 18 and name hn  ) 1.8 0 1.0  {}
assign (resid 18 and name hn  ) (resid 19 and name hn  ) 1.8 0 1.0  {}
assign (resid 19 and name hn  ) (resid 20 and name hn  ) 1.8 0 1.0  {}
assign (resid 20 and name hn  ) (resid 21 and name hn  ) 1.8 0 1.0  {}
assign (resid 21 and name hn  ) (resid 22 and name hn  ) 1.8 0 1.0  {}
assign (resid 22 and name hn  ) (resid 23 and name hn  ) 1.8 0 1.0  {}
assign (resid 23 and name hn  ) (resid 24 and name hn  ) 1.8 0 1.0  {}
!..........................Helix 1 (NH-NHi+2)..................................
assign (resid 6 and name hn   ) (resid 8 and name hn   ) 1.8 0 3.2  {}
assign (resid 7 and name hn   ) (resid 9 and name hn   ) 1.8 0 3.2  {}
assign (resid 8 and name hn   ) (resid 10 and name hn  ) 1.8 0 3.2  {}
assign (resid 9 and name hn   ) (resid 11 and name hn  ) 1.8 0 3.2  {}
assign (resid 10 and name hn  ) (resid 12 and name hn  ) 1.8 0 3.2  {}
assign (resid 11 and name hn  ) (resid 13 and name hn  ) 1.8 0 3.2  {}
assign (resid 12 and name hn  ) (resid 14 and name hn  ) 1.8 0 3.2  {}
assign (resid 13 and name hn  ) (resid 15 and name hn  ) 1.8 0 3.2  {}
assign (resid 14 and name hn  ) (resid 16 and name hn  ) 1.8 0 3.2  {}
assign (resid 15 and name hn  ) (resid 17 and name hn  ) 1.8 0 3.2  {}
assign (resid 17 and name hn  ) (resid 19 and name hn  ) 1.8 0 3.2  { }
assign (resid 18 and name hn  ) (resid 20 and name hn  ) 1.8 0 3.2  {}
!.............................Helix 1 (NH-NHi+3).............................
assign (resid 6 and name hn   ) (resid 9 and name hn   ) 1.8 0 3.2  {}
assign (resid 8 and name hn   ) (resid 11 and name hn  ) 1.8 0 3.2  {}
assign (resid 9 and name hn   ) (resid 12 and name hn  ) 1.8 0 3.2  {}
assign (resid 14 and name hn  ) (resid 17 and name hn  ) 1.8 0 3.2  {}
assign (resid 15 and name hn  ) (resid 18 and name hn  ) 1.8 0 3.2  {}
assign (resid 16 and name hn  ) (resid 19 and name hn  ) 1.8 0 3.2  {}
assign (resid 17 and name hn  ) (resid 20 and name hn  ) 1.8 0 3.2  {}
!.............................Helix 1 (Ha-NHi+1)................................
assign (resid 2 and name ha   ) (resid 3 and name hn   ) 1.8 0 1.5  {}
assign (resid 3 and name ha   ) (resid 4 and name hn   ) 1.8 0 3.2  {}
!assign (resid 4 and name ha  ) (resid 5 and name hn   ) 1.8 0 --  {}
!assign (resid 5 and name ha  ) (resid 6 and name hn   ) 1.8 0 --  {}
assign (resid 6 and name ha   ) (resid 7 and name hn   ) 1.8 0 3.2  {}
assign (resid 7 and name ha   ) (resid 8 and name hn   ) 1.8 0 3.2  {}
assign (resid 8 and name ha   ) (resid 9 and name hn   ) 1.8 0 3.2  {}
assign (resid 9 and name ha   ) (resid 10 and name hn  ) 1.8 0 3.2  {}
!assign (resid 10 and name ha  ) (resid 11 and name hn  ) 1.8 0 ---  {}
assign (resid 11 and name ha  ) (resid 12 and name hn  ) 1.8 0 3.2  {}
assign (resid 12 and name ha  ) (resid 13 and name hn  ) 1.8 0 3.2  {}
assign (resid 13 and name ha  ) (resid 14 and name hn  ) 1.8 0 3.2  {}
assign (resid 14 and name ha  ) (resid 15 and name hn  ) 1.8 0 3.2  {}
assign (resid 15 and name ha  ) (resid 16 and name hn  ) 1.8 0 3.2  {}
assign (resid 16 and name ha  ) (resid 17 and name hn  ) 1.8 0 3.2  {}
assign (resid 17 and name ha  ) (resid 18 and name hn  ) 1.8 0 3.2  {}
assign (resid 18 and name ha  ) (resid 19 and name hn  ) 1.8 0 3.2  {}
assign (resid 19 and name ha  ) (resid 20 and name hn  ) 1.8 0 3.2  {}
assign (resid 20 and name ha  ) (resid 21 and name hn  ) 1.8 0 3.2  {}
assign (resid 21 and name ha  ) (resid 22 and name hn  ) 1.8 0 3.2  {}
assign (resid 22 and name ha  ) (resid 23 and name hn  ) 1.8 0 3.2  {}
assign (resid 23 and name ha  ) (resid 24 and name hn  ) 1.8 0 3.2  {}
!assign (resid 24 and name ha  ) (resid 25 and name hn  ) 1.8 0 --   {}
!.............................Helix 1 (Ha-NHi+3)................................
assign (resid 4 and name ha   ) (resid 7 and name hn   ) 1.8 0 3.2  {}
assign (resid 5 and name ha   ) (resid 8 and name hn   ) 1.8 0 3.2  {}
assign (resid 6 and name ha   ) (resid 9 and name hn   ) 1.8 0 3.2  {}
assign (resid 7 and name ha   ) (resid 10 and name hn  ) 1.8 0 3.2  {}
assign (resid 8 and name ha   ) (resid 11 and name hn  ) 1.8 0 3.2  {}
assign (resid 9 and name ha   ) (resid 12 and name hn  ) 1.8 0 3.2  {}
assign (resid 10 and name ha  ) (resid 13 and name hn  ) 1.8 0 3.2  {}
assign (resid 11 and name ha  ) (resid 14 and name hn  ) 1.8 0 3.2  {}
assign (resid 12 and name ha  ) (resid 15 and name hn  ) 1.8 0 3.2  {}
assign (resid 13 and name ha  ) (resid 16 and name hn  ) 1.8 0 3.2  {}
assign (resid 14 and name ha  ) (resid 17 and name hn  ) 1.8 0 3.2  {}
assign (resid 15 and name ha  ) (resid 18 and name hn  ) 1.8 0 3.2  {}
assign (resid 16 and name ha  ) (resid 19 and name hn  ) 1.8 0 3.2  {}
assign (resid 17 and name ha  ) (resid 20 and name hn  ) 1.8 0 3.2  {}
assign (resid 18 and name ha  ) (resid 21 and name hn  ) 1.8 0 3.2  {}
!.............................Helix 1 (Ha-NHi+4).............................
assign (resid 5 and name ha   ) (resid 9 and name hn   ) 1.8 0 3.2  {}
assign (resid 6 and name ha   ) (resid 10 and name hn  ) 1.8 0 3.2  {}
assign (resid 8 and name ha   ) (resid 12 and name hn  ) 1.8 0 3.2  {}
assign (resid 10 and name ha  ) (resid 14 and name hn  ) 1.8 0 3.2  {}
assign (resid 11 and name ha  ) (resid 15 and name hn  ) 1.8 0 3.2  {}
assign (resid 12 and name ha  ) (resid 16 and name hn  ) 1.8 0 3.2  {}
assign (resid 13 and name ha  ) (resid 17 and name hn  ) 1.8 0 3.2  {}
assign (resid 14 and name ha  ) (resid 18 and name hn  ) 1.8 0 3.2  {}
assign (resid 15 and name ha  ) (resid 19 and name hn  ) 1.8 0 3.2  {}
assign (resid 16 and name ha  ) (resid 20 and name hn  ) 1.8 0 3.2  {}
assign (resid 17 and name ha  ) (resid 21 and name hn  ) 1.8 0 3.2  {}
!.............................Helix 1 (Ha-Hbi+3).............................
assign (resid 7 and name hb*  ) (resid 4 and name ha   ) 1.8 0 2.0  {, +0.5forHb*}
assign (resid 8 and name hb   ) (resid 5 and name ha   ) 1.8 0 1.5  {}
assign (resid 9 and name hb*  ) (resid 6 and name ha   ) 1.8 0 2.5  {}
assign (resid 10 and name hb  ) (resid 7 and name ha   ) 1.8 0 1.5  {}
assign (resid 11 and name hb  ) (resid 8 and name ha   ) 1.8 0 1.5  {}
assign (resid 12 and name hb1 ) (resid 9 and name ha   ) 1.8 0 1.5  {}
assign (resid 12 and name hb2 ) (resid 9 and name ha   ) 1.8 0 1.5  {}
assign (resid 13 and name hb* ) (resid 10 and name ha  ) 1.8 0 2.5  {, +1.0forhb*}
assign (resid 14 and name hb1 ) (resid 11 and name ha  ) 1.8 0 1.5  {}
assign (resid 14 and name hb2 ) (resid 11 and name ha  ) 1.8 0 1.5  {}
assign (resid 15 and name hb  ) (resid 12 and name ha  ) 1.8 0 1.5  {}
assign (resid 16 and name hb* ) (resid 13 and name ha  ) 1.8 0 2.5  {}
assign (resid 17 and name hb* ) (resid 14 and name ha  ) 1.8 0 2.5  {}
assign (resid 18 and name hb1 ) (resid 15 and name ha  ) 1.8 0 1.5  {}
assign (resid 18 and name hb2 ) (resid 15 and name ha  ) 1.8 0 1.5  {}
assign (resid 19 and name hb1 ) (resid 16 and name ha  ) 1.8 0 1.5  {}
assign (resid 19 and name hb2 ) (resid 16 and name ha  ) 1.8 0 1.5  {}
assign (resid 20 and name hb* ) (resid 17 and name ha  ) 1.8 0 2.5  {}
!Met1
assign (resid 1 and name ha ) (resid 1 and name hb* ) 1.8 0 2.0  {s}
!Pro2
assign (resid 2 and name ha ) (resid 2 and name hb* ) 1.8 0 1.5  {s}
assign (resid 2 and name ha ) (resid 2 and name hg* ) 1.8 0 3.7  {}
assign (resid 2 and name hd1) (resid 1 and name ha  ) 1.8 0 1.5  {}
assign (resid 2 and name hd2) (resid 1 and name ha  ) 1.8 0 1.5  {}
!Gly3
assign (resid 3 and name hn) (resid 1 and name ha* ) 1.8 0 1.5  {}
!Thr4
assign (resid 4 and name hn) (resid 4 and name ha  ) 1.8 0 3.2  {}
assign (resid 4 and name hn) (resid 4 and name hb  ) 1.8 0 1.5  {}
assign (resid 4 and name hn) (resid 4 and name hg2*) 1.8 0 2.0  {}
assign (resid 4 and name ha) (resid 4 and name hg2*) 1.8 0 2.5  {}
!Ile5
assign (resid 5 and name hn ) (resid 5 and name ha  ) 1.8 0 3.2  {}
assign (resid 5 and name hn ) (resid 5 and name hb  ) 1.8 0 1.5  {}
assign (resid 5 and name hn ) (resid 5 and name hg11  ) 1.8 0 2.0  {}
assign (resid 5 and name hn ) (resid 5 and name hg12  ) 1.8 0 2.0  {}
assign (resid 5 and name hn ) (resid 5 and name hd*   ) 1.8 0 3.0  {}
assign (resid 5 and name hn ) (resid 5 and name hg2*  ) 1.8 0 4.2  {}
assign (resid 5 and name ha ) (resid 5 and name hb  ) 1.8 0 1.5  {}
assign (resid 5 and name ha ) (resid 5 and name hg2 ) 1.8 0 4.2  {}
assign (resid 5 and name ha ) (resid 5 and name hd  ) 1.8 0 3.5  {}
!Lys6
assign (resid 6 and name hn ) (resid 6 and name ha  ) 1.8 0 3.2  {}
assign (resid 6 and name hn ) (resid 6 and name hb* ) 1.8 0 1.5  {}
assign (resid 6 and name hn ) (resid 6 and name hg* ) 1.8 0 3.7  {}
assign (resid 6 and name ha ) (resid 6 and name hb* ) 1.8 0 3.7  {}
assign (resid 6 and name ha ) (resid 6 and name hg* ) 1.8 0 2.0  {}
assign (resid 6 and name hn ) (resid 5 and name hb  ) 1.8 0 1.5  {}
assign (resid 6 and name hn ) (resid 5 and name hg2 ) 1.8 0 4.2  {}
assign (resid 6 and name hn ) (resid 5 and name hd  ) 1.8 0 3.0  { }
!Glu7
assign (resid 7 and name hn ) (resid 7 and name ha  ) 1.8 0 3.2  {}
assign (resid 7 and name hn ) (resid 7 and name hg* ) 1.8 0 3.7  {}
assign (resid 7 and name hn ) (resid 7 and name hb* ) 1.8 0 1.5  {s}
assign (resid 7 and name ha ) (resid 7 and name hg* ) 1.8 0 2.0  {}
assign (resid 7 and name ha ) (resid 7 and name hb* ) 1.8 0 3.7  {s}
assign (resid 7 and name hn ) (resid 6 and name hb* ) 1.8 0 3.7  {}
!Asn8
assign (resid 8 and name hn ) (resid 8 and name ha  ) 1.8 0 3.2  {}
assign (resid 8 and name hn ) (resid 8 and name hb1 ) 1.8 0 1.0  {}
assign (resid 8 and name hn ) (resid 8 and name hb2 ) 1.8 0 1.0  {}
assign (resid 8 and name ha ) (resid 8 and name hb1 ) 1.8 0 3.2  {}
assign (resid 8 and name ha ) (resid 8 and name hb2 ) 1.8 0 3.2  {}
assign (resid 8 and name hn ) (resid 7 and name hg* ) 1.8 0 3.7  {}
assign (resid 8 and name hn ) (resid 7 and name hb* ) 1.8 0 2.0  {}
!Ile9
assign (resid 9 and name hn ) (resid 9 and name ha  ) 1.8 0 3.2  {}
assign (resid 9 and name hn ) (resid 9 and name hb  ) 1.8 0 1.0  {}
assign (resid 9 and name hn ) (resid 9 and name hg11) 1.8 0 2.0  {}
assign (resid 9 and name hn ) (resid 9 and name hg12) 1.8 0 2.0  {}
assign (resid 9 and name hn ) (resid 9 and name hg2*) 1.8 0 4.2  {}
assign (resid 9 and name hn ) (resid 9 and name hd* ) 1.8 0 4.2  {}
assign (resid 9 and name ha ) (resid 9 and name hb  ) 1.8 0 3.2  {}
assign (resid 9 and name ha ) (resid 9 and name hg11) 1.8 0 2.0  {}
assign (resid 9 and name ha ) (resid 9 and name hg12) 1.8 0 2.0  {}
assign (resid 9 and name ha ) (resid 9 and name hg2*) 1.8 0 3.0  {}
assign (resid 9 and name ha ) (resid 9 and name hd* ) 1.8 0 3.0  {}
assign (resid 9 and name hn ) (resid 8 and name hb1 ) 1.8 0 3.2  {}
assign (resid 9 and name hn ) (resid 8 and name hb2 ) 1.8 0 3.2  {}
!Ile10
assign (resid 10 and name hn ) (resid 10 and name ha  ) 1.8 0 3.2  {}
assign (resid 10 and name hn ) (resid 10 and name hb  ) 1.8 0 1.0  {}
assign (resid 10 and name hn ) (resid 10 and name hg11) 1.8 0 3.7  {}
assign (resid 10 and name hn ) (resid 10 and name hg12) 1.8 0 3.7  {}
assign (resid 10 and name hn ) (resid 10 and name hg2*) 1.8 0 4.2  {}
assign (resid 10 and name hn ) (resid 10 and name hd* ) 1.8 0 4.2  {}
assign (resid 10 and name ha ) (resid 10 and name hb  ) 1.8 0 3.2  {}
assign (resid 10 and name ha ) (resid 10 and name hg11) 1.8 0 1.5  {}
assign (resid 10 and name ha ) (resid 10 and name hg12) 1.8 0 1.5  {}
assign (resid 10 and name ha ) (resid 10 and name hg2*) 1.8 0 3.2  {}
assign (resid 10 and name ha ) (resid 10 and name hd* ) 1.8 0 3.2  {}
assign (resid 10 and name hn ) (resid 9 and name hb  ) 1.8 0 1.5  {}
assign (resid 10 and name hn ) (resid 9 and name hg11) 1.8 0 3.7  {}
assign (resid 10 and name hn ) (resid 9 and name hg12) 1.8 0 3.7  {}
assign (resid 10 and name hn ) (resid 9 and name hg2*) 1.8 0 4.2  {}
assign (resid 10 and name hn ) (resid 9 and name hd* ) 1.8 0 4.2  {}
!Gly11
assign (resid 11 and name hn ) (resid 11 and name ha1 ) 1.8 0 3.2  {}
assign (resid 11 and name hn ) (resid 11 and name ha2 ) 1.8 0 1.5  {}
assign (resid 11 and name hn ) (resid 10 and name hb  ) 1.8 0 3.2  {}
assign (resid 11 and name hn ) (resid 10 and name hg11) 1.8 0 3.7  {}
assign (resid 11 and name hn ) (resid 10 and name hg12) 1.8 0 3.7  {}
assign (resid 11 and name hn ) (resid 10 and name hg2*) 1.8 0 4.7  {}
assign (resid 11 and name hn ) (resid 10 and name hd* ) 1.8 0 4.7  {}
!Val12
assign (resid 12 and name hn ) (resid 12 and name ha  ) 1.8 0 3.2  {}
assign (resid 12 and name hn ) (resid 12 and name hb  ) 1.8 0 1.5  {}
assign (resid 12 and name hn ) (resid 12 and name hg1*) 1.8 0 4.7  {}
assign (resid 12 and name hn ) (resid 12 and name hg2*) 1.8 0 2.0  {s}
assign (resid 12 and name ha ) (resid 12 and name hb  ) 1.8 0 3.2  {}
assign (resid 12 and name ha ) (resid 12 and name hg1*) 1.8 0 2.0  {s}
assign (resid 12 and name ha ) (resid 12 and name hg2*) 1.8 0 2.0  {s}
assign (resid 12 and name hg1*) (resid 9 and name hg2*) 1.8 0 3.5  {s}
assign (resid 12 and name hg2*) (resid 9 and name hd*) 1.8 0 3.5  {s}
!er13
assign (resid 13 and name hn ) (resid 13 and name ha  ) 1.8 0 3.2  {}
assign (resid 13 and name hn ) (resid 13 and name hb1 ) 1.8 0 2.5  {}
assign (resid 13 and name hn ) (resid 13 and name hb2 ) 1.8 0 2.5  {}
assign (resid 13 and name ha ) (resid 13 and name hb1 ) 1.8 0 3.7  {}
assign (resid 13 and name ha ) (resid 13 and name hb1 ) 1.8 0 3.7  {}
assign (resid 13 and name hn ) (resid 12 and name hb  ) 1.8 0 1.5  {}
assign (resid 13 and name hn ) (resid 12 and name hg1*) 1.8 0 4.7  {}
assign (resid 13 and name hn ) (resid 12 and name hg2*) 1.8 0 4.7  {s,}
!Tyr14
assign (resid 14 and name hn ) (resid 14 and name ha  ) 1.8 0 3.2  {}
assign (resid 14 and name hn ) (resid 14 and name hb* ) 1.8 0 2.5  {}
assign (resid 14 and name ha ) (resid 14 and name hb* ) 1.8 0 3.7  {}
assign (resid 14 and name hn ) (resid 13 and name hb1 ) 1.8 0 3.7  {}
assign (resid 14 and name hn ) (resid 13 and name hb2 ) 1.8 0 3.7  {}
assign (resid 14 and name hn ) (resid 14 and name hd* ) 1.8 0 3.8  {1.5+2.3}
assign (resid 14 and name ha ) (resid 14 and name hd* ) 1.8 0 3.3  {1.0+2.3}
assign (resid 14 and name hb*) (resid 14 and name hd* ) 1.8 0 3.8  {1.5+2.3}
assign (resid 14 and name ha ) (resid 14 and name he* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 14 and name hd*) (resid 10 and name hg2*) 1.8 0 4.3  {2.0+2.3}
assign (resid 14 and name he*) (resid 10 and name hg2*) 1.8 0 6.5  {4.2+2.3}
!Asp15
assign (resid 15 and name hn ) (resid 15 and name ha  ) 1.8 0 3.2  {}
assign (resid 15 and name hn ) (resid 15 and name hb1 ) 1.8 0 2.5  {}
assign (resid 15 and name hn ) (resid 15 and name hb2 ) 1.8 0 2.5  {}
assign (resid 15 and name ha ) (resid 15 and name hb1 ) 1.8 0 3.7  {}
assign (resid 15 and name ha ) (resid 15 and name hb1 ) 1.8 0 3.7  {}
assign (resid 15 and name hn ) (resid 14 and name hb* ) 1.8 0 2.5  {}
assign (resid 15 and name hn ) (resid 14 and name hd* ) 1.8 0 3.8  {1.5+2.3}
!Glu16
assign (resid 16 and name hn ) (resid 16 and name ha  ) 1.8 0 3.2  {}
assign (resid 16 and name hn ) (resid 16 and name hb1 ) 1.8 0 1.5  {s}
assign (resid 16 and name hn ) (resid 16 and name hb2 ) 1.8 0 1.5  {s}
assign (resid 16 and name hn ) (resid 16 and name hg1 ) 1.8 0 3.7  {}
assign (resid 16 and name hn ) (resid 16 and name hg1 ) 1.8 0 3.7  {}
assign (resid 16 and name ha ) (resid 16 and name hb1 ) 1.8 0 3.7  {}
assign (resid 16 and name ha ) (resid 16 and name hb2 ) 1.8 0 3.7  {}
assign (resid 16 and name ha ) (resid 16 and name hg1 ) 1.8 0 1.5  {}
assign (resid 16 and name ha ) (resid 16 and name hg1 ) 1.8 0 1.5  {}
assign (resid 16 and name hn ) (resid 15 and name hb1 ) 1.8 0 3.7  {}
assign (resid 16 and name hn ) (resid 15 and name hb2 ) 1.8 0 3.7  {}
!Tyr17
assign (resid 17 and name hn ) (resid 17 and name ha  ) 1.8 0 3.2  {}
assign (resid 17 and name hn ) (resid 17 and name hb* ) 1.8 0 1.5  {s}
assign (resid 17 and name ha ) (resid 17 and name hb* ) 1.8 0 2.0  {s}
assign (resid 17 and name hn ) (resid 16 and name hb1 ) 1.8 0 3.2  {}
assign (resid 17 and name hn ) (resid 16 and name hb2 ) 1.8 0 1.5  {s}
assign (resid 17 and name hn ) (resid 16 and name hg1 ) 1.8 0 3.7  {}
assign (resid 17 and name hn ) (resid 16 and name hg1 ) 1.8 0 3.7  {}
assign (resid 17 and name hn ) (resid 17 and name hd* ) 1.8 0 3.8  {1.5+2.3}
assign (resid 17 and name ha ) (resid 17 and name hd* ) 1.8 0 3.3  {1.1+2.3}
assign (resid 17 and name ha ) (resid 17 and name he* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 17 and name hb*) (resid 17 and name hd* ) 1.8 0 3.8  {1.5+2.3}
assign (resid 17 and name hd*) (resid 14 and name hd* ) 1.8 0 5.6  {1+2.3+2.3}
assign (resid 17 and name hd*) (resid 14 and name ha  ) 1.8 0 5.5  {3.2+2.3}
!Arg18
assign (resid 18 and name hn ) (resid 18 and name ha  ) 1.8 0 3.2  {}
assign (resid 18 and name hn ) (resid 18 and name hb* ) 1.8 0 1.5  {s}
assign (resid 18 and name hn ) (resid 18 and name hg1 ) 1.8 0 3.7  {}
assign (resid 18 and name hn ) (resid 18 and name hg2 ) 1.8 0 3.7  {}
assign (resid 18 and name ha ) (resid 18 and name hb* ) 1.8 0 3.2  {s}
assign (resid 18 and name ha ) (resid 18 and name hg1 ) 1.8 0 2.0  {}
assign (resid 18 and name ha ) (resid 18 and name hg2 ) 1.8 0 2.0  {}
assign (resid 18 and name hn ) (resid 17 and name hb* ) 1.8 0 1.5  {s}
assign (resid 18 and name hn ) (resid 17 and name hd* ) 1.8 0 3.8  {1.5+2.3}
assign (resid 18 and name ha ) (resid 17 and name hd* ) 1.8 0 5.4  {3.2+2.3}
!Tyr19
assign (resid 19 and name hn ) (resid 19 and name ha  ) 1.8 0 3.2  {}
assign (resid 19 and name hn ) (resid 19 and name hb1 ) 1.8 0 1.5  {s}
assign (resid 19 and name hn ) (resid 19 and name hb2 ) 1.8 0 1.5  {s}
assign (resid 19 and name ha ) (resid 19 and name hb1 ) 1.8 0 3.2  {}
assign (resid 19 and name ha ) (resid 19 and name hb2 ) 1.8 0 3.2  {}
assign (resid 19 and name hn ) (resid 18 and name hb* ) 1.8 0 2.5  {}
assign (resid 19 and name hn ) (resid 18 and name hg* ) 1.8 0 3.7  {}
assign (resid 19 and name hn ) (resid 19 and name hd* ) 1.8 0 3.8  {1.5+2.3}
assign (resid 19 and name ha ) (resid 19 and name hd* ) 1.8 0 3.3  {1.0+2.3}
assign (resid 19 and name hb1) (resid 19 and name hd* ) 1.8 0 3.3  {1.0+2.3}
assign (resid 19 and name hb2) (resid 19 and name hd* ) 1.8 0 3.3  {1.0+2.3}
assign (resid 19 and name hd*) (resid 17 and name hd* ) 1.8 0 6.6  {2+2.3+2.3}
assign (resid 19 and name hd*) (resid 16 and name ha  ) 1.8 0 5.5  {3.2+2.3}
!Arg20
assign (resid 20 and name hn ) (resid 20 and name ha  ) 1.8 0 3.2  {}
assign (resid 20 and name hn ) (resid 20 and name hb* ) 1.8 0 1.5  {s}
assign (resid 20 and name hn ) (resid 20 and name hg* ) 1.8 0 3.7  {}
assign (resid 20 and name ha ) (resid 20 and name hb* ) 1.8 0 3.7  {s}
assign (resid 20 and name ha ) (resid 20 and name hg* ) 1.8 0 1.5  {}
assign (resid 20 and name hn ) (resid 19 and name hb1 ) 1.8 0 3.2  {s}
assign (resid 20 and name hn ) (resid 19 and name hb2 ) 1.8 0 1.5  {}
assign (resid 20 and name hn ) (resid 19 and name hd* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 20 and name hg*) (resid 20 and name hd* ) 1.8 0 6.0  {3.7+2.3}
assign (resid 20 and name hg*) (resid 17 and name hd* ) 1.8 0 6.0  {3.7+2.3}
!er21
assign (resid 21 and name hn ) (resid 21 and name ha  ) 1.8 0 3.2  {}
assign (resid 21 and name hn ) (resid 21 and name hb1 ) 1.8 0 1.0  {s}
assign (resid 21 and name hn ) (resid 21 and name hb2 ) 1.8 0 1.0  {s}
assign (resid 21 and name ha ) (resid 21 and name hb1 ) 1.8 0 3.2  {}
assign (resid 21 and name ha ) (resid 21 and name hb2 ) 1.8 0 3.2  {}
assign (resid 21 and name hn ) (resid 20 and name hb* ) 1.8 0 3.7  {}
assign (resid 21 and name hn ) (resid 20 and name hg* ) 1.8 0 3.7  {}
!Val22
assign (resid 22 and name hn ) (resid 22 and name ha  ) 1.8 0 3.2  {}
assign (resid 22 and name hn ) (resid 22 and name hb  ) 1.8 0 1.5  {}
assign (resid 22 and name hn ) (resid 22 and name hg1*) 1.8 0 4.2  {}
assign (resid 22 and name hn ) (resid 22 and name hg2*) 1.8 0 2.5  {}
assign (resid 22 and name ha ) (resid 22 and name hb  ) 1.8 0 3.2  {}
assign (resid 22 and name ha ) (resid 22 and name hg1*) 1.8 0 2.5  {}
assign (resid 22 and name ha ) (resid 22 and name hg2*) 1.8 0 3.2  {}
assign (resid 19 and name ha ) (resid 22 and name hg1*) 1.8 0 4.2  {}
assign (resid 19 and name ha ) (resid 22 and name hg2*) 1.8 0 2.5  {}
assign (resid 21 and name ha ) (resid 22 and name hg1*) 1.8 0 3.2  {}
!assign (resid 21 and name ha ) (resid 22 and name hg2*) 1.8 0 4.2  {}
!Ile23
assign (resid 23 and name hn ) (resid 23 and name ha  ) 1.8 0 3.2  {}
assign (resid 23 and name hn ) (resid 23 and name hb  ) 1.8 0 1.0  {}
assign (resid 23 and name hn ) (resid 23 and name hg11) 1.8 0 1.5  {}
assign (resid 23 and name hn ) (resid 23 and name hg12) 1.8 0 3.2  {}
assign (resid 23 and name hn ) (resid 23 and name hg2*) 1.8 0 4.2  {}
assign (resid 23 and name hn ) (resid 23 and name hd* ) 1.8 0 2.5  {}
assign (resid 23 and name ha ) (resid 23 and name hb  ) 1.8 0 1.5  {}
assign (resid 23 and name ha ) (resid 23 and name hg11) 1.8 0 2.5  {}
assign (resid 23 and name ha ) (resid 23 and name hg12) 1.8 0 3.2  {}
assign (resid 23 and name ha ) (resid 23 and name hg2*) 1.8 0 2.5  {}
assign (resid 23 and name ha ) (resid 23 and name hd* ) 1.8 0 3.2  {}
assign (resid 23 and name hn ) (resid 22 and name hg1*) 1.8 0 2.5  {}
assign (resid 23 and name hn ) (resid 22 and name hg2*) 1.8 0 4.2  {}
assign (resid 23 and name hn ) (resid 22 and name hb  ) 1.8 0 3.2  {}
assign (resid 23 and name hb ) (resid 19 and name hd* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 23 and name hd*) (resid 19 and name hd* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 23 and name hg2*) (resid 19 and name hd* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 23 and name hd*) (resid 19 and name he* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 23 and name hg2*) (resid 19 and name he* ) 1.8 0 5.5  {3.2+2.3}
assign (resid 23 and name hd* ) (resid 22 and name hg1* ) 1.8 0 3.0  {s}
assign (resid 23 and name hg11) (resid 22 and name hg1* ) 1.8 0 4.2  {s}
!Lys24
assign (resid 24 and name hn ) (resid 24 and name ha  ) 1.8 0 3.2  {}
assign (resid 24 and name hn ) (resid 24 and name hb* ) 1.8 0 2.0  {}
assign (resid 24 and name hn ) (resid 24 and name hg1 ) 1.8 0 3.2  {}
assign (resid 24 and name hn ) (resid 24 and name hg2 ) 1.8 0 3.2  {}
assign (resid 24 and name ha ) (resid 24 and name hb* ) 1.8 0 3.2  {}
assign (resid 24 and name ha ) (resid 24 and name hg1 ) 1.8 0 3.2  {}
assign (resid 24 and name ha ) (resid 24 and name hg2 ) 1.8 0 3.2  {}
assign (resid 24 and name hn ) (resid 23 and name hb  ) 1.8 0 1.5  {}
assign (resid 24 and name hn ) (resid 23 and name hg1*) 1.8 0 3.7  {}
assign (resid 24 and name hn ) (resid 23 and name hg2*) 1.8 0 2.5  {}
!Ala25
assign (resid 24 and name hn ) (resid 24 and name ha  ) 1.8 0 3.2  {}
assign (resid 24 and name hn ) (resid 24 and name hb* ) 1.8 0 2.0  {}
assign (resid 24 and name ha ) (resid 24 and name hb* ) 1.8 0 2.0  {}
set essage=on echo=on end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1 -15.554  -2.865   9.976
    2   2H    MET   1          2H        MET   1 -13.942  -2.531  10.386
    3   3H    MET   1          3H        MET   1 -15.150  -1.374  10.685
    4    HA   MET   1           HA       MET   1 -14.415  -0.477   8.753
    5   1HB   MET   1          1HB       MET   1 -13.262  -2.036   7.083
    6   2HB   MET   1          2HB       MET   1 -12.495  -1.916   8.667
    7   1HG   MET   1          1HG       MET   1 -13.065  -4.058   9.259
    8   2HG   MET   1          2HG       MET   1 -14.581  -4.015   8.358
    9   1HE   MET   1          1HE       MET   1 -14.386  -6.118   7.868
   10   2HE   MET   1          2HE       MET   1 -14.534  -5.984   6.118
   11   3HE   MET   1          3HE       MET   1 -13.252  -6.972   6.813
   12    HA   PRO   2           HA       PRO   2 -18.335  -2.479   7.150
   13   1HB   PRO   2          1HB       PRO   2 -20.074  -0.492   7.858
   14   2HB   PRO   2          2HB       PRO   2 -19.671  -1.847   8.931
   15   1HG   PRO   2          1HG       PRO   2 -18.688   0.954   8.971
   16   2HG   PRO   2          2HG       PRO   2 -19.036  -0.141  10.316
   17   1HD   PRO   2          1HD       PRO   2 -16.511   0.419   9.376
   18   2HD   PRO   2          2HD       PRO   2 -16.948  -1.050  10.275
   19    H    GLY   3           H        GLY   3 -16.414   0.199   6.624
   20   1HA   GLY   3          1HA       GLY   3 -17.376   0.536   3.905
   21   2HA   GLY   3          2HA       GLY   3 -17.763   1.928   4.917
   22    H    THR   4           H        THR   4 -14.873  -0.072   5.270
   23    HA   THR   4           HA       THR   4 -13.211   2.017   3.993
   24    HB   THR   4           HB       THR   4 -13.534   2.612   6.449
   25    HG1  THR   4           HG1      THR   4 -11.522   2.834   4.956
   26   1HG2  THR   4          1HG2      THR   4 -12.953  -0.130   6.751
   27   2HG2  THR   4          2HG2      THR   4 -11.556   0.733   7.397
   28   3HG2  THR   4          3HG2      THR   4 -13.168   1.061   8.034
   29    H    ILE   5           H        ILE   5 -13.648  -0.526   3.029
   30    HA   ILE   5           HA       ILE   5 -11.391  -2.215   3.940
   31    HB   ILE   5           HB       ILE   5 -13.489  -2.738   1.812
   32   1HG1  ILE   5          1HG1      ILE   5 -13.328  -3.733   4.675
   33   2HG1  ILE   5          2HG1      ILE   5 -14.401  -2.445   4.128
   34   1HG2  ILE   5          1HG2      ILE   5 -11.426  -4.493   3.173
   35   2HG2  ILE   5          2HG2      ILE   5 -12.764  -5.125   2.214
   36   3HG2  ILE   5          3HG2      ILE   5 -11.535  -4.114   1.454
   37   1HD1  ILE   5          1HD1      ILE   5 -14.956  -4.401   2.301
   38   2HD1  ILE   5          2HD1      ILE   5 -14.614  -5.364   3.739
   39   3HD1  ILE   5          3HD1      ILE   5 -15.881  -4.138   3.780
   40    H    LYS   6           H        LYS   6 -12.483  -0.432   1.068
   41    HA   LYS   6           HA       LYS   6 -10.024  -1.168  -0.390
   42   1HB   LYS   6          1HB       LYS   6 -12.534  -0.659  -1.271
   43   2HB   LYS   6          2HB       LYS   6 -11.824   0.946  -1.448
   44   1HG   LYS   6          1HG       LYS   6  -9.917  -0.958  -2.394
   45   2HG   LYS   6          2HG       LYS   6 -11.472  -1.333  -3.139
   46   1HD   LYS   6          1HD       LYS   6 -11.253   1.480  -3.199
   47   2HD   LYS   6          2HD       LYS   6  -9.678   0.863  -3.703
   48   1HE   LYS   6          1HE       LYS   6 -12.151  -0.392  -4.864
   49   2HE   LYS   6          2HE       LYS   6 -11.587   1.163  -5.506
   50   1HZ   LYS   6          1HZ       LYS   6  -9.334   0.166  -5.644
   51   2HZ   LYS   6          2HZ       LYS   6 -10.011  -1.340  -5.242
   52   3HZ   LYS   6          3HZ       LYS   6 -10.459  -0.563  -6.685
   53    H    GLU   7           H        GLU   7 -11.521   1.716   1.058
   54    HA   GLU   7           HA       GLU   7  -9.534   3.599   0.291
   55   1HB   GLU   7          1HB       GLU   7 -11.819   3.983   1.466
   56   2HB   GLU   7          2HB       GLU   7 -10.932   3.692   2.963
   57   1HG   GLU   7          1HG       GLU   7 -10.985   6.095   2.474
   58   2HG   GLU   7          2HG       GLU   7  -9.334   5.487   2.345
   59    H    ASN   8           H        ASN   8  -9.360   0.949   2.451
   60    HA   ASN   8           HA       ASN   8  -7.151   2.090   4.035
   61   1HB   ASN   8          1HB       ASN   8  -8.992   0.368   4.805
   62   2HB   ASN   8          2HB       ASN   8  -7.906  -0.816   4.074
   63   1HD2  ASN   8          2HD2      ASN   8  -7.680   2.032   6.293
   64   2HD2  ASN   8          1HD2      ASN   8  -6.523   1.323   7.314
   65    H    ILE   9           H        ILE   9  -7.635  -0.422   1.555
   66    HA   ILE   9           HA       ILE   9  -4.925  -1.312   1.457
   67    HB   ILE   9           HB       ILE   9  -6.854  -1.183  -0.878
   68   1HG1  ILE   9          1HG1      ILE   9  -8.043  -2.210   0.952
   69   2HG1  ILE   9          2HG1      ILE   9  -7.477  -3.515  -0.091
   70   1HG2  ILE   9          1HG2      ILE   9  -4.208  -2.070  -0.669
   71   2HG2  ILE   9          2HG2      ILE   9  -5.174  -3.543  -0.570
   72   3HG2  ILE   9          3HG2      ILE   9  -5.344  -2.469  -1.958
   73   1HD1  ILE   9          1HD1      ILE   9  -5.371  -3.495   1.469
   74   2HD1  ILE   9          2HD1      ILE   9  -6.440  -2.664   2.600
   75   3HD1  ILE   9          3HD1      ILE   9  -6.847  -4.282   2.028
   76    H    ILE  10           H        ILE  10  -6.615   1.313  -0.248
   77    HA   ILE  10           HA       ILE  10  -4.643   2.097  -2.069
   78    HB   ILE  10           HB       ILE  10  -6.600   3.695  -0.414
   79   1HG1  ILE  10          1HG1      ILE  10  -6.477   3.527  -3.410
   80   2HG1  ILE  10          2HG1      ILE  10  -7.109   2.155  -2.498
   81   1HG2  ILE  10          1HG2      ILE  10  -4.468   4.689  -2.303
   82   2HG2  ILE  10          2HG2      ILE  10  -5.974   5.579  -2.084
   83   3HG2  ILE  10          3HG2      ILE  10  -4.902   5.310  -0.711
   84   1HD1  ILE  10          1HD1      ILE  10  -8.099   5.008  -2.221
   85   2HD1  ILE  10          2HD1      ILE  10  -8.899   3.757  -3.173
   86   3HD1  ILE  10          3HD1      ILE  10  -8.770   3.586  -1.422
   87    H    GLY  11           H        GLY  11  -4.705   2.476   1.425
   88   1HA   GLY  11          1HA       GLY  11  -2.314   4.195   1.413
   89   2HA   GLY  11          2HA       GLY  11  -3.170   3.620   2.845
   90    H    VAL  12           H        VAL  12  -3.162   0.818   2.007
   91    HA   VAL  12           HA       VAL  12  -0.587   0.062   3.080
   92    HB   VAL  12           HB       VAL  12  -2.833  -1.517   1.805
   93   1HG1  VAL  12          1HG1      VAL  12  -0.094  -2.347   2.683
   94   2HG1  VAL  12          2HG1      VAL  12  -1.442  -3.434   3.016
   95   3HG1  VAL  12          3HG1      VAL  12  -1.078  -2.963   1.356
   96   1HG2  VAL  12          1HG2      VAL  12  -3.171  -0.482   4.072
   97   2HG2  VAL  12          2HG2      VAL  12  -3.245  -2.243   4.090
   98   3HG2  VAL  12          3HG2      VAL  12  -1.794  -1.416   4.655
   99    H    SER  13           H        SER  13  -1.980   0.139  -0.181
  100    HA   SER  13           HA       SER  13   0.341  -1.128  -1.404
  101   1HB   SER  13          1HB       SER  13  -2.269  -0.210  -2.248
  102   2HB   SER  13          2HB       SER  13  -1.032   0.368  -3.361
  103    HG   SER  13           HG       SER  13  -1.984  -1.852  -3.647
  104    H    TYR  14           H        TYR  14  -0.846   2.215  -1.077
  105    HA   TYR  14           HA       TYR  14   1.031   3.576  -2.636
  106   1HB   TYR  14          1HB       TYR  14  -0.843   4.272  -0.659
  107   2HB   TYR  14          2HB       TYR  14   0.693   4.920  -0.083
  108    HD1  TYR  14           HD1      TYR  14   2.167   6.115  -1.943
  109    HD2  TYR  14           HD2      TYR  14  -2.083   5.532  -2.180
  110    HE1  TYR  14           HE1      TYR  14   2.005   7.964  -3.588
  111    HE2  TYR  14           HE2      TYR  14  -2.244   7.381  -3.824
  112    HH   TYR  14           HH       TYR  14   0.007   8.472  -5.591
  113    H    ASP  15           H        ASP  15   1.553   1.798   0.303
  114    HA   ASP  15           HA       ASP  15   4.229   3.012   0.686
  115   1HB   ASP  15          1HB       ASP  15   3.027   2.653   2.733
  116   2HB   ASP  15          2HB       ASP  15   2.624   0.997   2.276
  117    H    GLU  16           H        GLU  16   2.891  -0.307   0.367
  118    HA   GLU  16           HA       GLU  16   5.253  -1.727   0.039
  119   1HB   GLU  16          1HB       GLU  16   2.499  -2.166  -0.521
  120   2HB   GLU  16          2HB       GLU  16   3.403  -2.643  -1.957
  121   1HG   GLU  16          1HG       GLU  16   4.587  -4.297  -0.833
  122   2HG   GLU  16          2HG       GLU  16   4.410  -3.502   0.732
  123    H    TYR  17           H        TYR  17   3.537   0.217  -2.370
  124    HA   TYR  17           HA       TYR  17   5.269  -0.429  -4.577
  125   1HB   TYR  17          1HB       TYR  17   3.657   0.749  -5.635
  126   2HB   TYR  17          2HB       TYR  17   2.995   1.249  -4.084
  127    HD1  TYR  17           HD1      TYR  17   5.735   2.073  -6.501
  128    HD2  TYR  17           HD2      TYR  17   3.073   3.504  -3.450
  129    HE1  TYR  17           HE1      TYR  17   6.491   4.396  -6.933
  130    HE2  TYR  17           HE2      TYR  17   3.826   5.830  -3.884
  131    HH   TYR  17           HH       TYR  17   5.132   6.892  -6.430
  132    H    ARG  18           H        ARG  18   5.139   2.470  -2.493
  133    HA   ARG  18           HA       ARG  18   7.642   3.531  -3.438
  134   1HB   ARG  18          1HB       ARG  18   5.598   4.519  -1.915
  135   2HB   ARG  18          2HB       ARG  18   6.828   4.229  -0.684
  136   1HG   ARG  18          1HG       ARG  18   8.461   5.440  -2.240
  137   2HG   ARG  18          2HG       ARG  18   7.044   5.958  -3.154
  138   1HD   ARG  18          1HD       ARG  18   6.269   6.563  -0.605
  139   2HD   ARG  18          2HD       ARG  18   8.006   6.849  -0.506
  140    HE   ARG  18           HE       ARG  18   6.104   8.335  -2.219
  141   1HH1  ARG  18          1HH2      ARG  18   8.216   9.364  -0.191
  142   2HH1  ARG  18          2HH2      ARG  18   9.370  10.060  -1.278
  143   1HH2  ARG  18          1HH1      ARG  18   8.068   8.495  -4.085
  144   2HH2  ARG  18          2HH1      ARG  18   9.285   9.571  -3.482
  145    H    TYR  19           H        TYR  19   7.061   0.780  -1.681
  146    HA   TYR  19           HA       TYR  19   9.672   0.933  -0.252
  147   1HB   TYR  19          1HB       TYR  19   6.988  -0.142   0.413
  148   2HB   TYR  19          2HB       TYR  19   8.361  -1.113   0.913
  149    HD1  TYR  19           HD1      TYR  19   6.754   2.210   1.196
  150    HD2  TYR  19           HD2      TYR  19   9.854  -0.385   2.638
  151    HE1  TYR  19           HE1      TYR  19   7.159   3.749   3.103
  152    HE2  TYR  19           HE2      TYR  19  10.262   1.149   4.544
  153    HH   TYR  19           HH       TYR  19   8.289   3.233   5.672
  154    H    ARG  20           H        ARG  20   7.949  -0.446  -2.805
  155    HA   ARG  20           HA       ARG  20   8.834  -3.150  -2.796
  156   1HB   ARG  20          1HB       ARG  20   7.049  -2.677  -4.239
  157   2HB   ARG  20          2HB       ARG  20   7.844  -1.257  -4.914
  158   1HG   ARG  20          1HG       ARG  20   9.021  -2.479  -6.435
  159   2HG   ARG  20          2HG       ARG  20   9.287  -3.810  -5.309
  160   1HD   ARG  20          1HD       ARG  20   6.784  -4.332  -5.596
  161   2HD   ARG  20          2HD       ARG  20   6.837  -3.244  -6.983
  162    HE   ARG  20           HE       ARG  20   8.096  -5.900  -6.820
  163   1HH1  ARG  20          1HH2      ARG  20   6.465  -4.629  -9.107
  164   2HH1  ARG  20          2HH2      ARG  20   7.707  -4.403 -10.293
  165   1HH2  ARG  20          1HH1      ARG  20  10.306  -4.842  -8.039
  166   2HH2  ARG  20          2HH1      ARG  20   9.882  -4.522  -9.688
  167    H    SER  21           H        SER  21  10.302  -0.281  -4.396
  168    HA   SER  21           HA       SER  21  12.764  -1.946  -4.697
  169   1HB   SER  21          1HB       SER  21  11.364  -1.370  -6.815
  170   2HB   SER  21          2HB       SER  21  12.037   0.244  -6.619
  171    HG   SER  21           HG       SER  21  13.582  -0.692  -7.770
  172    H    VAL  22           H        VAL  22  12.476  -0.404  -2.461
  173    HA   VAL  22           HA       VAL  22  14.448   1.762  -2.959
  174    HB   VAL  22           HB       VAL  22  12.497   3.020  -2.770
  175   1HG1  VAL  22          1HG1      VAL  22  11.583   0.662  -1.307
  176   2HG1  VAL  22          2HG1      VAL  22  11.004   2.174  -0.617
  177   3HG1  VAL  22          3HG1      VAL  22  10.669   1.790  -2.306
  178   1HG2  VAL  22          1HG2      VAL  22  14.261   3.240  -0.741
  179   2HG2  VAL  22          2HG2      VAL  22  12.816   4.247  -0.854
  180   3HG2  VAL  22          3HG2      VAL  22  12.815   2.816   0.177
  181    H    ILE  23           H        ILE  23  12.911  -0.436  -0.626
  182    HA   ILE  23           HA       ILE  23  14.578   0.148   1.601
  183    HB   ILE  23           HB       ILE  23  13.451  -2.576   0.903
  184   1HG1  ILE  23          1HG1      ILE  23  11.932  -0.746   2.668
  185   2HG1  ILE  23          2HG1      ILE  23  11.962  -0.289   0.965
  186   1HG2  ILE  23          1HG2      ILE  23  15.072  -2.196   2.880
  187   2HG2  ILE  23          2HG2      ILE  23  13.748  -1.294   3.618
  188   3HG2  ILE  23          3HG2      ILE  23  13.542  -3.001   3.228
  189   1HD1  ILE  23          1HD1      ILE  23  11.372  -2.766   0.498
  190   2HD1  ILE  23          2HD1      ILE  23  10.933  -2.836   2.205
  191   3HD1  ILE  23          3HD1      ILE  23  10.096  -1.723   1.125
  192    H    LYS  24           H        LYS  24  14.978  -2.284  -0.986
  193    HA   LYS  24           HA       LYS  24  17.364  -3.473  -0.088
  194   1HB   LYS  24          1HB       LYS  24  16.282  -4.390  -2.024
  195   2HB   LYS  24          2HB       LYS  24  16.404  -2.860  -2.893
  196   1HG   LYS  24          1HG       LYS  24  18.885  -3.051  -2.830
  197   2HG   LYS  24          2HG       LYS  24  18.721  -4.624  -2.048
  198   1HD   LYS  24          1HD       LYS  24  17.429  -3.985  -4.707
  199   2HD   LYS  24          2HD       LYS  24  19.044  -4.682  -4.576
  200   1HE   LYS  24          1HE       LYS  24  17.274  -6.168  -2.864
  201   2HE   LYS  24          2HE       LYS  24  16.563  -6.071  -4.488
  202   1HZ   LYS  24          1HZ       LYS  24  19.447  -6.528  -4.262
  203   2HZ   LYS  24          2HZ       LYS  24  18.414  -7.836  -3.932
  204   3HZ   LYS  24          3HZ       LYS  24  18.360  -7.068  -5.447
  205    H    ALA  25           H        ALA  25  18.733  -1.899   0.879
  206    HA   ALA  25           HA       ALA  25  19.744   0.278  -0.869
  207   1HB   ALA  25          1HB       ALA  25  19.190   0.132   1.868
  208   2HB   ALA  25          2HB       ALA  25  20.952   0.104   1.778
  209   3HB   ALA  25          3HB       ALA  25  20.053   1.433   1.047
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1 -16.658  -2.203   4.570
    2   2H    MET   1          2H        MET   1 -17.709  -1.986   5.887
    3   3H    MET   1          3H        MET   1 -18.141  -1.410   4.348
    4    HA   MET   1           HA       MET   1 -17.426   0.540   5.302
    5   1HB   MET   1          1HB       MET   1 -16.406  -1.389   7.112
    6   2HB   MET   1          2HB       MET   1 -15.048  -0.348   6.681
    7   1HG   MET   1          1HG       MET   1 -15.870   1.328   7.939
    8   2HG   MET   1          2HG       MET   1 -17.417   1.252   7.094
    9   1HE   MET   1          1HE       MET   1 -17.122   2.223   9.693
   10   2HE   MET   1          2HE       MET   1 -18.829   1.787   9.669
   11   3HE   MET   1          3HE       MET   1 -17.804   1.291  11.024
   12    HA   PRO   2           HA       PRO   2 -14.458   0.421   1.898
   13   1HB   PRO   2          1HB       PRO   2 -15.113   2.896   0.936
   14   2HB   PRO   2          2HB       PRO   2 -16.050   1.437   0.562
   15   1HG   PRO   2          1HG       PRO   2 -16.623   3.609   2.503
   16   2HG   PRO   2          2HG       PRO   2 -17.733   2.674   1.491
   17   1HD   PRO   2          1HD       PRO   2 -17.331   2.227   4.173
   18   2HD   PRO   2          2HD       PRO   2 -17.926   1.004   3.030
   19    H    GLY   3           H        GLY   3 -14.558   2.072   4.776
   20   1HA   GLY   3          1HA       GLY   3 -12.472   4.055   4.182
   21   2HA   GLY   3          2HA       GLY   3 -13.165   3.723   5.772
   22    H    THR   4           H        THR   4 -12.658   0.753   5.208
   23    HA   THR   4           HA       THR   4  -9.700   0.776   5.637
   24    HB   THR   4           HB       THR   4 -10.962   0.494   7.787
   25    HG1  THR   4           HG1      THR   4  -9.096  -0.489   7.987
   26   1HG2  THR   4          1HG2      THR   4 -11.913  -2.053   6.445
   27   2HG2  THR   4          2HG2      THR   4 -12.181  -1.623   8.134
   28   3HG2  THR   4          3HG2      THR   4 -12.924  -0.666   6.853
   29    H    ILE   5           H        ILE   5 -12.542  -0.936   4.451
   30    HA   ILE   5           HA       ILE   5 -11.215  -3.349   3.650
   31    HB   ILE   5           HB       ILE   5 -13.665  -2.010   2.461
   32   1HG1  ILE   5          1HG1      ILE   5 -13.676  -2.553   4.956
   33   2HG1  ILE   5          2HG1      ILE   5 -14.945  -3.324   4.005
   34   1HG2  ILE   5          1HG2      ILE   5 -12.346  -4.672   2.075
   35   2HG2  ILE   5          2HG2      ILE   5 -14.107  -4.589   2.029
   36   3HG2  ILE   5          3HG2      ILE   5 -13.150  -3.639   0.892
   37   1HD1  ILE   5          1HD1      ILE   5 -12.384  -4.816   4.245
   38   2HD1  ILE   5          2HD1      ILE   5 -13.364  -4.699   5.707
   39   3HD1  ILE   5          3HD1      ILE   5 -14.042  -5.417   4.247
   40    H    LYS   6           H        LYS   6 -11.104  -0.155   2.395
   41    HA   LYS   6           HA       LYS   6  -9.718  -1.201  -0.038
   42   1HB   LYS   6          1HB       LYS   6 -12.035  -0.148  -0.423
   43   2HB   LYS   6          2HB       LYS   6 -11.276   1.386   0.006
   44   1HG   LYS   6          1HG       LYS   6 -10.786   1.486  -2.217
   45   2HG   LYS   6          2HG       LYS   6  -9.463   0.405  -1.779
   46   1HD   LYS   6          1HD       LYS   6 -11.650  -1.300  -2.075
   47   2HD   LYS   6          2HD       LYS   6 -11.831  -0.140  -3.392
   48   1HE   LYS   6          1HE       LYS   6  -9.114  -1.319  -2.867
   49   2HE   LYS   6          2HE       LYS   6 -10.318  -2.269  -3.760
   50   1HZ   LYS   6          1HZ       LYS   6 -10.709  -0.059  -5.005
   51   2HZ   LYS   6          2HZ       LYS   6  -9.164   0.358  -4.435
   52   3HZ   LYS   6          3HZ       LYS   6  -9.361  -1.004  -5.425
   53    H    GLU   7           H        GLU   7  -9.843   1.190   2.530
   54    HA   GLU   7           HA       GLU   7  -7.551   2.689   1.482
   55   1HB   GLU   7          1HB       GLU   7  -9.561   3.093   3.481
   56   2HB   GLU   7          2HB       GLU   7  -7.979   3.236   4.250
   57   1HG   GLU   7          1HG       GLU   7  -7.511   5.172   3.173
   58   2HG   GLU   7          2HG       GLU   7  -8.101   4.550   1.632
   59    H    ASN   8           H        ASN   8  -8.118   0.069   3.747
   60    HA   ASN   8           HA       ASN   8  -5.567   0.190   5.071
   61   1HB   ASN   8          1HB       ASN   8  -7.730  -1.159   5.683
   62   2HB   ASN   8          2HB       ASN   8  -7.049  -2.388   4.618
   63   1HD2  ASN   8          2HD2      ASN   8  -5.390  -0.146   6.901
   64   2HD2  ASN   8          1HD2      ASN   8  -4.649  -1.379   7.803
   65    H    ILE   9           H        ILE   9  -6.757  -1.774   2.330
   66    HA   ILE   9           HA       ILE   9  -4.336  -3.147   1.801
   67    HB   ILE   9           HB       ILE   9  -6.427  -2.207  -0.187
   68   1HG1  ILE   9          1HG1      ILE   9  -7.334  -3.552   1.702
   69   2HG1  ILE   9          2HG1      ILE   9  -7.428  -4.419   0.169
   70   1HG2  ILE   9          1HG2      ILE   9  -4.292  -4.355  -0.312
   71   2HG2  ILE   9          2HG2      ILE   9  -5.606  -4.202  -1.479
   72   3HG2  ILE   9          3HG2      ILE   9  -4.407  -2.918  -1.327
   73   1HD1  ILE   9          1HD1      ILE   9  -4.887  -5.031   1.212
   74   2HD1  ILE   9          2HD1      ILE   9  -5.994  -5.140   2.581
   75   3HD1  ILE   9          3HD1      ILE   9  -6.285  -6.104   1.133
   76    H    ILE  10           H        ILE  10  -5.437   0.072   0.779
   77    HA   ILE  10           HA       ILE  10  -3.429   0.668  -1.109
   78    HB   ILE  10           HB       ILE  10  -4.822   2.427   0.928
   79   1HG1  ILE  10          1HG1      ILE  10  -5.100   2.174  -2.085
   80   2HG1  ILE  10          2HG1      ILE  10  -6.173   1.407  -0.913
   81   1HG2  ILE  10          1HG2      ILE  10  -2.612   3.390   0.328
   82   2HG2  ILE  10          2HG2      ILE  10  -3.039   3.267  -1.379
   83   3HG2  ILE  10          3HG2      ILE  10  -3.943   4.350  -0.320
   84   1HD1  ILE  10          1HD1      ILE  10  -6.448   3.816   0.050
   85   2HD1  ILE  10          2HD1      ILE  10  -5.827   4.335  -1.518
   86   3HD1  ILE  10          3HD1      ILE  10  -7.314   3.392  -1.426
   87    H    GLY  11           H        GLY  11  -3.354   0.980   2.442
   88   1HA   GLY  11          1HA       GLY  11  -0.639   1.971   2.524
   89   2HA   GLY  11          2HA       GLY  11  -1.523   1.288   3.892
   90    H    VAL  12           H        VAL  12  -1.986  -1.086   1.875
   91    HA   VAL  12           HA       VAL  12   0.476  -2.528   2.713
   92    HB   VAL  12           HB       VAL  12  -2.221  -3.472   1.703
   93   1HG1  VAL  12          1HG1      VAL  12   0.403  -4.829   1.844
   94   2HG1  VAL  12          2HG1      VAL  12  -0.932  -5.715   2.580
   95   3HG1  VAL  12          3HG1      VAL  12  -1.023  -5.230   0.887
   96   1HG2  VAL  12          1HG2      VAL  12  -1.181  -2.852   4.279
   97   2HG2  VAL  12          2HG2      VAL  12  -2.736  -3.588   3.894
   98   3HG2  VAL  12          3HG2      VAL  12  -1.328  -4.607   4.190
   99    H    SER  13           H        SER  13  -0.901  -1.023  -0.006
  100    HA   SER  13           HA       SER  13   0.926  -2.560  -1.812
  101   1HB   SER  13          1HB       SER  13  -0.627  -2.347  -3.576
  102   2HB   SER  13          2HB       SER  13  -1.642  -2.705  -2.182
  103    HG   SER  13           HG       SER  13  -2.119  -0.533  -2.009
  104    H    TYR  14           H        TYR  14  -0.357   0.605  -0.902
  105    HA   TYR  14           HA       TYR  14   1.245   2.037  -2.871
  106   1HB   TYR  14          1HB       TYR  14  -0.956   2.713  -1.435
  107   2HB   TYR  14          2HB       TYR  14   0.298   3.468  -0.451
  108    HD1  TYR  14           HD1      TYR  14  -1.077   3.248  -3.905
  109    HD2  TYR  14           HD2      TYR  14   1.436   5.426  -1.185
  110    HE1  TYR  14           HE1      TYR  14  -0.888   5.089  -5.554
  111    HE2  TYR  14           HE2      TYR  14   1.626   7.267  -2.836
  112    HH   TYR  14           HH       TYR  14   0.386   6.943  -6.097
  113    H    ASP  15           H        ASP  15   1.494   1.378   0.622
  114    HA   ASP  15           HA       ASP  15   3.871   2.900   1.071
  115   1HB   ASP  15          1HB       ASP  15   2.469   0.661   2.462
  116   2HB   ASP  15          2HB       ASP  15   4.147   0.968   2.907
  117    H    GLU  16           H        GLU  16   3.486  -0.616   0.484
  118    HA   GLU  16           HA       GLU  16   6.236  -1.249   0.315
  119   1HB   GLU  16          1HB       GLU  16   3.795  -2.580  -0.170
  120   2HB   GLU  16          2HB       GLU  16   4.720  -2.722  -1.666
  121   1HG   GLU  16          1HG       GLU  16   6.703  -3.403  -0.173
  122   2HG   GLU  16          2HG       GLU  16   5.511  -3.612   1.110
  123    H    TYR  17           H        TYR  17   4.000  -0.118  -2.218
  124    HA   TYR  17           HA       TYR  17   5.876  -0.191  -4.369
  125   1HB   TYR  17          1HB       TYR  17   3.921   0.324  -5.394
  126   2HB   TYR  17          2HB       TYR  17   3.200   0.847  -3.877
  127    HD1  TYR  17           HD1      TYR  17   5.771   2.025  -6.345
  128    HD2  TYR  17           HD2      TYR  17   2.546   3.078  -3.714
  129    HE1  TYR  17           HE1      TYR  17   5.929   4.384  -7.099
  130    HE2  TYR  17           HE2      TYR  17   2.700   5.437  -4.469
  131    HH   TYR  17           HH       TYR  17   4.805   6.382  -7.126
  132    H    ARG  18           H        ARG  18   4.813   2.588  -2.388
  133    HA   ARG  18           HA       ARG  18   6.802   4.405  -3.296
  134   1HB   ARG  18          1HB       ARG  18   4.673   4.581  -1.599
  135   2HB   ARG  18          2HB       ARG  18   6.008   4.612  -0.448
  136   1HG   ARG  18          1HG       ARG  18   7.051   6.378  -2.047
  137   2HG   ARG  18          2HG       ARG  18   5.418   6.529  -2.696
  138   1HD   ARG  18          1HD       ARG  18   5.768   6.611   0.274
  139   2HD   ARG  18          2HD       ARG  18   6.221   8.039  -0.658
  140    HE   ARG  18           HE       ARG  18   3.827   7.873  -1.615
  141   1HH1  ARG  18          1HH1      ARG  18   3.067   5.441  -0.028
  142   2HH1  ARG  18          2HH1      ARG  18   2.248   6.139   1.330
  143   1HH2  ARG  18          1HH2      ARG  18   3.512   9.321   0.798
  144   2HH2  ARG  18          2HH2      ARG  18   2.500   8.332   1.796
  145    H    TYR  19           H        TYR  19   7.058   1.614  -1.343
  146    HA   TYR  19           HA       TYR  19   9.577   2.489  -0.069
  147   1HB   TYR  19          1HB       TYR  19   7.618   0.247   0.266
  148   2HB   TYR  19          2HB       TYR  19   9.267   0.022   0.826
  149    HD1  TYR  19           HD1      TYR  19   7.369   3.213   0.732
  150    HD2  TYR  19           HD2      TYR  19   8.959   0.072   3.189
  151    HE1  TYR  19           HE1      TYR  19   6.852   4.540   2.765
  152    HE2  TYR  19           HE2      TYR  19   8.444   1.396   5.223
  153    HH   TYR  19           HH       TYR  19   7.850   3.444   5.979
  154    H    ARG  20           H        ARG  20   8.342   0.408  -2.612
  155    HA   ARG  20           HA       ARG  20  10.664  -1.243  -2.929
  156   1HB   ARG  20          1HB       ARG  20   8.170  -0.762  -4.342
  157   2HB   ARG  20          2HB       ARG  20   9.514  -0.967  -5.467
  158   1HG   ARG  20          1HG       ARG  20   9.800  -2.898  -3.376
  159   2HG   ARG  20          2HG       ARG  20   8.147  -2.986  -3.986
  160   1HD   ARG  20          1HD       ARG  20   9.725  -2.698  -6.279
  161   2HD   ARG  20          2HD       ARG  20  10.621  -3.827  -5.261
  162    HE   ARG  20           HE       ARG  20   7.927  -4.288  -6.398
  163   1HH1  ARG  20          1HH2      ARG  20  10.479  -6.047  -6.498
  164   2HH1  ARG  20          2HH2      ARG  20   9.999  -7.341  -5.451
  165   1HH2  ARG  20          1HH1      ARG  20   7.310  -5.610  -4.108
  166   2HH2  ARG  20          2HH1      ARG  20   8.206  -7.093  -4.095
  167    H    SER  21           H        SER  21  10.229   2.072  -3.506
  168    HA   SER  21           HA       SER  21  12.479   2.077  -5.466
  169   1HB   SER  21          1HB       SER  21  10.214   3.204  -6.030
  170   2HB   SER  21          2HB       SER  21  10.704   4.438  -4.874
  171    HG   SER  21           HG       SER  21  11.957   5.205  -6.362
  172    H    VAL  22           H        VAL  22  12.267   2.056  -2.357
  173    HA   VAL  22           HA       VAL  22  14.425   4.022  -1.961
  174    HB   VAL  22           HB       VAL  22  12.740   5.397  -1.241
  175   1HG1  VAL  22          1HG1      VAL  22  11.251   2.845  -0.800
  176   2HG1  VAL  22          2HG1      VAL  22  10.678   4.319  -0.017
  177   3HG1  VAL  22          3HG1      VAL  22  10.809   4.247  -1.775
  178   1HG2  VAL  22          1HG2      VAL  22  14.177   4.682   0.766
  179   2HG2  VAL  22          2HG2      VAL  22  12.623   5.424   1.144
  180   3HG2  VAL  22          3HG2      VAL  22  12.811   3.673   1.240
  181    H    ILE  23           H        ILE  23  12.462   1.369  -0.621
  182    HA   ILE  23           HA       ILE  23  14.530   0.762   1.384
  183    HB   ILE  23           HB       ILE  23  12.181  -1.006   0.725
  184   1HG1  ILE  23          1HG1      ILE  23  11.480   1.443   0.912
  185   2HG1  ILE  23          2HG1      ILE  23  10.739   0.353   2.078
  186   1HG2  ILE  23          1HG2      ILE  23  13.726  -0.313   3.240
  187   2HG2  ILE  23          2HG2      ILE  23  12.298  -1.348   3.210
  188   3HG2  ILE  23          3HG2      ILE  23  13.765  -1.843   2.365
  189   1HD1  ILE  23          1HD1      ILE  23  13.293   1.799   2.746
  190   2HD1  ILE  23          2HD1      ILE  23  11.731   2.592   2.950
  191   3HD1  ILE  23          3HD1      ILE  23  12.093   1.115   3.843
  192    H    LYS  24           H        LYS  24  12.901  -1.359  -1.002
  193    HA   LYS  24           HA       LYS  24  15.163  -3.148  -1.113
  194   1HB   LYS  24          1HB       LYS  24  12.557  -3.385  -1.827
  195   2HB   LYS  24          2HB       LYS  24  13.284  -3.099  -3.409
  196   1HG   LYS  24          1HG       LYS  24  14.987  -4.918  -2.061
  197   2HG   LYS  24          2HG       LYS  24  13.339  -5.499  -1.820
  198   1HD   LYS  24          1HD       LYS  24  13.636  -4.602  -4.537
  199   2HD   LYS  24          2HD       LYS  24  14.928  -5.742  -4.155
  200   1HE   LYS  24          1HE       LYS  24  12.972  -7.151  -3.072
  201   2HE   LYS  24          2HE       LYS  24  11.957  -6.191  -4.167
  202   1HZ   LYS  24          1HZ       LYS  24  13.745  -6.729  -5.896
  203   2HZ   LYS  24          2HZ       LYS  24  14.218  -7.972  -4.839
  204   3HZ   LYS  24          3HZ       LYS  24  12.651  -7.963  -5.486
  205    H    ALA  25           H        ALA  25  15.907  -3.653  -3.598
  206    HA   ALA  25           HA       ALA  25  17.670  -1.554  -4.319
  207   1HB   ALA  25          1HB       ALA  25  17.593  -4.099  -5.024
  208   2HB   ALA  25          2HB       ALA  25  16.683  -3.476  -6.400
  209   3HB   ALA  25          3HB       ALA  25  18.324  -2.906  -6.098
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1 -18.329   0.437  10.951
    2   2H    MET   1          2H        MET   1 -16.867   0.067  11.733
    3   3H    MET   1          3H        MET   1 -17.130   1.628  11.125
    4    HA   MET   1           HA       MET   1 -15.807   0.764   9.468
    5   1HB   MET   1          1HB       MET   1 -16.160  -1.485  10.860
    6   2HB   MET   1          2HB       MET   1 -17.232  -1.869   9.513
    7   1HG   MET   1          1HG       MET   1 -15.483  -1.733   7.929
    8   2HG   MET   1          2HG       MET   1 -14.433  -0.848   9.035
    9   1HE   MET   1          1HE       MET   1 -16.089  -3.763   7.871
   10   2HE   MET   1          2HE       MET   1 -14.513  -4.453   7.494
   11   3HE   MET   1          3HE       MET   1 -15.514  -5.193   8.741
   12    HA   PRO   2           HA       PRO   2 -19.726   1.602   7.188
   13   1HB   PRO   2          1HB       PRO   2 -18.839   3.901   6.001
   14   2HB   PRO   2          2HB       PRO   2 -19.581   3.870   7.613
   15   1HG   PRO   2          1HG       PRO   2 -16.714   4.051   6.854
   16   2HG   PRO   2          2HG       PRO   2 -17.582   4.826   8.187
   17   1HD   PRO   2          1HD       PRO   2 -15.980   2.618   8.472
   18   2HD   PRO   2          2HD       PRO   2 -17.314   3.034   9.571
   19    H    GLY   3           H        GLY   3 -16.631   0.634   6.494
   20   1HA   GLY   3          1HA       GLY   3 -16.726  -0.804   4.320
   21   2HA   GLY   3          2HA       GLY   3 -17.017   0.753   3.540
   22    H    THR   4           H        THR   4 -15.233   1.794   2.821
   23    HA   THR   4           HA       THR   4 -12.941   2.088   2.338
   24    HB   THR   4           HB       THR   4 -13.241   3.628   4.199
   25    HG1  THR   4           HG1      THR   4 -10.944   2.222   3.801
   26   1HG2  THR   4          1HG2      THR   4 -12.780   1.178   5.913
   27   2HG2  THR   4          2HG2      THR   4 -12.778   2.829   6.532
   28   3HG2  THR   4          3HG2      THR   4 -14.246   2.154   5.827
   29    H    ILE   5           H        ILE   5 -13.822  -0.706   2.755
   30    HA   ILE   5           HA       ILE   5 -11.718  -2.060   4.241
   31    HB   ILE   5           HB       ILE   5 -13.565  -3.213   2.130
   32   1HG1  ILE   5          1HG1      ILE   5 -13.997  -3.101   5.129
   33   2HG1  ILE   5          2HG1      ILE   5 -14.720  -1.947   4.008
   34   1HG2  ILE   5          1HG2      ILE   5 -11.444  -4.426   3.200
   35   2HG2  ILE   5          2HG2      ILE   5 -12.566  -4.683   4.536
   36   3HG2  ILE   5          3HG2      ILE   5 -12.953  -5.298   2.930
   37   1HD1  ILE   5          1HD1      ILE   5 -15.414  -4.245   2.777
   38   2HD1  ILE   5          2HD1      ILE   5 -15.358  -4.818   4.443
   39   3HD1  ILE   5          3HD1      ILE   5 -16.423  -3.482   4.005
   40    H    LYS   6           H        LYS   6 -11.965  -0.690   1.102
   41    HA   LYS   6           HA       LYS   6  -9.618  -2.284   0.173
   42   1HB   LYS   6          1HB       LYS   6 -10.204  -1.624  -2.072
   43   2HB   LYS   6          2HB       LYS   6 -11.679  -2.189  -1.289
   44   1HG   LYS   6          1HG       LYS   6 -12.073   0.280  -0.655
   45   2HG   LYS   6          2HG       LYS   6 -10.834   0.653  -1.854
   46   1HD   LYS   6          1HD       LYS   6 -12.428  -1.121  -3.223
   47   2HD   LYS   6          2HD       LYS   6 -13.609  -0.244  -2.248
   48   1HE   LYS   6          1HE       LYS   6 -12.360   1.899  -3.061
   49   2HE   LYS   6          2HE       LYS   6 -11.713   0.841  -4.330
   50   1HZ   LYS   6          1HZ       LYS   6 -14.506   0.412  -3.865
   51   2HZ   LYS   6          2HZ       LYS   6 -14.185   2.010  -4.334
   52   3HZ   LYS   6          3HZ       LYS   6 -13.690   0.722  -5.323
   53    H    GLU   7           H        GLU   7 -10.757   0.962   0.901
   54    HA   GLU   7           HA       GLU   7  -8.592   2.422  -0.262
   55   1HB   GLU   7          1HB       GLU   7 -10.389   3.000   2.107
   56   2HB   GLU   7          2HB       GLU   7  -9.182   4.148   1.524
   57   1HG   GLU   7          1HG       GLU   7 -10.643   3.205  -0.739
   58   2HG   GLU   7          2HG       GLU   7 -11.811   3.673   0.497
   59    H    ASN   8           H        ASN   8  -8.800   0.423   2.564
   60    HA   ASN   8           HA       ASN   8  -6.424   1.556   3.846
   61   1HB   ASN   8          1HB       ASN   8  -8.100   0.526   5.269
   62   2HB   ASN   8          2HB       ASN   8  -8.004  -0.981   4.360
   63   1HD2  ASN   8          2HD2      ASN   8  -5.617   1.238   5.940
   64   2HD2  ASN   8          1HD2      ASN   8  -4.750  -0.008   6.700
   65    H    ILE   9           H        ILE   9  -7.176  -1.540   2.201
   66    HA   ILE   9           HA       ILE   9  -4.481  -2.500   2.207
   67    HB   ILE   9           HB       ILE   9  -6.667  -3.103   0.193
   68   1HG1  ILE   9          1HG1      ILE   9  -7.484  -3.510   2.450
   69   2HG1  ILE   9          2HG1      ILE   9  -7.110  -5.061   1.698
   70   1HG2  ILE   9          1HG2      ILE   9  -3.961  -3.888   0.312
   71   2HG2  ILE   9          2HG2      ILE   9  -4.885  -5.274   0.889
   72   3HG2  ILE   9          3HG2      ILE   9  -5.227  -4.586  -0.699
   73   1HD1  ILE   9          1HD1      ILE   9  -4.762  -4.761   2.783
   74   2HD1  ILE   9          2HD1      ILE   9  -5.563  -3.573   3.811
   75   3HD1  ILE   9          3HD1      ILE   9  -6.106  -5.251   3.814
   76    H    ILE  10           H        ILE  10  -6.335  -0.707  -0.269
   77    HA   ILE  10           HA       ILE  10  -4.455  -0.619  -2.325
   78    HB   ILE  10           HB       ILE  10  -6.344   1.516  -1.312
   79   1HG1  ILE  10          1HG1      ILE  10  -6.441  -0.032  -3.901
   80   2HG1  ILE  10          2HG1      ILE  10  -7.099  -0.708  -2.411
   81   1HG2  ILE  10          1HG2      ILE  10  -4.466   1.544  -3.682
   82   2HG2  ILE  10          2HG2      ILE  10  -5.923   2.537  -3.627
   83   3HG2  ILE  10          3HG2      ILE  10  -4.651   2.770  -2.427
   84   1HD1  ILE  10          1HD1      ILE  10  -8.000   2.003  -2.661
   85   2HD1  ILE  10          2HD1      ILE  10  -8.333   1.158  -4.172
   86   3HD1  ILE  10          3HD1      ILE  10  -8.964   0.525  -2.651
   87    H    GLY  11           H        GLY  11  -4.373   1.006   0.778
   88   1HA   GLY  11          1HA       GLY  11  -2.120   2.728   0.033
   89   2HA   GLY  11          2HA       GLY  11  -2.803   2.556   1.653
   90    H    VAL  12           H        VAL  12  -2.613  -0.455   1.337
   91    HA   VAL  12           HA       VAL  12  -0.073  -0.806   2.623
   92    HB   VAL  12           HB       VAL  12  -1.932  -2.808   1.304
   93   1HG1  VAL  12          1HG1      VAL  12   0.712  -3.085   2.605
   94   2HG1  VAL  12          2HG1      VAL  12  -0.527  -4.201   3.180
   95   3HG1  VAL  12          3HG1      VAL  12  -0.102  -4.161   1.469
   96   1HG2  VAL  12          1HG2      VAL  12  -2.547  -1.329   3.415
   97   2HG2  VAL  12          2HG2      VAL  12  -2.942  -3.048   3.386
   98   3HG2  VAL  12          3HG2      VAL  12  -1.514  -2.484   4.257
   99    H    SER  13           H        SER  13  -1.143  -1.109  -0.727
  100    HA   SER  13           HA       SER  13   1.336  -2.318  -1.655
  101   1HB   SER  13          1HB       SER  13  -1.219  -1.565  -2.785
  102   2HB   SER  13          2HB       SER  13   0.093  -0.987  -3.811
  103    HG   SER  13           HG       SER  13   0.907  -3.295  -3.274
  104    H    TYR  14           H        TYR  14   0.120   0.954  -1.237
  105    HA   TYR  14           HA       TYR  14   1.965   2.372  -2.848
  106   1HB   TYR  14          1HB       TYR  14   0.475   3.021  -0.321
  107   2HB   TYR  14          2HB       TYR  14   1.676   4.154  -0.940
  108    HD1  TYR  14           HD1      TYR  14  -0.586   1.886  -2.857
  109    HD2  TYR  14           HD2      TYR  14   0.381   5.935  -1.800
  110    HE1  TYR  14           HE1      TYR  14  -2.221   2.712  -4.529
  111    HE2  TYR  14           HE2      TYR  14  -1.253   6.762  -3.473
  112    HH   TYR  14           HH       TYR  14  -3.443   5.723  -4.571
  113    H    ASP  15           H        ASP  15   2.261   1.294   0.541
  114    HA   ASP  15           HA       ASP  15   4.811   2.388   1.078
  115   1HB   ASP  15          1HB       ASP  15   3.336  -0.031   2.088
  116   2HB   ASP  15          2HB       ASP  15   5.001   0.257   2.593
  117    H    GLU  16           H        GLU  16   3.954  -0.764  -0.360
  118    HA   GLU  16           HA       GLU  16   6.527  -1.851  -0.660
  119   1HB   GLU  16          1HB       GLU  16   3.982  -2.492  -1.569
  120   2HB   GLU  16          2HB       GLU  16   4.874  -2.185  -3.059
  121   1HG   GLU  16          1HG       GLU  16   5.974  -4.137  -2.862
  122   2HG   GLU  16          2HG       GLU  16   6.512  -3.711  -1.237
  123    H    TYR  17           H        TYR  17   4.830   0.492  -2.726
  124    HA   TYR  17           HA       TYR  17   6.906   0.701  -4.699
  125   1HB   TYR  17          1HB       TYR  17   5.117   1.784  -5.603
  126   2HB   TYR  17          2HB       TYR  17   4.404   2.082  -4.023
  127    HD1  TYR  17           HD1      TYR  17   7.551   3.182  -5.760
  128    HD2  TYR  17           HD2      TYR  17   4.002   4.341  -3.636
  129    HE1  TYR  17           HE1      TYR  17   8.245   5.558  -5.897
  130    HE2  TYR  17           HE2      TYR  17   4.698   6.719  -3.772
  131    HH   TYR  17           HH       TYR  17   7.180   7.793  -5.820
  132    H    ARG  18           H        ARG  18   6.033   2.995  -2.096
  133    HA   ARG  18           HA       ARG  18   8.386   4.553  -2.230
  134   1HB   ARG  18          1HB       ARG  18   6.178   4.759  -0.755
  135   2HB   ARG  18          2HB       ARG  18   7.190   3.961   0.450
  136   1HG   ARG  18          1HG       ARG  18   8.396   5.835   0.806
  137   2HG   ARG  18          2HG       ARG  18   8.617   6.100  -0.924
  138   1HD   ARG  18          1HD       ARG  18   5.907   6.642  -0.456
  139   2HD   ARG  18          2HD       ARG  18   6.758   7.382   0.900
  140    HE   ARG  18           HE       ARG  18   7.446   7.971  -1.954
  141   1HH1  ARG  18          1HH1      ARG  18   8.156   8.641   1.264
  142   2HH1  ARG  18          2HH1      ARG  18   8.104  10.364   1.098
  143   1HH2  ARG  18          1HH2      ARG  18   6.884  10.279  -2.145
  144   2HH2  ARG  18          2HH2      ARG  18   7.385  11.291  -0.832
  145    H    TYR  19           H        TYR  19   7.881   1.340  -1.109
  146    HA   TYR  19           HA       TYR  19  10.347   1.233   0.477
  147   1HB   TYR  19          1HB       TYR  19   8.132  -0.664  -0.265
  148   2HB   TYR  19          2HB       TYR  19   9.623  -1.274   0.420
  149    HD1  TYR  19           HD1      TYR  19   9.810   1.601   2.050
  150    HD2  TYR  19           HD2      TYR  19   7.024  -1.660   1.759
  151    HE1  TYR  19           HE1      TYR  19   8.957   2.128   4.309
  152    HE2  TYR  19           HE2      TYR  19   6.173  -1.129   4.024
  153    HH   TYR  19           HH       TYR  19   6.290   1.426   5.476
  154    H    ARG  20           H        ARG  20   9.246   0.638  -2.755
  155    HA   ARG  20           HA       ARG  20  11.253  -1.255  -3.555
  156   1HB   ARG  20          1HB       ARG  20   9.192  -0.840  -4.857
  157   2HB   ARG  20          2HB       ARG  20   9.762   0.788  -5.228
  158   1HG   ARG  20          1HG       ARG  20  10.351  -0.536  -7.120
  159   2HG   ARG  20          2HG       ARG  20  11.847  -0.323  -6.209
  160   1HD   ARG  20          1HD       ARG  20  11.646  -2.664  -6.848
  161   2HD   ARG  20          2HD       ARG  20  11.433  -2.528  -5.103
  162    HE   ARG  20           HE       ARG  20   8.872  -2.367  -6.360
  163   1HH1  ARG  20          1HH1      ARG  20  10.972  -4.655  -7.356
  164   2HH1  ARG  20          2HH1      ARG  20  10.192  -6.012  -6.617
  165   1HH2  ARG  20          1HH2      ARG  20   8.055  -4.072  -4.693
  166   2HH2  ARG  20          2HH2      ARG  20   8.539  -5.682  -5.109
  167    H    SER  21           H        SER  21  11.398   2.143  -2.931
  168    HA   SER  21           HA       SER  21  13.971   2.328  -4.428
  169   1HB   SER  21          1HB       SER  21  12.036   4.049  -4.706
  170   2HB   SER  21          2HB       SER  21  12.573   4.662  -3.144
  171    HG   SER  21           HG       SER  21  14.437   4.177  -5.191
  172    H    VAL  22           H        VAL  22  13.275   1.210  -1.609
  173    HA   VAL  22           HA       VAL  22  15.628   2.393  -0.301
  174    HB   VAL  22           HB       VAL  22  14.132   3.789   0.720
  175   1HG1  VAL  22          1HG1      VAL  22  12.113   1.647   0.152
  176   2HG1  VAL  22          2HG1      VAL  22  11.729   2.989   1.230
  177   3HG1  VAL  22          3HG1      VAL  22  12.167   3.302  -0.450
  178   1HG2  VAL  22          1HG2      VAL  22  15.007   1.928   2.383
  179   2HG2  VAL  22          2HG2      VAL  22  13.799   3.096   2.923
  180   3HG2  VAL  22          3HG2      VAL  22  13.302   1.476   2.435
  181    H    ILE  23           H        ILE  23  12.965   0.015  -0.055
  182    HA   ILE  23           HA       ILE  23  14.507  -1.690   1.741
  183    HB   ILE  23           HB       ILE  23  12.053  -2.501   0.181
  184   1HG1  ILE  23          1HG1      ILE  23  11.738  -0.247   1.271
  185   2HG1  ILE  23          2HG1      ILE  23  10.688  -1.501   1.920
  186   1HG2  ILE  23          1HG2      ILE  23  13.679  -3.679   2.215
  187   2HG2  ILE  23          2HG2      ILE  23  12.107  -3.310   2.923
  188   3HG2  ILE  23          3HG2      ILE  23  12.209  -4.327   1.486
  189   1HD1  ILE  23          1HD1      ILE  23  13.360  -0.857   3.168
  190   2HD1  ILE  23          2HD1      ILE  23  11.884  -0.012   3.633
  191   3HD1  ILE  23          3HD1      ILE  23  12.016  -1.753   3.875
  192    H    LYS  24           H        LYS  24  13.132  -2.384  -1.502
  193    HA   LYS  24           HA       LYS  24  15.126  -4.483  -1.912
  194   1HB   LYS  24          1HB       LYS  24  12.826  -4.690  -2.814
  195   2HB   LYS  24          2HB       LYS  24  13.120  -3.297  -3.855
  196   1HG   LYS  24          1HG       LYS  24  15.292  -5.111  -4.209
  197   2HG   LYS  24          2HG       LYS  24  13.797  -6.036  -4.335
  198   1HD   LYS  24          1HD       LYS  24  13.470  -5.208  -6.400
  199   2HD   LYS  24          2HD       LYS  24  13.400  -3.580  -5.725
  200   1HE   LYS  24          1HE       LYS  24  15.718  -3.210  -6.069
  201   2HE   LYS  24          2HE       LYS  24  16.047  -4.943  -6.272
  202   1HZ   LYS  24          1HZ       LYS  24  14.200  -4.608  -8.131
  203   2HZ   LYS  24          2HZ       LYS  24  14.872  -3.048  -8.153
  204   3HZ   LYS  24          3HZ       LYS  24  15.856  -4.397  -8.450
  205    H    ALA  25           H        ALA  25  15.076  -1.119  -2.331
  206    HA   ALA  25           HA       ALA  25  17.421  -1.320  -4.175
  207   1HB   ALA  25          1HB       ALA  25  15.127  -0.334  -5.074
  208   2HB   ALA  25          2HB       ALA  25  15.667   1.109  -4.216
  209   3HB   ALA  25          3HB       ALA  25  16.659   0.426  -5.504
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1 -19.750   3.014   8.775
    2   2H    MET   1          2H        MET   1 -21.131   3.232   7.810
    3   3H    MET   1          3H        MET   1 -20.915   1.786   8.676
    4    HA   MET   1           HA       MET   1 -19.971   0.907   6.867
    5   1HB   MET   1          1HB       MET   1 -19.647   2.402   4.887
    6   2HB   MET   1          2HB       MET   1 -21.235   2.605   5.629
    7   1HG   MET   1          1HG       MET   1 -20.813   4.767   6.099
    8   2HG   MET   1          2HG       MET   1 -19.292   4.350   6.887
    9   1HE   MET   1          1HE       MET   1 -20.793   6.442   4.582
   10   2HE   MET   1          2HE       MET   1 -19.393   7.081   5.439
   11   3HE   MET   1          3HE       MET   1 -19.419   7.060   3.669
   12    HA   PRO   2           HA       PRO   2 -15.877   2.587   8.379
   13   1HB   PRO   2          1HB       PRO   2 -15.317   0.693  10.264
   14   2HB   PRO   2          2HB       PRO   2 -16.219   2.176  10.626
   15   1HG   PRO   2          1HG       PRO   2 -17.197  -0.592  10.292
   16   2HG   PRO   2          2HG       PRO   2 -17.828   0.719  11.296
   17   1HD   PRO   2          1HD       PRO   2 -18.875  -0.117   8.848
   18   2HD   PRO   2          2HD       PRO   2 -19.241   1.413   9.673
   19    H    GLY   3           H        GLY   3 -17.018   0.212   6.531
   20   1HA   GLY   3          1HA       GLY   3 -15.247  -1.943   6.504
   21   2HA   GLY   3          2HA       GLY   3 -15.961  -1.265   5.040
   22    H    THR   4           H        THR   4 -13.057  -1.975   6.427
   23    HA   THR   4           HA       THR   4 -11.670   0.281   5.034
   24    HB   THR   4           HB       THR   4 -11.101   0.185   7.403
   25    HG1  THR   4           HG1      THR   4  -8.985   0.243   7.078
   26   1HG2  THR   4          1HG2      THR   4 -10.493  -2.719   6.804
   27   2HG2  THR   4          2HG2      THR   4  -9.980  -1.902   8.281
   28   3HG2  THR   4          3HG2      THR   4 -11.698  -2.090   7.927
   29    H    ILE   5           H        ILE   5 -12.711  -2.018   3.643
   30    HA   ILE   5           HA       ILE   5 -10.430  -3.801   3.144
   31    HB   ILE   5           HB       ILE   5 -12.864  -3.698   1.391
   32   1HG1  ILE   5          1HG1      ILE   5 -13.837  -3.505   3.597
   33   2HG1  ILE   5          2HG1      ILE   5 -13.991  -5.190   3.099
   34   1HG2  ILE   5          1HG2      ILE   5 -10.858  -5.295   1.140
   35   2HG2  ILE   5          2HG2      ILE   5 -11.447  -6.072   2.609
   36   3HG2  ILE   5          3HG2      ILE   5 -12.462  -6.028   1.168
   37   1HD1  ILE   5          1HD1      ILE   5 -11.891  -5.706   4.358
   38   2HD1  ILE   5          2HD1      ILE   5 -11.873  -4.042   4.942
   39   3HD1  ILE   5          3HD1      ILE   5 -13.191  -5.122   5.397
   40    H    LYS   6           H        LYS   6 -11.470  -0.763   2.032
   41    HA   LYS   6           HA       LYS   6  -9.882  -1.086  -0.485
   42   1HB   LYS   6          1HB       LYS   6 -12.031   0.950   0.181
   43   2HB   LYS   6          2HB       LYS   6 -11.145   0.857  -1.342
   44   1HG   LYS   6          1HG       LYS   6 -12.464  -0.804  -2.108
   45   2HG   LYS   6          2HG       LYS   6 -12.298  -1.717  -0.607
   46   1HD   LYS   6          1HD       LYS   6 -14.045   0.730  -0.692
   47   2HD   LYS   6          2HD       LYS   6 -14.660  -0.815  -1.281
   48   1HE   LYS   6          1HE       LYS   6 -13.571  -1.622   1.076
   49   2HE   LYS   6          2HE       LYS   6 -14.060   0.032   1.501
   50   1HZ   LYS   6          1HZ       LYS   6 -16.193  -0.564   0.225
   51   2HZ   LYS   6          2HZ       LYS   6 -15.723  -2.178   0.470
   52   3HZ   LYS   6          3HZ       LYS   6 -16.006  -1.168   1.802
   53    H    GLU   7           H        GLU   7 -10.170   0.585   2.537
   54    HA   GLU   7           HA       GLU   7  -8.301   2.721   1.757
   55   1HB   GLU   7          1HB       GLU   7 -10.178   3.090   3.390
   56   2HB   GLU   7          2HB       GLU   7  -9.343   2.017   4.514
   57   1HG   GLU   7          1HG       GLU   7  -7.554   4.047   3.429
   58   2HG   GLU   7          2HG       GLU   7  -8.934   4.764   4.261
   59    H    ASN   8           H        ASN   8  -8.083  -0.490   2.840
   60    HA   ASN   8           HA       ASN   8  -5.454  -0.060   4.146
   61   1HB   ASN   8          1HB       ASN   8  -7.209  -1.632   5.109
   62   2HB   ASN   8          2HB       ASN   8  -6.908  -2.682   3.723
   63   1HD2  ASN   8          2HD2      ASN   8  -5.798  -1.861   6.868
   64   2HD2  ASN   8          1HD2      ASN   8  -4.336  -2.722   6.825
   65    H    ILE   9           H        ILE   9  -6.869  -1.960   1.468
   66    HA   ILE   9           HA       ILE   9  -4.386  -2.953   0.468
   67    HB   ILE   9           HB       ILE   9  -6.946  -2.351  -1.048
   68   1HG1  ILE   9          1HG1      ILE   9  -7.309  -3.852   0.864
   69   2HG1  ILE   9          2HG1      ILE   9  -7.413  -4.760  -0.645
   70   1HG2  ILE   9          1HG2      ILE   9  -4.442  -3.903  -1.693
   71   2HG2  ILE   9          2HG2      ILE   9  -5.981  -4.320  -2.446
   72   3HG2  ILE   9          3HG2      ILE   9  -5.289  -2.716  -2.685
   73   1HD1  ILE   9          1HD1      ILE   9  -4.985  -5.374  -0.352
   74   2HD1  ILE   9          2HD1      ILE   9  -5.050  -4.632   1.247
   75   3HD1  ILE   9          3HD1      ILE   9  -6.049  -6.040   0.886
   76    H    ILE  10           H        ILE  10  -6.123   0.076  -0.103
   77    HA   ILE  10           HA       ILE  10  -4.773   1.048  -2.349
   78    HB   ILE  10           HB       ILE  10  -6.614   2.155  -0.839
   79   1HG1  ILE  10          1HG1      ILE  10  -4.432   3.869  -2.061
   80   2HG1  ILE  10          2HG1      ILE  10  -5.677   3.037  -2.992
   81   1HG2  ILE  10          1HG2      ILE  10  -5.045   2.286   1.145
   82   2HG2  ILE  10          2HG2      ILE  10  -4.136   3.509   0.259
   83   3HG2  ILE  10          3HG2      ILE  10  -5.812   3.814   0.714
   84   1HD1  ILE  10          1HD1      ILE  10  -7.140   4.341  -1.040
   85   2HD1  ILE  10          2HD1      ILE  10  -5.864   5.500  -1.411
   86   3HD1  ILE  10          3HD1      ILE  10  -6.918   4.907  -2.696
   87    H    GLY  11           H        GLY  11  -3.641   0.821   0.985
   88   1HA   GLY  11          1HA       GLY  11  -1.175   2.287   0.476
   89   2HA   GLY  11          2HA       GLY  11  -1.533   1.337   1.920
   90    H    VAL  12           H        VAL  12  -2.133  -1.130   0.633
   91    HA   VAL  12           HA       VAL  12   0.414  -2.324   0.435
   92    HB   VAL  12           HB       VAL  12  -2.249  -3.159  -0.745
   93   1HG1  VAL  12          1HG1      VAL  12   0.469  -4.370  -0.921
   94   2HG1  VAL  12          2HG1      VAL  12  -0.873  -5.464  -0.590
   95   3HG1  VAL  12          3HG1      VAL  12  -0.882  -4.475  -2.048
   96   1HG2  VAL  12          1HG2      VAL  12  -1.869  -2.998   1.790
   97   2HG2  VAL  12          2HG2      VAL  12  -2.424  -4.557   1.181
   98   3HG2  VAL  12          3HG2      VAL  12  -0.725  -4.325   1.593
   99    H    SER  13           H        SER  13  -1.567  -0.752  -2.015
  100    HA   SER  13           HA       SER  13   0.403  -1.468  -4.117
  101   1HB   SER  13          1HB       SER  13  -2.413  -0.846  -4.078
  102   2HB   SER  13          2HB       SER  13  -1.577   0.270  -5.154
  103    HG   SER  13           HG       SER  13  -2.263  -1.804  -6.078
  104    H    TYR  14           H        TYR  14  -0.046   0.920  -1.819
  105    HA   TYR  14           HA       TYR  14   1.284   2.973  -3.532
  106   1HB   TYR  14          1HB       TYR  14  -0.728   3.115  -1.372
  107   2HB   TYR  14          2HB       TYR  14   0.555   4.320  -1.271
  108    HD1  TYR  14           HD1      TYR  14   1.230   5.209  -3.803
  109    HD2  TYR  14           HD2      TYR  14  -2.627   3.842  -2.500
  110    HE1  TYR  14           HE1      TYR  14   0.156   6.511  -5.619
  111    HE2  TYR  14           HE2      TYR  14  -3.703   5.144  -4.316
  112    HH   TYR  14           HH       TYR  14  -1.837   7.340  -6.353
  113    H    ASP  15           H        ASP  15   1.247   1.844  -0.123
  114    HA   ASP  15           HA       ASP  15   3.743   2.995   0.594
  115   1HB   ASP  15          1HB       ASP  15   1.932   1.803   2.068
  116   2HB   ASP  15          2HB       ASP  15   2.851   0.342   1.705
  117    H    GLU  16           H        GLU  16   2.989  -0.256  -0.677
  118    HA   GLU  16           HA       GLU  16   5.624  -1.294  -0.655
  119   1HB   GLU  16          1HB       GLU  16   3.159  -2.194  -1.523
  120   2HB   GLU  16          2HB       GLU  16   4.064  -2.037  -3.029
  121   1HG   GLU  16          1HG       GLU  16   4.518  -4.242  -2.241
  122   2HG   GLU  16          2HG       GLU  16   5.957  -3.296  -1.857
  123    H    TYR  17           H        TYR  17   3.914   0.492  -3.233
  124    HA   TYR  17           HA       TYR  17   6.024   0.527  -5.121
  125   1HB   TYR  17          1HB       TYR  17   4.479   1.720  -6.264
  126   2HB   TYR  17          2HB       TYR  17   3.476   1.748  -4.820
  127    HD1  TYR  17           HD1      TYR  17   6.469   3.492  -6.265
  128    HD2  TYR  17           HD2      TYR  17   2.895   3.821  -3.910
  129    HE1  TYR  17           HE1      TYR  17   6.814   5.942  -6.087
  130    HE2  TYR  17           HE2      TYR  17   3.237   6.271  -3.731
  131    HH   TYR  17           HH       TYR  17   4.554   8.065  -5.310
  132    H    ARG  18           H        ARG  18   5.176   2.983  -2.693
  133    HA   ARG  18           HA       ARG  18   7.481   4.614  -3.025
  134   1HB   ARG  18          1HB       ARG  18   5.290   4.967  -1.604
  135   2HB   ARG  18          2HB       ARG  18   6.229   4.203  -0.322
  136   1HG   ARG  18          1HG       ARG  18   7.688   5.963  -0.143
  137   2HG   ARG  18          2HG       ARG  18   7.586   6.359  -1.860
  138   1HD   ARG  18          1HD       ARG  18   5.045   6.730  -0.441
  139   2HD   ARG  18          2HD       ARG  18   6.339   7.758   0.174
  140    HE   ARG  18           HE       ARG  18   4.961   8.329  -2.170
  141   1HH1  ARG  18          1HH2      ARG  18   7.097  10.139  -1.313
  142   2HH1  ARG  18          2HH2      ARG  18   8.293   9.968  -2.556
  143   1HH2  ARG  18          1HH1      ARG  18   6.972   7.004  -3.783
  144   2HH2  ARG  18          2HH1      ARG  18   8.218   8.194  -3.958
  145    H    TYR  19           H        TYR  19   7.142   1.473  -1.724
  146    HA   TYR  19           HA       TYR  19   9.652   1.680  -0.157
  147   1HB   TYR  19          1HB       TYR  19   7.246  -0.058  -0.179
  148   2HB   TYR  19          2HB       TYR  19   8.769  -0.830   0.244
  149    HD1  TYR  19           HD1      TYR  19   7.397   2.602   0.865
  150    HD2  TYR  19           HD2      TYR  19   8.918  -1.041   2.550
  151    HE1  TYR  19           HE1      TYR  19   7.283   3.600   3.135
  152    HE2  TYR  19           HE2      TYR  19   8.806  -0.047   4.821
  153    HH   TYR  19           HH       TYR  19   7.788   1.693   6.011
  154    H    ARG  20           H        ARG  20   8.433   0.549  -3.177
  155    HA   ARG  20           HA       ARG  20  10.251  -1.653  -3.578
  156   1HB   ARG  20          1HB       ARG  20   8.149  -0.364  -5.038
  157   2HB   ARG  20          2HB       ARG  20   9.560  -0.502  -6.089
  158   1HG   ARG  20          1HG       ARG  20   9.366  -2.952  -4.674
  159   2HG   ARG  20          2HG       ARG  20   7.743  -2.570  -5.249
  160   1HD   ARG  20          1HD       ARG  20   8.447  -3.466  -7.213
  161   2HD   ARG  20          2HD       ARG  20   9.273  -1.924  -7.436
  162    HE   ARG  20           HE       ARG  20  10.678  -4.188  -6.090
  163   1HH1  ARG  20          1HH1      ARG  20  11.143  -1.221  -7.488
  164   2HH1  ARG  20          2HH1      ARG  20  12.388  -1.713  -8.588
  165   1HH2  ARG  20          1HH2      ARG  20  11.958  -5.099  -7.976
  166   2HH2  ARG  20          2HH2      ARG  20  12.850  -3.909  -8.864
  167    H    SER  21           H        SER  21  10.667   1.800  -3.838
  168    HA   SER  21           HA       SER  21  13.315   1.294  -5.135
  169   1HB   SER  21          1HB       SER  21  11.496   2.612  -6.431
  170   2HB   SER  21          2HB       SER  21  11.836   3.912  -5.295
  171    HG   SER  21           HG       SER  21  13.337   4.314  -6.748
  172    H    VAL  22           H        VAL  22  12.970   1.205  -2.313
  173    HA   VAL  22           HA       VAL  22  14.757   3.387  -1.530
  174    HB   VAL  22           HB       VAL  22  12.797   4.530  -1.082
  175   1HG1  VAL  22          1HG1      VAL  22  11.661   1.805  -0.612
  176   2HG1  VAL  22          2HG1      VAL  22  10.826   3.219   0.027
  177   3HG1  VAL  22          3HG1      VAL  22  11.105   3.068  -1.707
  178   1HG2  VAL  22          1HG2      VAL  22  14.190   3.659   1.090
  179   2HG2  VAL  22          2HG2      VAL  22  12.847   4.798   1.185
  180   3HG2  VAL  22          3HG2      VAL  22  12.569   3.082   1.483
  181    H    ILE  23           H        ILE  23  12.938   0.472  -0.595
  182    HA   ILE  23           HA       ILE  23  14.452   0.015   1.822
  183    HB   ILE  23           HB       ILE  23  12.984  -2.067   0.185
  184   1HG1  ILE  23          1HG1      ILE  23  11.641   0.055   0.644
  185   2HG1  ILE  23          2HG1      ILE  23  10.959  -1.430   1.299
  186   1HG2  ILE  23          1HG2      ILE  23  14.317  -1.999   2.757
  187   2HG2  ILE  23          2HG2      ILE  23  12.607  -2.384   2.956
  188   3HG2  ILE  23          3HG2      ILE  23  13.620  -3.376   1.905
  189   1HD1  ILE  23          1HD1      ILE  23  12.784   0.334   2.935
  190   2HD1  ILE  23          2HD1      ILE  23  11.042   0.602   2.877
  191   3HD1  ILE  23          3HD1      ILE  23  11.681  -0.918   3.504
  192    H    LYS  24           H        LYS  24  14.490  -1.763  -1.295
  193    HA   LYS  24           HA       LYS  24  17.338  -1.764  -1.518
  194   1HB   LYS  24          1HB       LYS  24  16.199  -3.741   0.298
  195   2HB   LYS  24          2HB       LYS  24  17.093  -4.502  -1.020
  196   1HG   LYS  24          1HG       LYS  24  18.634  -2.275  -0.190
  197   2HG   LYS  24          2HG       LYS  24  18.123  -3.104   1.281
  198   1HD   LYS  24          1HD       LYS  24  18.814  -5.222  -0.310
  199   2HD   LYS  24          2HD       LYS  24  19.973  -4.001  -0.838
  200   1HE   LYS  24          1HE       LYS  24  20.174  -3.632   1.827
  201   2HE   LYS  24          2HE       LYS  24  19.727  -5.350   1.807
  202   1HZ   LYS  24          1HZ       LYS  24  21.446  -5.244  -0.228
  203   2HZ   LYS  24          2HZ       LYS  24  22.115  -4.051   0.777
  204   3HZ   LYS  24          3HZ       LYS  24  21.905  -5.633   1.360
  205    H    ALA  25           H        ALA  25  15.069  -4.494  -1.935
  206    HA   ALA  25           HA       ALA  25  14.801  -3.939  -4.801
  207   1HB   ALA  25          1HB       ALA  25  16.755  -5.897  -3.754
  208   2HB   ALA  25          2HB       ALA  25  15.695  -6.514  -5.021
  209   3HB   ALA  25          3HB       ALA  25  16.697  -5.094  -5.324
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1 -18.992   0.702   0.032
    2   2H    MET   1          2H        MET   1 -17.459   0.965  -0.643
    3   3H    MET   1          3H        MET   1 -18.169  -0.577  -0.723
    4    HA   MET   1           HA       MET   1 -17.942  -0.910   1.613
    5   1HB   MET   1          1HB       MET   1 -15.484   0.352   0.352
    6   2HB   MET   1          2HB       MET   1 -15.473  -0.790   1.697
    7   1HG   MET   1          1HG       MET   1 -17.003  -2.116  -0.164
    8   2HG   MET   1          2HG       MET   1 -15.824  -1.289  -1.181
    9   1HE   MET   1          1HE       MET   1 -16.469  -2.883   1.969
   10   2HE   MET   1          2HE       MET   1 -15.807  -4.501   1.699
   11   3HE   MET   1          3HE       MET   1 -14.895  -3.316   2.630
   12    HA   PRO   2           HA       PRO   2 -18.416   3.272   3.386
   13   1HB   PRO   2          1HB       PRO   2 -20.051   2.470   5.427
   14   2HB   PRO   2          2HB       PRO   2 -20.653   2.839   3.798
   15   1HG   PRO   2          1HG       PRO   2 -20.120   0.204   5.066
   16   2HG   PRO   2          2HG       PRO   2 -21.417   0.684   3.962
   17   1HD   PRO   2          1HD       PRO   2 -19.206  -0.737   3.195
   18   2HD   PRO   2          2HD       PRO   2 -20.149   0.299   2.102
   19    H    GLY   3           H        GLY   3 -16.887   0.448   4.277
   20   1HA   GLY   3          1HA       GLY   3 -16.089   1.470   6.960
   21   2HA   GLY   3          2HA       GLY   3 -15.835  -0.179   6.387
   22    H    THR   4           H        THR   4 -13.561   0.196   7.073
   23    HA   THR   4           HA       THR   4 -12.044   1.670   4.955
   24    HB   THR   4           HB       THR   4 -11.944   2.808   7.179
   25    HG1  THR   4           HG1      THR   4  -9.422   1.682   6.807
   26   1HG2  THR   4          1HG2      THR   4 -11.751   0.174   8.123
   27   2HG2  THR   4          2HG2      THR   4 -10.163   0.881   8.415
   28   3HG2  THR   4          3HG2      THR   4 -11.605   1.649   9.079
   29    H    ILE   5           H        ILE   5 -12.827  -1.134   4.956
   30    HA   ILE   5           HA       ILE   5 -10.455  -2.671   5.732
   31    HB   ILE   5           HB       ILE   5 -12.749  -3.587   3.983
   32   1HG1  ILE   5          1HG1      ILE   5 -13.590  -2.557   6.092
   33   2HG1  ILE   5          2HG1      ILE   5 -13.869  -4.298   6.044
   34   1HG2  ILE   5          1HG2      ILE   5 -10.607  -4.909   5.635
   35   2HG2  ILE   5          2HG2      ILE   5 -12.117  -5.752   5.292
   36   3HG2  ILE   5          3HG2      ILE   5 -11.075  -5.234   3.966
   37   1HD1  ILE   5          1HD1      ILE   5 -11.261  -3.730   7.163
   38   2HD1  ILE   5          2HD1      ILE   5 -12.513  -2.859   8.049
   39   3HD1  ILE   5          3HD1      ILE   5 -12.608  -4.612   7.883
   40    H    LYS   6           H        LYS   6 -11.766  -1.217   2.807
   41    HA   LYS   6           HA       LYS   6  -9.751  -2.539   1.108
   42   1HB   LYS   6          1HB       LYS   6 -12.100  -2.026   0.321
   43   2HB   LYS   6          2HB       LYS   6 -11.671  -0.315   0.366
   44   1HG   LYS   6          1HG       LYS   6 -10.011  -0.578  -1.320
   45   2HG   LYS   6          2HG       LYS   6 -10.032  -2.336  -1.173
   46   1HD   LYS   6          1HD       LYS   6 -11.293  -1.893  -3.132
   47   2HD   LYS   6          2HD       LYS   6 -12.505  -2.188  -1.885
   48   1HE   LYS   6          1HE       LYS   6 -12.302   0.442  -1.529
   49   2HE   LYS   6          2HE       LYS   6 -11.756   0.389  -3.216
   50   1HZ   LYS   6          1HZ       LYS   6 -13.749  -1.263  -3.434
   51   2HZ   LYS   6          2HZ       LYS   6 -14.334  -0.429  -2.074
   52   3HZ   LYS   6          3HZ       LYS   6 -14.013   0.411  -3.515
   53    H    GLU   7           H        GLU   7 -10.275   0.555   2.689
   54    HA   GLU   7           HA       GLU   7  -8.189   1.948   1.220
   55   1HB   GLU   7          1HB       GLU   7  -9.844   2.511   3.658
   56   2HB   GLU   7          2HB       GLU   7  -8.406   3.486   3.359
   57   1HG   GLU   7          1HG       GLU   7  -9.782   3.251   0.882
   58   2HG   GLU   7          2HG       GLU   7 -10.980   3.678   2.104
   59    H    ASN   8           H        ASN   8  -8.388   0.472   4.465
   60    HA   ASN   8           HA       ASN   8  -5.833   1.055   5.423
   61   1HB   ASN   8          1HB       ASN   8  -7.565  -0.196   6.700
   62   2HB   ASN   8          2HB       ASN   8  -7.269  -1.607   5.684
   63   1HD2  ASN   8          2HD2      ASN   8  -6.568  -0.576   8.687
   64   2HD2  ASN   8          1HD2      ASN   8  -5.007  -1.213   8.887
   65    H    ILE   9           H        ILE   9  -6.793  -1.352   3.018
   66    HA   ILE   9           HA       ILE   9  -4.207  -2.630   2.866
   67    HB   ILE   9           HB       ILE   9  -6.305  -2.452   0.684
   68   1HG1  ILE   9          1HG1      ILE   9  -7.235  -3.241   2.874
   69   2HG1  ILE   9          2HG1      ILE   9  -7.250  -4.493   1.631
   70   1HG2  ILE   9          1HG2      ILE   9  -3.943  -3.331   0.197
   71   2HG2  ILE   9          2HG2      ILE   9  -4.335  -4.669   1.277
   72   3HG2  ILE   9          3HG2      ILE   9  -5.276  -4.416  -0.193
   73   1HD1  ILE   9          1HD1      ILE   9  -4.966  -4.201   3.590
   74   2HD1  ILE   9          2HD1      ILE   9  -6.379  -5.199   3.936
   75   3HD1  ILE   9          3HD1      ILE   9  -5.344  -5.582   2.559
   76    H    ILE  10           H        ILE  10  -5.674   0.175   1.298
   77    HA   ILE  10           HA       ILE  10  -3.727   0.524  -0.753
   78    HB   ILE  10           HB       ILE  10  -6.008   1.814  -0.163
   79   1HG1  ILE  10          1HG1      ILE  10  -3.598   2.916  -1.628
   80   2HG1  ILE  10          2HG1      ILE  10  -4.911   1.954  -2.308
   81   1HG2  ILE  10          1HG2      ILE  10  -4.841   2.898   1.847
   82   2HG2  ILE  10          2HG2      ILE  10  -3.914   3.830   0.674
   83   3HG2  ILE  10          3HG2      ILE  10  -5.668   3.996   0.742
   84   1HD1  ILE  10          1HD1      ILE  10  -6.262   4.051  -1.126
   85   2HD1  ILE  10          2HD1      ILE  10  -4.805   4.834  -1.738
   86   3HD1  ILE  10          3HD1      ILE  10  -5.857   3.944  -2.839
   87    H    GLY  11           H        GLY  11  -3.798   1.570   2.642
   88   1HA   GLY  11          1HA       GLY  11  -1.380   3.111   2.560
   89   2HA   GLY  11          2HA       GLY  11  -2.057   2.366   4.012
   90    H    VAL  12           H        VAL  12  -2.015  -0.276   2.474
   91    HA   VAL  12           HA       VAL  12   0.724  -1.020   3.284
   92    HB   VAL  12           HB       VAL  12  -1.684  -2.608   2.361
   93   1HG1  VAL  12          1HG1      VAL  12   1.067  -3.318   2.156
   94   2HG1  VAL  12          2HG1      VAL  12   0.379  -4.247   3.487
   95   3HG1  VAL  12          3HG1      VAL  12  -0.341  -4.344   1.880
   96   1HG2  VAL  12          1HG2      VAL  12  -1.487  -1.586   4.723
   97   2HG2  VAL  12          2HG2      VAL  12  -1.827  -3.314   4.622
   98   3HG2  VAL  12          3HG2      VAL  12  -0.194  -2.756   4.984
   99    H    SER  13           H        SER  13  -1.200  -0.580   0.386
  100    HA   SER  13           HA       SER  13   0.973  -1.683  -1.305
  101   1HB   SER  13          1HB       SER  13  -1.310  -2.308  -1.916
  102   2HB   SER  13          2HB       SER  13  -1.780  -0.612  -1.998
  103    HG   SER  13           HG       SER  13  -1.236  -0.917  -4.029
  104    H    TYR  14           H        TYR  14   0.314   1.201   0.171
  105    HA   TYR  14           HA       TYR  14   1.245   2.862  -2.112
  106   1HB   TYR  14          1HB       TYR  14  -0.698   3.381  -0.305
  107   2HB   TYR  14          2HB       TYR  14   0.678   4.103   0.527
  108    HD1  TYR  14           HD1      TYR  14  -0.146   3.815  -3.118
  109    HD2  TYR  14           HD2      TYR  14   0.576   6.421   0.219
  110    HE1  TYR  14           HE1      TYR  14  -0.259   5.778  -4.627
  111    HE2  TYR  14           HE2      TYR  14   0.464   8.386  -1.291
  112    HH   TYR  14           HH       TYR  14  -0.359   8.016  -4.727
  113    H    ASP  15           H        ASP  15   2.383   1.338   0.745
  114    HA   ASP  15           HA       ASP  15   4.714   3.164   0.958
  115   1HB   ASP  15          1HB       ASP  15   3.399   2.178   2.972
  116   2HB   ASP  15          2HB       ASP  15   4.271   0.686   2.619
  117    H    GLU  16           H        GLU  16   4.138  -0.369   0.632
  118    HA   GLU  16           HA       GLU  16   6.787  -1.130   0.072
  119   1HB   GLU  16          1HB       GLU  16   4.279  -2.375   0.002
  120   2HB   GLU  16          2HB       GLU  16   4.898  -2.537  -1.642
  121   1HG   GLU  16          1HG       GLU  16   7.135  -3.114  -0.180
  122   2HG   GLU  16          2HG       GLU  16   5.869  -3.764   0.862
  123    H    TYR  17           H        TYR  17   4.299   0.133  -2.126
  124    HA   TYR  17           HA       TYR  17   5.769  -0.121  -4.551
  125   1HB   TYR  17          1HB       TYR  17   3.844   0.756  -5.351
  126   2HB   TYR  17          2HB       TYR  17   3.308   1.023  -3.698
  127    HD1  TYR  17           HD1      TYR  17   5.532   2.567  -6.296
  128    HD2  TYR  17           HD2      TYR  17   2.851   3.207  -3.002
  129    HE1  TYR  17           HE1      TYR  17   5.680   5.017  -6.653
  130    HE2  TYR  17           HE2      TYR  17   2.997   5.658  -3.360
  131    HH   TYR  17           HH       TYR  17   5.025   7.017  -5.963
  132    H    ARG  18           H        ARG  18   5.421   2.700  -2.405
  133    HA   ARG  18           HA       ARG  18   7.464   4.257  -3.700
  134   1HB   ARG  18          1HB       ARG  18   5.553   4.786  -1.820
  135   2HB   ARG  18          2HB       ARG  18   6.999   4.725  -0.815
  136   1HG   ARG  18          1HG       ARG  18   8.075   6.267  -2.579
  137   2HG   ARG  18          2HG       ARG  18   6.431   6.539  -3.157
  138   1HD   ARG  18          1HD       ARG  18   7.153   6.869  -0.245
  139   2HD   ARG  18          2HD       ARG  18   7.338   8.190  -1.398
  140    HE   ARG  18           HE       ARG  18   4.752   7.417  -1.836
  141   1HH1  ARG  18          1HH1      ARG  18   5.815   6.730   1.205
  142   2HH1  ARG  18          2HH1      ARG  18   4.809   7.869   2.037
  143   1HH2  ARG  18          1HH2      ARG  18   3.777   9.477  -0.855
  144   2HH2  ARG  18          2HH2      ARG  18   3.655   9.422   0.872
  145    H    TYR  19           H        TYR  19   7.699   1.463  -1.849
  146    HA   TYR  19           HA       TYR  19  10.384   2.181  -0.799
  147   1HB   TYR  19          1HB       TYR  19   8.204   0.324  -0.003
  148   2HB   TYR  19          2HB       TYR  19   9.850  -0.224   0.274
  149    HD1  TYR  19           HD1      TYR  19   8.557   3.269   0.332
  150    HD2  TYR  19           HD2      TYR  19  10.084  -0.028   2.621
  151    HE1  TYR  19           HE1      TYR  19   8.704   4.725   2.337
  152    HE2  TYR  19           HE2      TYR  19  10.230   1.425   4.626
  153    HH   TYR  19           HH       TYR  19   9.956   3.470   5.434
  154    H    ARG  20           H        ARG  20   8.757   0.354  -3.223
  155    HA   ARG  20           HA       ARG  20  10.767  -1.717  -3.537
  156   1HB   ARG  20          1HB       ARG  20   8.300  -0.860  -4.919
  157   2HB   ARG  20          2HB       ARG  20   9.514  -1.598  -5.964
  158   1HG   ARG  20          1HG       ARG  20   8.982  -2.945  -3.361
  159   2HG   ARG  20          2HG       ARG  20   7.726  -3.065  -4.594
  160   1HD   ARG  20          1HD       ARG  20   9.826  -3.622  -6.148
  161   2HD   ARG  20          2HD       ARG  20  10.510  -4.149  -4.611
  162    HE   ARG  20           HE       ARG  20   7.971  -5.310  -4.713
  163   1HH1  ARG  20          1HH1      ARG  20  10.671  -5.151  -6.849
  164   2HH1  ARG  20          2HH1      ARG  20  10.520  -6.794  -7.376
  165   1HH2  ARG  20          1HH2      ARG  20   7.835  -7.497  -5.298
  166   2HH2  ARG  20          2HH2      ARG  20   8.915  -8.121  -6.500
  167    H    SER  21           H        SER  21  10.484   1.580  -4.601
  168    HA   SER  21           HA       SER  21  12.708   1.132  -6.534
  169   1HB   SER  21          1HB       SER  21  10.555   2.279  -7.295
  170   2HB   SER  21          2HB       SER  21  11.034   3.632  -6.276
  171    HG   SER  21           HG       SER  21  11.873   2.992  -8.729
  172    H    VAL  22           H        VAL  22  12.870   1.422  -3.533
  173    HA   VAL  22           HA       VAL  22  14.983   3.471  -3.540
  174    HB   VAL  22           HB       VAL  22  13.355   4.852  -2.718
  175   1HG1  VAL  22          1HG1      VAL  22  12.005   2.309  -2.050
  176   2HG1  VAL  22          2HG1      VAL  22  11.574   3.703  -1.059
  177   3HG1  VAL  22          3HG1      VAL  22  11.365   3.765  -2.809
  178   1HG2  VAL  22          1HG2      VAL  22  14.086   3.258  -0.246
  179   2HG2  VAL  22          2HG2      VAL  22  14.996   4.621  -0.901
  180   3HG2  VAL  22          3HG2      VAL  22  13.383   4.875  -0.235
  181    H    ILE  23           H        ILE  23  13.247   1.065  -1.520
  182    HA   ILE  23           HA       ILE  23  15.834   0.441  -0.187
  183    HB   ILE  23           HB       ILE  23  12.981  -0.338   0.487
  184   1HG1  ILE  23          1HG1      ILE  23  14.281   1.049   2.583
  185   2HG1  ILE  23          2HG1      ILE  23  14.646   1.941   1.105
  186   1HG2  ILE  23          1HG2      ILE  23  14.668  -2.091   1.074
  187   2HG2  ILE  23          2HG2      ILE  23  15.535  -0.887   2.027
  188   3HG2  ILE  23          3HG2      ILE  23  13.903  -1.370   2.491
  189   1HD1  ILE  23          1HD1      ILE  23  11.846   1.031   1.334
  190   2HD1  ILE  23          2HD1      ILE  23  12.331   2.231   2.532
  191   3HD1  ILE  23          3HD1      ILE  23  12.484   2.589   0.811
  192    H    LYS  24           H        LYS  24  13.042  -1.316  -1.595
  193    HA   LYS  24           HA       LYS  24  14.665  -3.742  -1.883
  194   1HB   LYS  24          1HB       LYS  24  11.817  -2.981  -2.300
  195   2HB   LYS  24          2HB       LYS  24  12.433  -4.304  -3.293
  196   1HG   LYS  24          1HG       LYS  24  13.455  -5.029  -0.899
  197   2HG   LYS  24          2HG       LYS  24  12.009  -4.182  -0.354
  198   1HD   LYS  24          1HD       LYS  24  10.799  -5.586  -2.200
  199   2HD   LYS  24          2HD       LYS  24  12.221  -6.625  -2.096
  200   1HE   LYS  24          1HE       LYS  24  11.146  -5.882   0.541
  201   2HE   LYS  24          2HE       LYS  24  10.016  -6.832  -0.445
  202   1HZ   LYS  24          1HZ       LYS  24  12.090  -8.213  -1.009
  203   2HZ   LYS  24          2HZ       LYS  24  12.768  -7.513   0.383
  204   3HZ   LYS  24          3HZ       LYS  24  11.357  -8.452   0.502
  205    H    ALA  25           H        ALA  25  16.244  -2.362  -3.265
  206    HA   ALA  25           HA       ALA  25  15.305  -2.236  -6.097
  207   1HB   ALA  25          1HB       ALA  25  17.010  -0.544  -4.476
  208   2HB   ALA  25          2HB       ALA  25  17.876  -1.102  -5.907
  209   3HB   ALA  25          3HB       ALA  25  16.348  -0.238  -6.082
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1 -12.077   7.728   4.598
    2   2H    MET   1          2H        MET   1 -11.687   8.012   2.969
    3   3H    MET   1          3H        MET   1 -13.311   7.878   3.440
    4    HA   MET   1           HA       MET   1 -13.044   5.773   2.646
    5   1HB   MET   1          1HB       MET   1 -10.245   6.616   3.075
    6   2HB   MET   1          2HB       MET   1 -10.513   4.878   3.218
    7   1HG   MET   1          1HG       MET   1 -10.555   4.737   0.974
    8   2HG   MET   1          2HG       MET   1 -12.005   5.740   0.969
    9   1HE   MET   1          1HE       MET   1 -11.887   6.929  -0.994
   10   2HE   MET   1          2HE       MET   1 -10.539   7.839  -1.673
   11   3HE   MET   1          3HE       MET   1 -10.470   6.079  -1.626
   12    HA   PRO   2           HA       PRO   2 -13.379   4.892   7.195
   13   1HB   PRO   2          1HB       PRO   2 -16.066   4.379   7.182
   14   2HB   PRO   2          2HB       PRO   2 -15.395   6.008   7.398
   15   1HG   PRO   2          1HG       PRO   2 -16.571   4.752   4.973
   16   2HG   PRO   2          2HG       PRO   2 -16.697   6.419   5.556
   17   1HD   PRO   2          1HD       PRO   2 -15.035   5.625   3.529
   18   2HD   PRO   2          2HD       PRO   2 -14.746   7.050   4.551
   19    H    GLY   3           H        GLY   3 -13.646   3.283   4.287
   20   1HA   GLY   3          1HA       GLY   3 -14.610   0.722   5.381
   21   2HA   GLY   3          2HA       GLY   3 -14.112   1.014   3.713
   22    H    THR   4           H        THR   4 -13.059   0.007   6.862
   23    HA   THR   4           HA       THR   4 -10.236   0.206   6.511
   24    HB   THR   4           HB       THR   4 -11.518  -0.383   8.650
   25    HG1  THR   4           HG1      THR   4  -9.690  -1.154   9.384
   26   1HG2  THR   4          1HG2      THR   4 -12.532  -2.423   7.164
   27   2HG2  THR   4          2HG2      THR   4 -11.210  -3.250   7.989
   28   3HG2  THR   4          3HG2      THR   4 -12.463  -2.437   8.927
   29    H    ILE   5           H        ILE   5 -12.589  -2.054   5.248
   30    HA   ILE   5           HA       ILE   5 -10.813  -4.185   4.560
   31    HB   ILE   5           HB       ILE   5 -13.283  -3.310   3.034
   32   1HG1  ILE   5          1HG1      ILE   5 -13.896  -5.430   4.778
   33   2HG1  ILE   5          2HG1      ILE   5 -12.965  -4.289   5.749
   34   1HG2  ILE   5          1HG2      ILE   5 -11.815  -5.044   1.979
   35   2HG2  ILE   5          2HG2      ILE   5 -12.022  -6.041   3.419
   36   3HG2  ILE   5          3HG2      ILE   5 -13.412  -5.660   2.404
   37   1HD1  ILE   5          1HD1      ILE   5 -14.610  -2.588   4.383
   38   2HD1  ILE   5          2HD1      ILE   5 -15.656  -3.996   4.563
   39   3HD1  ILE   5          3HD1      ILE   5 -14.963  -3.224   5.990
   40    H    LYS   6           H        LYS   6 -11.284  -1.031   3.204
   41    HA   LYS   6           HA       LYS   6  -9.754  -1.800   0.763
   42   1HB   LYS   6          1HB       LYS   6 -11.490   0.566   1.472
   43   2HB   LYS   6          2HB       LYS   6 -10.365   0.636   0.115
   44   1HG   LYS   6          1HG       LYS   6 -11.977  -1.820   0.166
   45   2HG   LYS   6          2HG       LYS   6 -12.940  -0.354  -0.012
   46   1HD   LYS   6          1HD       LYS   6 -11.481   0.359  -1.890
   47   2HD   LYS   6          2HD       LYS   6 -10.572  -1.145  -1.735
   48   1HE   LYS   6          1HE       LYS   6 -12.734  -2.403  -2.118
   49   2HE   LYS   6          2HE       LYS   6 -13.496  -0.845  -2.498
   50   1HZ   LYS   6          1HZ       LYS   6 -10.937  -1.564  -3.760
   51   2HZ   LYS   6          2HZ       LYS   6 -12.380  -2.203  -4.389
   52   3HZ   LYS   6          3HZ       LYS   6 -12.151  -0.520  -4.320
   53    H    GLU   7           H        GLU   7  -9.732   0.469   3.504
   54    HA   GLU   7           HA       GLU   7  -7.264   1.759   2.771
   55   1HB   GLU   7          1HB       GLU   7  -8.715   1.468   5.413
   56   2HB   GLU   7          2HB       GLU   7  -7.238   2.415   5.229
   57   1HG   GLU   7          1HG       GLU   7  -9.035   3.133   3.118
   58   2HG   GLU   7          2HG       GLU   7  -9.910   3.216   4.648
   59    H    ASN   8           H        ASN   8  -7.937  -1.362   3.935
   60    HA   ASN   8           HA       ASN   8  -5.346  -1.687   5.307
   61   1HB   ASN   8          1HB       ASN   8  -7.332  -2.877   6.168
   62   2HB   ASN   8          2HB       ASN   8  -7.498  -3.717   4.625
   63   1HD2  ASN   8          2HD2      ASN   8  -6.715  -4.623   7.524
   64   2HD2  ASN   8          1HD2      ASN   8  -5.330  -5.569   7.265
   65    H    ILE   9           H        ILE   9  -6.964  -3.036   2.414
   66    HA   ILE   9           HA       ILE   9  -4.578  -4.379   1.483
   67    HB   ILE   9           HB       ILE   9  -6.946  -3.505  -0.192
   68   1HG1  ILE   9          1HG1      ILE   9  -7.659  -4.700   1.893
   69   2HG1  ILE   9          2HG1      ILE   9  -8.010  -5.614   0.426
   70   1HG2  ILE   9          1HG2      ILE   9  -4.905  -4.414  -1.339
   71   2HG2  ILE   9          2HG2      ILE   9  -5.101  -5.902  -0.413
   72   3HG2  ILE   9          3HG2      ILE   9  -6.341  -5.412  -1.568
   73   1HD1  ILE   9          1HD1      ILE   9  -5.354  -6.266   1.272
   74   2HD1  ILE   9          2HD1      ILE   9  -6.431  -6.423   2.659
   75   3HD1  ILE   9          3HD1      ILE   9  -6.762  -7.324   1.180
   76    H    ILE  10           H        ILE  10  -5.696  -1.123   1.369
   77    HA   ILE  10           HA       ILE  10  -4.357  -0.268  -1.023
   78    HB   ILE  10           HB       ILE  10  -5.509   1.069   1.385
   79   1HG1  ILE  10          1HG1      ILE  10  -6.897   0.493  -0.551
   80   2HG1  ILE  10          2HG1      ILE  10  -6.741   2.237  -0.416
   81   1HG2  ILE  10          1HG2      ILE  10  -3.472   2.265  -0.490
   82   2HG2  ILE  10          2HG2      ILE  10  -4.756   3.270   0.181
   83   3HG2  ILE  10          3HG2      ILE  10  -3.616   2.461   1.257
   84   1HD1  ILE  10          1HD1      ILE  10  -4.557   1.501  -1.974
   85   2HD1  ILE  10          2HD1      ILE  10  -5.871   0.486  -2.566
   86   3HD1  ILE  10          3HD1      ILE  10  -6.047   2.240  -2.559
   87    H    GLY  11           H        GLY  11  -3.409   0.115   2.416
   88   1HA   GLY  11          1HA       GLY  11  -0.797   1.081   1.937
   89   2HA   GLY  11          2HA       GLY  11  -1.268   0.183   3.382
   90    H    VAL  12           H        VAL  12  -2.135  -2.072   1.478
   91    HA   VAL  12           HA       VAL  12   0.490  -3.412   1.467
   92    HB   VAL  12           HB       VAL  12  -2.301  -4.379   0.775
   93   1HG1  VAL  12          1HG1      VAL  12  -0.361  -5.516  -0.450
   94   2HG1  VAL  12          2HG1      VAL  12   0.184  -6.066   1.135
   95   3HG1  VAL  12          3HG1      VAL  12  -1.390  -6.570   0.519
   96   1HG2  VAL  12          1HG2      VAL  12  -0.857  -4.030   3.236
   97   2HG2  VAL  12          2HG2      VAL  12  -2.483  -4.674   3.001
   98   3HG2  VAL  12          3HG2      VAL  12  -1.089  -5.755   2.953
   99    H    SER  13           H        SER  13  -1.633  -1.823  -0.765
  100    HA   SER  13           HA       SER  13   0.029  -2.852  -3.032
  101   1HB   SER  13          1HB       SER  13  -1.833  -2.947  -4.355
  102   2HB   SER  13          2HB       SER  13  -2.667  -3.077  -2.809
  103    HG   SER  13           HG       SER  13  -3.606  -1.418  -3.953
  104    H    TYR  14           H        TYR  14  -0.269  -0.249  -1.056
  105    HA   TYR  14           HA       TYR  14   0.532   1.629  -3.242
  106   1HB   TYR  14          1HB       TYR  14  -1.592   1.868  -1.302
  107   2HB   TYR  14          2HB       TYR  14  -0.404   3.145  -1.046
  108    HD1  TYR  14           HD1      TYR  14  -2.662   1.587  -3.547
  109    HD2  TYR  14           HD2      TYR  14  -0.102   4.914  -2.638
  110    HE1  TYR  14           HE1      TYR  14  -3.536   2.799  -5.525
  111    HE2  TYR  14           HE2      TYR  14  -0.976   6.126  -4.617
  112    HH   TYR  14           HH       TYR  14  -3.733   5.006  -6.387
  113    H    ASP  15           H        ASP  15   0.980   0.611   0.119
  114    HA   ASP  15           HA       ASP  15   3.149   2.496   0.605
  115   1HB   ASP  15          1HB       ASP  15   1.549   0.966   2.228
  116   2HB   ASP  15          2HB       ASP  15   3.057   0.052   2.258
  117    H    GLU  16           H        GLU  16   2.906  -0.922  -0.326
  118    HA   GLU  16           HA       GLU  16   5.658  -1.593  -0.138
  119   1HB   GLU  16          1HB       GLU  16   3.282  -2.766  -1.213
  120   2HB   GLU  16          2HB       GLU  16   4.542  -2.865  -2.444
  121   1HG   GLU  16          1HG       GLU  16   5.836  -3.509  -0.040
  122   2HG   GLU  16          2HG       GLU  16   4.289  -4.353   0.037
  123    H    TYR  17           H        TYR  17   3.826  -0.134  -2.834
  124    HA   TYR  17           HA       TYR  17   6.031  -0.045  -4.658
  125   1HB   TYR  17          1HB       TYR  17   4.365   0.688  -5.999
  126   2HB   TYR  17          2HB       TYR  17   3.303   0.828  -4.604
  127    HD1  TYR  17           HD1      TYR  17   6.054   2.650  -6.376
  128    HD2  TYR  17           HD2      TYR  17   2.525   2.941  -3.948
  129    HE1  TYR  17           HE1      TYR  17   6.109   5.119  -6.596
  130    HE2  TYR  17           HE2      TYR  17   2.580   5.412  -4.164
  131    HH   TYR  17           HH       TYR  17   3.683   7.162  -4.960
  132    H    ARG  18           H        ARG  18   4.635   2.578  -2.665
  133    HA   ARG  18           HA       ARG  18   6.698   4.466  -3.049
  134   1HB   ARG  18          1HB       ARG  18   4.399   4.543  -1.681
  135   2HB   ARG  18          2HB       ARG  18   5.479   4.212  -0.327
  136   1HG   ARG  18          1HG       ARG  18   6.751   6.186  -0.722
  137   2HG   ARG  18          2HG       ARG  18   6.029   6.419  -2.315
  138   1HD   ARG  18          1HD       ARG  18   4.007   6.284  -0.221
  139   2HD   ARG  18          2HD       ARG  18   5.161   7.585   0.066
  140    HE   ARG  18           HE       ARG  18   4.615   8.122  -2.472
  141   1HH1  ARG  18          1HH1      ARG  18   2.315   6.119  -2.321
  142   2HH1  ARG  18          2HH1      ARG  18   0.979   7.174  -1.994
  143   1HH2  ARG  18          1HH2      ARG  18   2.977   9.846  -1.053
  144   2HH2  ARG  18          2HH2      ARG  18   1.355   9.285  -1.277
  145    H    TYR  19           H        TYR  19   6.664   1.501  -1.297
  146    HA   TYR  19           HA       TYR  19   9.046   2.170   0.298
  147   1HB   TYR  19          1HB       TYR  19   7.039  -0.037   0.157
  148   2HB   TYR  19          2HB       TYR  19   8.625  -0.410   0.814
  149    HD1  TYR  19           HD1      TYR  19   7.151   2.953   1.050
  150    HD2  TYR  19           HD2      TYR  19   7.811  -0.769   3.091
  151    HE1  TYR  19           HE1      TYR  19   6.503   4.015   3.198
  152    HE2  TYR  19           HE2      TYR  19   7.163   0.292   5.239
  153    HH   TYR  19           HH       TYR  19   6.823   2.306   6.264
  154    H    ARG  20           H        ARG  20   8.281   0.899  -2.771
  155    HA   ARG  20           HA       ARG  20  10.480  -0.980  -3.014
  156   1HB   ARG  20          1HB       ARG  20   8.620  -1.283  -4.490
  157   2HB   ARG  20          2HB       ARG  20   8.694   0.392  -5.036
  158   1HG   ARG  20          1HG       ARG  20  10.502   0.010  -6.417
  159   2HG   ARG  20          2HG       ARG  20  11.140  -1.282  -5.400
  160   1HD   ARG  20          1HD       ARG  20   9.958  -2.883  -6.492
  161   2HD   ARG  20          2HD       ARG  20   8.508  -1.884  -6.571
  162    HE   ARG  20           HE       ARG  20   9.136  -1.518  -8.805
  163   1HH1  ARG  20          1HH1      ARG  20  11.771  -3.109  -7.729
  164   2HH1  ARG  20          2HH1      ARG  20  12.959  -2.156  -8.555
  165   1HH2  ARG  20          1HH2      ARG  20  10.719   0.329  -9.467
  166   2HH2  ARG  20          2HH2      ARG  20  12.364  -0.210  -9.537
  167    H    SER  21           H        SER  21  10.045   2.462  -3.741
  168    HA   SER  21           HA       SER  21  12.741   2.589  -4.924
  169   1HB   SER  21          1HB       SER  21  10.947   3.926  -5.950
  170   2HB   SER  21          2HB       SER  21  10.697   4.767  -4.423
  171    HG   SER  21           HG       SER  21  12.672   5.708  -4.620
  172    H    VAL  22           H        VAL  22  12.128   2.039  -1.987
  173    HA   VAL  22           HA       VAL  22  14.158   3.881  -0.933
  174    HB   VAL  22           HB       VAL  22  12.352   5.157  -0.299
  175   1HG1  VAL  22          1HG1      VAL  22  10.809   2.575  -0.141
  176   2HG1  VAL  22          2HG1      VAL  22  10.144   4.118   0.388
  177   3HG1  VAL  22          3HG1      VAL  22  10.604   3.888  -1.299
  178   1HG2  VAL  22          1HG2      VAL  22  13.525   3.759   1.731
  179   2HG2  VAL  22          2HG2      VAL  22  12.348   5.048   1.983
  180   3HG2  VAL  22          3HG2      VAL  22  11.826   3.364   1.988
  181    H    ILE  23           H        ILE  23  11.958   1.142  -0.267
  182    HA   ILE  23           HA       ILE  23  13.849   0.117   1.765
  183    HB   ILE  23           HB       ILE  23  11.346  -1.289   0.864
  184   1HG1  ILE  23          1HG1      ILE  23  10.939   1.213   1.284
  185   2HG1  ILE  23          2HG1      ILE  23   9.985   0.094   2.249
  186   1HG2  ILE  23          1HG2      ILE  23  12.847  -1.022   3.485
  187   2HG2  ILE  23          2HG2      ILE  23  11.321  -1.886   3.302
  188   3HG2  ILE  23          3HG2      ILE  23  12.762  -2.453   2.458
  189   1HD1  ILE  23          1HD1      ILE  23  12.626   1.123   3.266
  190   2HD1  ILE  23          2HD1      ILE  23  11.155   2.074   3.464
  191   3HD1  ILE  23          3HD1      ILE  23  11.270   0.469   4.185
  192    H    LYS  24           H        LYS  24  12.107  -1.379  -0.991
  193    HA   LYS  24           HA       LYS  24  12.834  -3.000  -2.525
  194   1HB   LYS  24          1HB       LYS  24  14.605  -1.142  -2.842
  195   2HB   LYS  24          2HB       LYS  24  15.659  -2.164  -1.864
  196   1HG   LYS  24          1HG       LYS  24  14.463  -3.880  -3.759
  197   2HG   LYS  24          2HG       LYS  24  14.950  -2.439  -4.652
  198   1HD   LYS  24          1HD       LYS  24  17.082  -2.972  -2.899
  199   2HD   LYS  24          2HD       LYS  24  16.607  -4.545  -3.544
  200   1HE   LYS  24          1HE       LYS  24  16.577  -2.607  -5.681
  201   2HE   LYS  24          2HE       LYS  24  18.150  -2.564  -4.860
  202   1HZ   LYS  24          1HZ       LYS  24  16.869  -5.156  -5.393
  203   2HZ   LYS  24          2HZ       LYS  24  17.688  -4.372  -6.658
  204   3HZ   LYS  24          3HZ       LYS  24  18.519  -4.784  -5.239
  205    H    ALA  25           H        ALA  25  12.439  -3.760   0.225
  206    HA   ALA  25           HA       ALA  25  14.434  -5.241   1.472
  207   1HB   ALA  25          1HB       ALA  25  11.496  -5.385   1.333
  208   2HB   ALA  25          2HB       ALA  25  12.268  -6.920   1.733
  209   3HB   ALA  25          3HB       ALA  25  12.562  -5.498   2.734
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1 -18.598   0.637   1.929
    2   2H    MET   1          2H        MET   1 -18.680   2.266   1.456
    3   3H    MET   1          3H        MET   1 -17.676   1.190   0.615
    4    HA   MET   1           HA       MET   1 -16.012   1.331   2.117
    5   1HB   MET   1          1HB       MET   1 -16.433   3.615   1.507
    6   2HB   MET   1          2HB       MET   1 -17.811   3.718   2.604
    7   1HG   MET   1          1HG       MET   1 -16.412   3.646   4.533
    8   2HG   MET   1          2HG       MET   1 -15.011   3.145   3.586
    9   1HE   MET   1          1HE       MET   1 -16.903   5.484   5.241
   10   2HE   MET   1          2HE       MET   1 -16.246   7.089   4.927
   11   3HE   MET   1          3HE       MET   1 -17.565   6.459   3.930
   12    HA   PRO   2           HA       PRO   2 -18.050  -0.472   5.779
   13   1HB   PRO   2          1HB       PRO   2 -16.126  -2.369   6.198
   14   2HB   PRO   2          2HB       PRO   2 -17.467  -2.589   5.057
   15   1HG   PRO   2          1HG       PRO   2 -14.634  -1.860   4.529
   16   2HG   PRO   2          2HG       PRO   2 -15.730  -2.889   3.593
   17   1HD   PRO   2          1HD       PRO   2 -15.120  -0.300   2.933
   18   2HD   PRO   2          2HD       PRO   2 -16.621  -1.123   2.458
   19    H    GLY   3           H        GLY   3 -15.330   1.366   5.228
   20   1HA   GLY   3          1HA       GLY   3 -14.850   2.771   7.360
   21   2HA   GLY   3          2HA       GLY   3 -14.423   1.214   8.069
   22    H    THR   4           H        THR   4 -12.326   0.578   7.872
   23    HA   THR   4           HA       THR   4 -10.631   2.056   5.900
   24    HB   THR   4           HB       THR   4 -10.095   2.372   8.340
   25    HG1  THR   4           HG1      THR   4  -8.537   2.198   6.435
   26   1HG2  THR   4          1HG2      THR   4 -10.324  -0.502   8.268
   27   2HG2  THR   4          2HG2      THR   4  -8.717  -0.044   8.834
   28   3HG2  THR   4          3HG2      THR   4 -10.150   0.559   9.666
   29    H    ILE   5           H        ILE   5 -11.928  -0.995   6.680
   30    HA   ILE   5           HA       ILE   5  -9.923  -2.819   5.949
   31    HB   ILE   5           HB       ILE   5 -12.803  -3.064   5.051
   32   1HG1  ILE   5          1HG1      ILE   5 -12.575  -4.335   7.511
   33   2HG1  ILE   5          2HG1      ILE   5 -11.679  -2.833   7.748
   34   1HG2  ILE   5          1HG2      ILE   5 -10.478  -4.871   5.430
   35   2HG2  ILE   5          2HG2      ILE   5 -12.033  -5.488   5.991
   36   3HG2  ILE   5          3HG2      ILE   5 -11.833  -4.999   4.308
   37   1HD1  ILE   5          1HD1      ILE   5 -14.175  -2.425   6.276
   38   2HD1  ILE   5          2HD1      ILE   5 -14.441  -3.108   7.879
   39   3HD1  ILE   5          3HD1      ILE   5 -13.566  -1.586   7.704
   40    H    LYS   6           H        LYS   6 -11.568  -0.491   3.984
   41    HA   LYS   6           HA       LYS   6 -10.727  -1.824   1.476
   42   1HB   LYS   6          1HB       LYS   6 -12.963  -0.451   1.981
   43   2HB   LYS   6          2HB       LYS   6 -11.942   0.905   1.499
   44   1HG   LYS   6          1HG       LYS   6 -11.376  -0.286  -0.602
   45   2HG   LYS   6          2HG       LYS   6 -12.448  -1.605  -0.128
   46   1HD   LYS   6          1HD       LYS   6 -13.678  -0.148  -1.619
   47   2HD   LYS   6          2HD       LYS   6 -14.325   0.069   0.008
   48   1HE   LYS   6          1HE       LYS   6 -13.352   2.185   0.257
   49   2HE   LYS   6          2HE       LYS   6 -12.100   1.857  -0.957
   50   1HZ   LYS   6          1HZ       LYS   6 -14.097   1.560  -2.531
   51   2HZ   LYS   6          2HZ       LYS   6 -14.962   2.444  -1.366
   52   3HZ   LYS   6          3HZ       LYS   6 -13.613   3.136  -2.131
   53    H    GLU   7           H        GLU   7 -10.391   1.469   2.858
   54    HA   GLU   7           HA       GLU   7  -8.299   2.291   1.126
   55   1HB   GLU   7          1HB       GLU   7  -9.626   3.800   2.630
   56   2HB   GLU   7          2HB       GLU   7  -8.713   3.166   3.999
   57   1HG   GLU   7          1HG       GLU   7  -6.814   4.303   3.434
   58   2HG   GLU   7          2HG       GLU   7  -7.093   4.109   1.702
   59    H    ASN   8           H        ASN   8  -8.246   0.238   3.947
   60    HA   ASN   8           HA       ASN   8  -5.489   0.499   4.640
   61   1HB   ASN   8          1HB       ASN   8  -7.384  -0.763   5.883
   62   2HB   ASN   8          2HB       ASN   8  -6.991  -2.110   4.814
   63   1HD2  ASN   8          2HD2      ASN   8  -5.403   0.171   7.108
   64   2HD2  ASN   8          1HD2      ASN   8  -4.210  -0.930   7.607
   65    H    ILE   9           H        ILE   9  -7.124  -1.731   2.377
   66    HA   ILE   9           HA       ILE   9  -4.683  -3.047   1.572
   67    HB   ILE   9           HB       ILE   9  -7.194  -2.799  -0.096
   68   1HG1  ILE   9          1HG1      ILE   9  -7.909  -3.417   2.144
   69   2HG1  ILE   9          2HG1      ILE   9  -7.947  -4.861   1.131
   70   1HG2  ILE   9          1HG2      ILE   9  -4.827  -4.002  -0.662
   71   2HG2  ILE   9          2HG2      ILE   9  -5.652  -5.320   0.171
   72   3HG2  ILE   9          3HG2      ILE   9  -6.378  -4.590  -1.261
   73   1HD1  ILE   9          1HD1      ILE   9  -5.338  -4.788   2.137
   74   2HD1  ILE   9          2HD1      ILE   9  -6.350  -4.322   3.504
   75   3HD1  ILE   9          3HD1      ILE   9  -6.637  -5.853   2.676
   76    H    ILE  10           H        ILE  10  -6.663  -0.485   0.047
   77    HA   ILE  10           HA       ILE  10  -5.200  -0.041  -2.276
   78    HB   ILE  10           HB       ILE  10  -6.315   2.095  -0.429
   79   1HG1  ILE  10          1HG1      ILE  10  -7.574   0.601  -2.754
   80   2HG1  ILE  10          2HG1      ILE  10  -7.972   0.364  -1.052
   81   1HG2  ILE  10          1HG2      ILE  10  -4.732   2.838  -2.272
   82   2HG2  ILE  10          2HG2      ILE  10  -5.895   2.186  -3.427
   83   3HG2  ILE  10          3HG2      ILE  10  -6.357   3.517  -2.365
   84   1HD1  ILE  10          1HD1      ILE  10  -8.100   3.154  -2.090
   85   2HD1  ILE  10          2HD1      ILE  10  -9.363   2.044  -2.621
   86   3HD1  ILE  10          3HD1      ILE  10  -9.123   2.349  -0.901
   87    H    GLY  11           H        GLY  11  -4.275   0.637   1.023
   88   1HA   GLY  11          1HA       GLY  11  -1.942   2.238   0.200
   89   2HA   GLY  11          2HA       GLY  11  -2.375   1.817   1.857
   90    H    VAL  12           H        VAL  12  -2.722  -1.061   1.057
   91    HA   VAL  12           HA       VAL  12  -0.121  -2.000   1.737
   92    HB   VAL  12           HB       VAL  12  -2.436  -3.402   0.370
   93   1HG1  VAL  12          1HG1      VAL  12  -0.206  -4.481  -0.063
   94   2HG1  VAL  12          2HG1      VAL  12   0.007  -4.629   1.682
   95   3HG1  VAL  12          3HG1      VAL  12  -1.307  -5.489   0.878
   96   1HG2  VAL  12          1HG2      VAL  12  -2.749  -2.510   2.715
   97   2HG2  VAL  12          2HG2      VAL  12  -2.913  -4.261   2.581
   98   3HG2  VAL  12          3HG2      VAL  12  -1.428  -3.562   3.226
   99    H    SER  13           H        SER  13  -1.761  -1.834  -1.434
  100    HA   SER  13           HA       SER  13   0.607  -2.776  -2.854
  101   1HB   SER  13          1HB       SER  13  -1.843  -2.990  -3.618
  102   2HB   SER  13          2HB       SER  13  -1.727  -1.292  -4.075
  103    HG   SER  13           HG       SER  13   0.351  -2.172  -5.135
  104    H    TYR  14           H        TYR  14  -0.471   0.230  -1.608
  105    HA   TYR  14           HA       TYR  14   1.092   1.853  -3.502
  106   1HB   TYR  14          1HB       TYR  14  -0.930   2.329  -1.454
  107   2HB   TYR  14          2HB       TYR  14   0.421   3.455  -1.311
  108    HD1  TYR  14           HD1      TYR  14   1.328   3.828  -4.042
  109    HD2  TYR  14           HD2      TYR  14  -2.678   3.453  -2.539
  110    HE1  TYR  14           HE1      TYR  14   0.477   5.101  -5.993
  111    HE2  TYR  14           HE2      TYR  14  -3.529   4.726  -4.490
  112    HH   TYR  14           HH       TYR  14  -2.299   6.583  -6.150
  113    H    ASP  15           H        ASP  15   1.501   0.321  -0.408
  114    HA   ASP  15           HA       ASP  15   3.770   1.947   0.424
  115   1HB   ASP  15          1HB       ASP  15   2.549  -0.640   1.370
  116   2HB   ASP  15          2HB       ASP  15   4.102  -0.096   2.004
  117    H    GLU  16           H        GLU  16   3.501  -1.449  -0.730
  118    HA   GLU  16           HA       GLU  16   6.183  -2.114  -0.926
  119   1HB   GLU  16          1HB       GLU  16   3.759  -3.052  -2.072
  120   2HB   GLU  16          2HB       GLU  16   4.910  -2.879  -3.395
  121   1HG   GLU  16          1HG       GLU  16   6.502  -4.016  -1.500
  122   2HG   GLU  16          2HG       GLU  16   4.946  -4.745  -1.099
  123    H    TYR  17           H        TYR  17   4.347   0.089  -2.955
  124    HA   TYR  17           HA       TYR  17   6.338   0.425  -5.007
  125   1HB   TYR  17          1HB       TYR  17   4.305   1.310  -5.682
  126   2HB   TYR  17          2HB       TYR  17   3.920   1.925  -4.076
  127    HD1  TYR  17           HD1      TYR  17   6.738   2.395  -6.514
  128    HD2  TYR  17           HD2      TYR  17   3.803   4.234  -3.980
  129    HE1  TYR  17           HE1      TYR  17   7.574   4.638  -7.178
  130    HE2  TYR  17           HE2      TYR  17   4.638   6.480  -4.637
  131    HH   TYR  17           HH       TYR  17   6.963   7.383  -5.528
  132    H    ARG  18           H        ARG  18   5.582   2.280  -2.051
  133    HA   ARG  18           HA       ARG  18   7.881   4.034  -2.333
  134   1HB   ARG  18          1HB       ARG  18   5.606   4.212  -0.900
  135   2HB   ARG  18          2HB       ARG  18   6.669   3.562   0.348
  136   1HG   ARG  18          1HG       ARG  18   8.148   5.401   0.209
  137   2HG   ARG  18          2HG       ARG  18   7.506   5.908  -1.354
  138   1HD   ARG  18          1HD       ARG  18   5.371   6.515  -0.303
  139   2HD   ARG  18          2HD       ARG  18   5.972   5.968   1.261
  140    HE   ARG  18           HE       ARG  18   7.699   7.979   0.078
  141   1HH1  ARG  18          1HH1      ARG  18   7.288   7.902   2.973
  142   2HH1  ARG  18          2HH1      ARG  18   6.194   9.214   3.259
  143   1HH2  ARG  18          1HH2      ARG  18   5.204   9.461  -0.054
  144   2HH2  ARG  18          2HH2      ARG  18   5.014  10.096   1.546
  145    H    TYR  19           H        TYR  19   7.786   0.822  -1.810
  146    HA   TYR  19           HA       TYR  19  10.103   0.814   0.043
  147   1HB   TYR  19          1HB       TYR  19   7.781  -1.033  -0.451
  148   2HB   TYR  19          2HB       TYR  19   9.254  -1.626   0.291
  149    HD1  TYR  19           HD1      TYR  19   7.118   1.452   0.576
  150    HD2  TYR  19           HD2      TYR  19   9.191  -1.710   2.607
  151    HE1  TYR  19           HE1      TYR  19   6.397   2.383   2.760
  152    HE2  TYR  19           HE2      TYR  19   8.471  -0.782   4.794
  153    HH   TYR  19           HH       TYR  19   7.340   2.270   5.205
  154    H    ARG  20           H        ARG  20   9.124   0.440  -3.149
  155    HA   ARG  20           HA       ARG  20  11.015  -1.746  -3.779
  156   1HB   ARG  20          1HB       ARG  20   8.567  -1.160  -4.778
  157   2HB   ARG  20          2HB       ARG  20   9.583  -0.326  -5.953
  158   1HG   ARG  20          1HG       ARG  20   9.250  -2.579  -6.746
  159   2HG   ARG  20          2HG       ARG  20  10.918  -2.453  -6.184
  160   1HD   ARG  20          1HD       ARG  20   9.713  -3.210  -3.879
  161   2HD   ARG  20          2HD       ARG  20   8.648  -3.994  -5.046
  162    HE   ARG  20           HE       ARG  20  11.176  -4.682  -5.924
  163   1HH1  ARG  20          1HH1      ARG  20   8.964  -5.485  -3.491
  164   2HH1  ARG  20          2HH1      ARG  20  10.008  -6.608  -2.684
  165   1HH2  ARG  20          1HH2      ARG  20  12.769  -5.854  -4.644
  166   2HH2  ARG  20          2HH2      ARG  20  12.163  -6.816  -3.337
  167    H    SER  21           H        SER  21  10.378   1.400  -5.397
  168    HA   SER  21           HA       SER  21  13.168   1.463  -6.290
  169   1HB   SER  21          1HB       SER  21  11.241   2.178  -7.739
  170   2HB   SER  21          2HB       SER  21  11.030   3.565  -6.675
  171    HG   SER  21           HG       SER  21  12.832   3.153  -8.655
  172    H    VAL  22           H        VAL  22  12.303   1.905  -3.387
  173    HA   VAL  22           HA       VAL  22  13.925   4.357  -2.991
  174    HB   VAL  22           HB       VAL  22  11.942   5.298  -2.423
  175   1HG1  VAL  22          1HG1      VAL  22  10.693   3.350  -3.303
  176   2HG1  VAL  22          2HG1      VAL  22  10.825   2.584  -1.720
  177   3HG1  VAL  22          3HG1      VAL  22   9.910   4.080  -1.902
  178   1HG2  VAL  22          1HG2      VAL  22  13.250   4.644  -0.201
  179   2HG2  VAL  22          2HG2      VAL  22  11.656   5.394  -0.117
  180   3HG2  VAL  22          3HG2      VAL  22  11.820   3.649   0.071
  181    H    ILE  23           H        ILE  23  12.369   1.782  -1.031
  182    HA   ILE  23           HA       ILE  23  14.797   1.634   0.638
  183    HB   ILE  23           HB       ILE  23  12.114   0.234   0.758
  184   1HG1  ILE  23          1HG1      ILE  23  12.969   1.726   3.090
  185   2HG1  ILE  23          2HG1      ILE  23  13.034   2.745   1.652
  186   1HG2  ILE  23          1HG2      ILE  23  14.661  -0.190   2.305
  187   2HG2  ILE  23          2HG2      ILE  23  13.101  -0.451   3.085
  188   3HG2  ILE  23          3HG2      ILE  23  13.543  -1.393   1.661
  189   1HD1  ILE  23          1HD1      ILE  23  10.627   1.034   1.888
  190   2HD1  ILE  23          2HD1      ILE  23  10.762   2.323   3.084
  191   3HD1  ILE  23          3HD1      ILE  23  10.771   2.712   1.364
  192    H    LYS  24           H        LYS  24  13.116  -0.252  -1.820
  193    HA   LYS  24           HA       LYS  24  13.691  -2.303  -2.832
  194   1HB   LYS  24          1HB       LYS  24  15.566  -0.455  -3.379
  195   2HB   LYS  24          2HB       LYS  24  16.575  -1.619  -2.521
  196   1HG   LYS  24          1HG       LYS  24  14.697  -2.515  -4.703
  197   2HG   LYS  24          2HG       LYS  24  16.309  -1.908  -5.085
  198   1HD   LYS  24          1HD       LYS  24  16.968  -3.625  -3.124
  199   2HD   LYS  24          2HD       LYS  24  15.509  -4.424  -3.712
  200   1HE   LYS  24          1HE       LYS  24  16.489  -5.022  -5.691
  201   2HE   LYS  24          2HE       LYS  24  17.364  -3.484  -5.828
  202   1HZ   LYS  24          1HZ       LYS  24  18.028  -5.472  -3.740
  203   2HZ   LYS  24          2HZ       LYS  24  18.738  -5.539  -5.282
  204   3HZ   LYS  24          3HZ       LYS  24  18.969  -4.175  -4.296
  205    H    ALA  25           H        ALA  25  13.077  -3.060  -0.422
  206    HA   ALA  25           HA       ALA  25  14.640  -5.317   0.188
  207   1HB   ALA  25          1HB       ALA  25  15.637  -2.805   1.373
  208   2HB   ALA  25          2HB       ALA  25  15.410  -4.115   2.532
  209   3HB   ALA  25          3HB       ALA  25  16.466  -4.343   1.137
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1 -15.023   1.509  11.669
    2   2H    MET   1          2H        MET   1 -13.336   1.444  11.487
    3   3H    MET   1          3H        MET   1 -14.108   2.938  11.702
    4    HA   MET   1           HA       MET   1 -15.180   2.769   9.559
    5   1HB   MET   1          1HB       MET   1 -12.274   2.614  10.069
    6   2HB   MET   1          2HB       MET   1 -12.735   2.317   8.391
    7   1HG   MET   1          1HG       MET   1 -14.139   4.426   8.514
    8   2HG   MET   1          2HG       MET   1 -13.381   4.752  10.072
    9   1HE   MET   1          1HE       MET   1 -13.590   4.838   6.661
   10   2HE   MET   1          2HE       MET   1 -12.319   5.953   6.141
   11   3HE   MET   1          3HE       MET   1 -12.077   4.213   6.010
   12    HA   PRO   2           HA       PRO   2 -15.256  -1.792   8.891
   13   1HB   PRO   2          1HB       PRO   2 -17.972  -2.046   8.756
   14   2HB   PRO   2          2HB       PRO   2 -17.076  -2.091  10.287
   15   1HG   PRO   2          1HG       PRO   2 -18.717   0.074   9.125
   16   2HG   PRO   2          2HG       PRO   2 -18.414  -0.334  10.819
   17   1HD   PRO   2          1HD       PRO   2 -17.205   1.736   9.383
   18   2HD   PRO   2          2HD       PRO   2 -16.659   1.083  10.940
   19    H    GLY   3           H        GLY   3 -15.776   0.940   7.152
   20   1HA   GLY   3          1HA       GLY   3 -16.674  -0.584   4.736
   21   2HA   GLY   3          2HA       GLY   3 -17.070   1.115   4.994
   22    H    THR   4           H        THR   4 -14.057  -0.823   5.168
   23    HA   THR   4           HA       THR   4 -12.882   0.907   3.076
   24    HB   THR   4           HB       THR   4 -12.437   2.012   5.299
   25    HG1  THR   4           HG1      THR   4 -10.289   0.942   3.798
   26   1HG2  THR   4          1HG2      THR   4 -12.134  -0.455   6.291
   27   2HG2  THR   4          2HG2      THR   4 -10.446  -0.122   5.901
   28   3HG2  THR   4          3HG2      THR   4 -11.323   0.941   7.002
   29    H    ILE   5           H        ILE   5 -13.511  -1.716   2.704
   30    HA   ILE   5           HA       ILE   5 -11.327  -3.500   3.419
   31    HB   ILE   5           HB       ILE   5 -13.501  -3.772   1.317
   32   1HG1  ILE   5          1HG1      ILE   5 -14.504  -3.626   3.496
   33   2HG1  ILE   5          2HG1      ILE   5 -14.451  -5.341   3.087
   34   1HG2  ILE   5          1HG2      ILE   5 -11.518  -5.749   2.475
   35   2HG2  ILE   5          2HG2      ILE   5 -12.944  -6.225   1.553
   36   3HG2  ILE   5          3HG2      ILE   5 -11.679  -5.264   0.787
   37   1HD1  ILE   5          1HD1      ILE   5 -12.129  -5.289   4.298
   38   2HD1  ILE   5          2HD1      ILE   5 -12.746  -3.809   5.033
   39   3HD1  ILE   5          3HD1      ILE   5 -13.602  -5.334   5.268
   40    H    LYS   6           H        LYS   6 -12.062  -1.362   0.749
   41    HA   LYS   6           HA       LYS   6  -9.653  -2.354  -0.706
   42   1HB   LYS   6          1HB       LYS   6 -11.865  -0.524  -1.690
   43   2HB   LYS   6          2HB       LYS   6 -10.565  -1.211  -2.664
   44   1HG   LYS   6          1HG       LYS   6 -11.471  -3.505  -1.776
   45   2HG   LYS   6          2HG       LYS   6 -12.941  -2.589  -1.444
   46   1HD   LYS   6          1HD       LYS   6 -13.514  -2.769  -3.611
   47   2HD   LYS   6          2HD       LYS   6 -12.074  -1.847  -4.046
   48   1HE   LYS   6          1HE       LYS   6 -10.741  -3.880  -4.182
   49   2HE   LYS   6          2HE       LYS   6 -12.102  -4.851  -3.583
   50   1HZ   LYS   6          1HZ       LYS   6 -13.423  -4.028  -5.469
   51   2HZ   LYS   6          2HZ       LYS   6 -12.051  -3.228  -6.074
   52   3HZ   LYS   6          3HZ       LYS   6 -12.076  -4.924  -5.979
   53    H    GLU   7           H        GLU   7 -11.181   0.539   0.657
   54    HA   GLU   7           HA       GLU   7  -9.174   2.401  -0.206
   55   1HB   GLU   7          1HB       GLU   7 -11.558   2.506   1.299
   56   2HB   GLU   7          2HB       GLU   7 -10.290   3.105   2.371
   57   1HG   GLU   7          1HG       GLU   7  -9.708   4.277  -0.095
   58   2HG   GLU   7          2HG       GLU   7 -11.467   4.369   0.024
   59    H    ASN   8           H        ASN   8  -9.147  -0.100   2.121
   60    HA   ASN   8           HA       ASN   8  -7.118   1.079   3.859
   61   1HB   ASN   8          1HB       ASN   8  -8.786  -0.705   4.561
   62   2HB   ASN   8          2HB       ASN   8  -7.852  -1.848   3.595
   63   1HD2  ASN   8          2HD2      ASN   8  -8.187  -1.772   6.583
   64   2HD2  ASN   8          1HD2      ASN   8  -6.613  -1.656   7.211
   65    H    ILE   9           H        ILE   9  -7.102  -1.621   1.498
   66    HA   ILE   9           HA       ILE   9  -4.229  -1.866   1.522
   67    HB   ILE   9           HB       ILE   9  -6.245  -2.722  -0.579
   68   1HG1  ILE   9          1HG1      ILE   9  -6.603  -3.696   1.683
   69   2HG1  ILE   9          2HG1      ILE   9  -6.084  -4.915   0.519
   70   1HG2  ILE   9          1HG2      ILE   9  -3.753  -2.518  -1.231
   71   2HG2  ILE   9          2HG2      ILE   9  -3.486  -3.860  -0.119
   72   3HG2  ILE   9          3HG2      ILE   9  -4.538  -4.070  -1.519
   73   1HD1  ILE   9          1HD1      ILE   9  -3.751  -4.664   1.319
   74   2HD1  ILE   9          2HD1      ILE   9  -4.297  -3.486   2.511
   75   3HD1  ILE   9          3HD1      ILE   9  -4.833  -5.163   2.619
   76    H    ILE  10           H        ILE  10  -6.497   0.092  -0.311
   77    HA   ILE  10           HA       ILE  10  -4.933   0.884  -2.489
   78    HB   ILE  10           HB       ILE  10  -7.030   2.250  -0.856
   79   1HG1  ILE  10          1HG1      ILE  10  -7.422   0.496  -2.653
   80   2HG1  ILE  10          2HG1      ILE  10  -8.256   2.022  -2.894
   81   1HG2  ILE  10          1HG2      ILE  10  -5.229   3.531  -2.919
   82   2HG2  ILE  10          2HG2      ILE  10  -6.880   4.097  -2.669
   83   3HG2  ILE  10          3HG2      ILE  10  -5.714   4.165  -1.347
   84   1HD1  ILE  10          1HD1      ILE  10  -5.536   1.636  -4.087
   85   2HD1  ILE  10          2HD1      ILE  10  -6.948   0.957  -4.898
   86   3HD1  ILE  10          3HD1      ILE  10  -6.841   2.695  -4.620
   87    H    GLY  11           H        GLY  11  -4.763   1.946   0.881
   88   1HA   GLY  11          1HA       GLY  11  -2.610   3.865   0.244
   89   2HA   GLY  11          2HA       GLY  11  -3.330   3.610   1.833
   90    H    VAL  12           H        VAL  12  -3.047   0.687   1.706
   91    HA   VAL  12           HA       VAL  12  -0.371   0.487   2.780
   92    HB   VAL  12           HB       VAL  12  -2.459  -1.584   2.061
   93   1HG1  VAL  12          1HG1      VAL  12   0.393  -1.882   2.756
   94   2HG1  VAL  12          2HG1      VAL  12  -0.703  -2.837   3.754
   95   3HG1  VAL  12          3HG1      VAL  12  -0.709  -3.035   2.001
   96   1HG2  VAL  12          1HG2      VAL  12  -1.525  -0.198   4.564
   97   2HG2  VAL  12          2HG2      VAL  12  -3.173  -0.452   3.986
   98   3HG2  VAL  12          3HG2      VAL  12  -2.259  -1.798   4.667
   99    H    SER  13           H        SER  13  -1.875  -0.403  -0.305
  100    HA   SER  13           HA       SER  13   0.467  -1.746  -1.344
  101   1HB   SER  13          1HB       SER  13  -2.180  -1.416  -2.164
  102   2HB   SER  13          2HB       SER  13  -1.247  -0.537  -3.373
  103    HG   SER  13           HG       SER  13  -0.754  -2.418  -4.145
  104    H    TYR  14           H        TYR  14  -0.293   1.536  -0.818
  105    HA   TYR  14           HA       TYR  14   1.278   2.618  -3.027
  106   1HB   TYR  14          1HB       TYR  14  -0.250   3.686  -0.729
  107   2HB   TYR  14          2HB       TYR  14   1.140   4.656  -1.219
  108    HD1  TYR  14           HD1      TYR  14  -1.407   2.593  -3.054
  109    HD2  TYR  14           HD2      TYR  14   0.528   6.404  -2.627
  110    HE1  TYR  14           HE1      TYR  14  -2.695   3.464  -4.987
  111    HE2  TYR  14           HE2      TYR  14  -0.759   7.275  -4.559
  112    HH   TYR  14           HH       TYR  14  -1.983   5.819  -6.757
  113    H    ASP  15           H        ASP  15   1.783   2.307   0.508
  114    HA   ASP  15           HA       ASP  15   4.413   3.359   0.576
  115   1HB   ASP  15          1HB       ASP  15   2.737   2.363   2.465
  116   2HB   ASP  15          2HB       ASP  15   3.872   1.019   2.324
  117    H    GLU  16           H        GLU  16   3.318  -0.004   0.057
  118    HA   GLU  16           HA       GLU  16   5.775  -1.311  -0.114
  119   1HB   GLU  16          1HB       GLU  16   3.119  -1.851  -0.930
  120   2HB   GLU  16          2HB       GLU  16   4.127  -2.109  -2.355
  121   1HG   GLU  16          1HG       GLU  16   4.163  -4.197  -1.249
  122   2HG   GLU  16          2HG       GLU  16   5.683  -3.438  -0.774
  123    H    TYR  17           H        TYR  17   4.201   0.764  -2.507
  124    HA   TYR  17           HA       TYR  17   6.139   0.404  -4.595
  125   1HB   TYR  17          1HB       TYR  17   4.327   1.493  -5.491
  126   2HB   TYR  17          2HB       TYR  17   3.923   2.278  -3.969
  127    HD1  TYR  17           HD1      TYR  17   6.547   2.339  -6.645
  128    HD2  TYR  17           HD2      TYR  17   4.306   4.571  -3.740
  129    HE1  TYR  17           HE1      TYR  17   7.584   4.440  -7.463
  130    HE2  TYR  17           HE2      TYR  17   5.344   6.674  -4.555
  131    HH   TYR  17           HH       TYR  17   6.965   6.915  -7.463
  132    H    ARG  18           H        ARG  18   5.702   3.151  -2.347
  133    HA   ARG  18           HA       ARG  18   8.169   4.426  -2.818
  134   1HB   ARG  18          1HB       ARG  18   6.290   5.299  -1.372
  135   2HB   ARG  18          2HB       ARG  18   6.796   4.163  -0.124
  136   1HG   ARG  18          1HG       ARG  18   9.001   5.204  -0.013
  137   2HG   ARG  18          2HG       ARG  18   8.581   6.292  -1.336
  138   1HD   ARG  18          1HD       ARG  18   6.778   7.270   0.033
  139   2HD   ARG  18          2HD       ARG  18   7.186   6.177   1.355
  140    HE   ARG  18           HE       ARG  18   8.633   7.969   1.918
  141   1HH1  ARG  18          1HH1      ARG  18  10.582   6.439   0.133
  142   2HH1  ARG  18          2HH1      ARG  18  11.195   7.718  -0.861
  143   1HH2  ARG  18          1HH2      ARG  18   8.658   9.933  -0.034
  144   2HH2  ARG  18          2HH2      ARG  18  10.105   9.698  -0.956
  145    H    TYR  19           H        TYR  19   7.429   1.464  -1.206
  146    HA   TYR  19           HA       TYR  19  10.037   1.282   0.141
  147   1HB   TYR  19          1HB       TYR  19   7.518  -0.364   0.013
  148   2HB   TYR  19          2HB       TYR  19   8.989  -1.030   0.692
  149    HD1  TYR  19           HD1      TYR  19   8.906   2.503   1.104
  150    HD2  TYR  19           HD2      TYR  19   7.379  -1.156   2.757
  151    HE1  TYR  19           HE1      TYR  19   8.446   3.662   3.251
  152    HE2  TYR  19           HE2      TYR  19   6.921   0.002   4.903
  153    HH   TYR  19           HH       TYR  19   6.748   3.236   5.242
  154    H    ARG  20           H        ARG  20   8.734   0.614  -2.913
  155    HA   ARG  20           HA       ARG  20  10.159  -1.850  -3.476
  156   1HB   ARG  20          1HB       ARG  20   8.156  -1.255  -4.744
  157   2HB   ARG  20          2HB       ARG  20   8.937   0.214  -5.328
  158   1HG   ARG  20          1HG       ARG  20  10.740  -1.848  -5.935
  159   2HG   ARG  20          2HG       ARG  20   9.151  -2.495  -6.345
  160   1HD   ARG  20          1HD       ARG  20   8.775  -0.915  -7.983
  161   2HD   ARG  20          2HD       ARG  20   9.751   0.310  -7.172
  162    HE   ARG  20           HE       ARG  20  11.014  -2.020  -8.558
  163   1HH1  ARG  20          1HH1      ARG  20  10.187   1.150  -9.126
  164   2HH1  ARG  20          2HH1      ARG  20  11.791   1.708  -9.467
  165   1HH2  ARG  20          1HH2      ARG  20  13.318  -1.232  -8.444
  166   2HH2  ARG  20          2HH2      ARG  20  13.562   0.361  -9.079
  167    H    SER  21           H        SER  21  10.946   1.569  -3.702
  168    HA   SER  21           HA       SER  21  13.477   0.853  -5.102
  169   1HB   SER  21          1HB       SER  21  11.932   2.709  -5.984
  170   2HB   SER  21          2HB       SER  21  12.467   3.651  -4.595
  171    HG   SER  21           HG       SER  21  14.225   4.040  -5.658
  172    H    VAL  22           H        VAL  22  12.928   0.443  -2.201
  173    HA   VAL  22           HA       VAL  22  15.362   1.713  -1.198
  174    HB   VAL  22           HB       VAL  22  13.961   3.439  -0.567
  175   1HG1  VAL  22          1HG1      VAL  22  11.824   1.345  -0.223
  176   2HG1  VAL  22          2HG1      VAL  22  11.599   3.039   0.211
  177   3HG1  VAL  22          3HG1      VAL  22  11.911   2.591  -1.466
  178   1HG2  VAL  22          1HG2      VAL  22  14.962   2.173   1.455
  179   2HG2  VAL  22          2HG2      VAL  22  13.661   3.320   1.779
  180   3HG2  VAL  22          3HG2      VAL  22  13.318   1.591   1.724
  181    H    ILE  23           H        ILE  23  12.523  -0.334  -0.520
  182    HA   ILE  23           HA       ILE  23  14.207  -1.930   1.358
  183    HB   ILE  23           HB       ILE  23  11.201  -1.713   1.024
  184   1HG1  ILE  23          1HG1      ILE  23  12.394  -1.356   3.673
  185   2HG1  ILE  23          2HG1      ILE  23  13.013  -0.196   2.496
  186   1HG2  ILE  23          1HG2      ILE  23  12.879  -3.593   2.701
  187   2HG2  ILE  23          2HG2      ILE  23  11.174  -3.277   3.024
  188   3HG2  ILE  23          3HG2      ILE  23  11.661  -4.022   1.501
  189   1HD1  ILE  23          1HD1      ILE  23  10.681   0.380   1.867
  190   2HD1  ILE  23          2HD1      ILE  23  10.090  -0.735   3.098
  191   3HD1  ILE  23          3HD1      ILE  23  10.999   0.700   3.572
  192    H    LYS  24           H        LYS  24  12.286  -2.051  -1.576
  193    HA   LYS  24           HA       LYS  24  11.901  -3.810  -3.097
  194   1HB   LYS  24          1HB       LYS  24  14.727  -4.546  -2.286
  195   2HB   LYS  24          2HB       LYS  24  13.936  -4.901  -3.821
  196   1HG   LYS  24          1HG       LYS  24  13.746  -2.473  -4.274
  197   2HG   LYS  24          2HG       LYS  24  14.577  -2.134  -2.755
  198   1HD   LYS  24          1HD       LYS  24  16.395  -3.779  -3.757
  199   2HD   LYS  24          2HD       LYS  24  15.664  -3.303  -5.291
  200   1HE   LYS  24          1HE       LYS  24  15.968  -0.904  -3.830
  201   2HE   LYS  24          2HE       LYS  24  17.489  -1.797  -3.628
  202   1HZ   LYS  24          1HZ       LYS  24  17.342  -2.276  -6.076
  203   2HZ   LYS  24          2HZ       LYS  24  16.108  -1.111  -6.161
  204   3HZ   LYS  24          3HZ       LYS  24  17.668  -0.658  -5.674
  205    H    ALA  25           H        ALA  25  10.454  -4.659  -1.195
  206    HA   ALA  25           HA       ALA  25   9.669  -6.512   0.012
  207   1HB   ALA  25          1HB       ALA  25  10.667  -7.446  -2.391
  208   2HB   ALA  25          2HB       ALA  25  11.511  -8.445  -1.209
  209   3HB   ALA  25          3HB       ALA  25   9.748  -8.405  -1.233
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1 -20.604   4.318   2.076
    2   2H    MET   1          2H        MET   1 -19.973   5.851   2.434
    3   3H    MET   1          3H        MET   1 -19.401   4.994   1.083
    4    HA   MET   1           HA       MET   1 -17.734   4.728   2.714
    5   1HB   MET   1          1HB       MET   1 -19.432   5.586   4.440
    6   2HB   MET   1          2HB       MET   1 -19.946   3.907   4.612
    7   1HG   MET   1          1HG       MET   1 -18.299   3.762   6.168
    8   2HG   MET   1          2HG       MET   1 -17.207   3.689   4.784
    9   1HE   MET   1          1HE       MET   1 -19.285   5.975   6.989
   10   2HE   MET   1          2HE       MET   1 -17.958   5.488   8.040
   11   3HE   MET   1          3HE       MET   1 -18.128   7.178   7.575
   12    HA   PRO   2           HA       PRO   2 -18.507   0.512   1.201
   13   1HB   PRO   2          1HB       PRO   2 -15.954   0.117   0.296
   14   2HB   PRO   2          2HB       PRO   2 -17.197   0.958  -0.652
   15   1HG   PRO   2          1HG       PRO   2 -14.947   2.076   0.932
   16   2HG   PRO   2          2HG       PRO   2 -15.633   2.628  -0.603
   17   1HD   PRO   2          1HD       PRO   2 -16.151   3.793   1.826
   18   2HD   PRO   2          2HD       PRO   2 -17.239   3.880   0.423
   19    H    GLY   3           H        GLY   3 -16.801   1.834   3.735
   20   1HA   GLY   3          1HA       GLY   3 -16.462   0.564   5.789
   21   2HA   GLY   3          2HA       GLY   3 -16.169  -0.872   4.807
   22    H    THR   4           H        THR   4 -14.216  -0.809   6.389
   23    HA   THR   4           HA       THR   4 -12.074   0.999   5.384
   24    HB   THR   4           HB       THR   4 -12.476   0.825   7.856
   25    HG1  THR   4           HG1      THR   4 -10.080   0.141   6.604
   26   1HG2  THR   4          1HG2      THR   4 -12.245  -2.016   7.178
   27   2HG2  THR   4          2HG2      THR   4 -11.230  -1.547   8.542
   28   3HG2  THR   4          3HG2      THR   4 -12.967  -1.254   8.595
   29    H    ILE   5           H        ILE   5 -13.094  -1.329   3.863
   30    HA   ILE   5           HA       ILE   5 -11.103  -3.442   4.093
   31    HB   ILE   5           HB       ILE   5 -13.136  -2.795   1.939
   32   1HG1  ILE   5          1HG1      ILE   5 -13.922  -3.514   4.254
   33   2HG1  ILE   5          2HG1      ILE   5 -14.435  -4.558   2.926
   34   1HG2  ILE   5          1HG2      ILE   5 -10.903  -4.698   2.022
   35   2HG2  ILE   5          2HG2      ILE   5 -12.459  -5.471   1.713
   36   3HG2  ILE   5          3HG2      ILE   5 -11.888  -4.182   0.653
   37   1HD1  ILE   5          1HD1      ILE   5 -11.889  -5.118   4.441
   38   2HD1  ILE   5          2HD1      ILE   5 -13.446  -5.693   5.038
   39   3HD1  ILE   5          3HD1      ILE   5 -12.855  -6.224   3.465
   40    H    LYS   6           H        LYS   6 -11.646  -0.711   1.868
   41    HA   LYS   6           HA       LYS   6  -9.003  -1.289   0.623
   42   1HB   LYS   6          1HB       LYS   6 -11.422   0.282  -0.228
   43   2HB   LYS   6          2HB       LYS   6  -9.851   0.616  -0.957
   44   1HG   LYS   6          1HG       LYS   6 -10.242  -1.111  -2.354
   45   2HG   LYS   6          2HG       LYS   6 -10.042  -2.175  -0.962
   46   1HD   LYS   6          1HD       LYS   6 -12.430  -2.056  -0.475
   47   2HD   LYS   6          2HD       LYS   6 -12.664  -0.893  -1.783
   48   1HE   LYS   6          1HE       LYS   6 -11.383  -3.539  -2.417
   49   2HE   LYS   6          2HE       LYS   6 -13.147  -3.450  -2.233
   50   1HZ   LYS   6          1HZ       LYS   6 -11.786  -1.368  -3.789
   51   2HZ   LYS   6          2HZ       LYS   6 -12.023  -2.882  -4.516
   52   3HZ   LYS   6          3HZ       LYS   6 -13.358  -1.990  -3.960
   53    H    GLU   7           H        GLU   7 -10.507   0.801   2.886
   54    HA   GLU   7           HA       GLU   7  -8.843   3.128   2.454
   55   1HB   GLU   7          1HB       GLU   7 -10.767   2.198   4.505
   56   2HB   GLU   7          2HB       GLU   7  -9.523   3.304   5.085
   57   1HG   GLU   7          1HG       GLU   7 -10.172   5.010   3.583
   58   2HG   GLU   7          2HG       GLU   7 -11.086   3.889   2.571
   59    H    ASN   8           H        ASN   8  -8.457   0.127   4.241
   60    HA   ASN   8           HA       ASN   8  -5.983   1.149   5.515
   61   1HB   ASN   8          1HB       ASN   8  -7.718  -0.321   6.717
   62   2HB   ASN   8          2HB       ASN   8  -7.091  -1.651   5.744
   63   1HD2  ASN   8          2HD2      ASN   8  -6.803  -1.607   8.606
   64   2HD2  ASN   8          1HD2      ASN   8  -5.152  -1.452   8.966
   65    H    ILE   9           H        ILE   9  -7.031  -1.241   3.108
   66    HA   ILE   9           HA       ILE   9  -4.439  -2.404   2.695
   67    HB   ILE   9           HB       ILE   9  -6.658  -2.141   0.647
   68   1HG1  ILE   9          1HG1      ILE   9  -7.390  -3.063   2.899
   69   2HG1  ILE   9          2HG1      ILE   9  -7.590  -4.175   1.543
   70   1HG2  ILE   9          1HG2      ILE   9  -4.458  -2.940  -0.182
   71   2HG2  ILE   9          2HG2      ILE   9  -4.471  -4.209   1.045
   72   3HG2  ILE   9          3HG2      ILE   9  -5.678  -4.212  -0.242
   73   1HD1  ILE   9          1HD1      ILE   9  -5.079  -4.181   3.216
   74   2HD1  ILE   9          2HD1      ILE   9  -6.502  -5.108   3.694
   75   3HD1  ILE   9          3HD1      ILE   9  -5.699  -5.453   2.162
   76    H    ILE  10           H        ILE  10  -6.123   0.324   1.131
   77    HA   ILE  10           HA       ILE  10  -4.317   0.892  -0.932
   78    HB   ILE  10           HB       ILE  10  -5.954   2.700   0.857
   79   1HG1  ILE  10          1HG1      ILE  10  -6.107   1.956  -2.083
   80   2HG1  ILE  10          2HG1      ILE  10  -7.126   1.293  -0.807
   81   1HG2  ILE  10          1HG2      ILE  10  -3.943   3.962   0.148
   82   2HG2  ILE  10          2HG2      ILE  10  -4.266   3.523  -1.530
   83   3HG2  ILE  10          3HG2      ILE  10  -5.391   4.563  -0.657
   84   1HD1  ILE  10          1HD1      ILE  10  -7.890   3.634  -0.294
   85   2HD1  ILE  10          2HD1      ILE  10  -6.998   4.182  -1.713
   86   3HD1  ILE  10          3HD1      ILE  10  -8.356   3.073  -1.901
   87    H    GLY  11           H        GLY  11  -4.088   1.744   2.514
   88   1HA   GLY  11          1HA       GLY  11  -1.599   3.188   2.248
   89   2HA   GLY  11          2HA       GLY  11  -2.252   2.543   3.757
   90    H    VAL  12           H        VAL  12  -2.483  -0.180   2.701
   91    HA   VAL  12           HA       VAL  12   0.198  -1.101   3.321
   92    HB   VAL  12           HB       VAL  12  -2.202  -2.613   2.232
   93   1HG1  VAL  12          1HG1      VAL  12   0.509  -3.443   3.232
   94   2HG1  VAL  12          2HG1      VAL  12  -0.876  -4.509   3.473
   95   3HG1  VAL  12          3HG1      VAL  12  -0.394  -4.043   1.841
   96   1HG2  VAL  12          1HG2      VAL  12  -1.665  -1.443   4.794
   97   2HG2  VAL  12          2HG2      VAL  12  -3.048  -2.423   4.311
   98   3HG2  VAL  12          3HG2      VAL  12  -1.602  -3.198   4.961
   99    H    SER  13           H        SER  13  -1.696  -0.614   0.392
  100    HA   SER  13           HA       SER  13   0.425  -1.819  -1.281
  101   1HB   SER  13          1HB       SER  13  -2.395  -1.023  -1.649
  102   2HB   SER  13          2HB       SER  13  -1.355  -0.688  -3.031
  103    HG   SER  13           HG       SER  13  -2.340  -3.027  -2.188
  104    H    TYR  14           H        TYR  14   0.537   0.828   0.348
  105    HA   TYR  14           HA       TYR  14   1.451   2.544  -1.930
  106   1HB   TYR  14          1HB       TYR  14  -0.257   3.115   0.361
  107   2HB   TYR  14          2HB       TYR  14   1.136   4.196   0.307
  108    HD1  TYR  14           HD1      TYR  14   1.718   4.706  -2.412
  109    HD2  TYR  14           HD2      TYR  14  -2.131   4.091  -0.609
  110    HE1  TYR  14           HE1      TYR  14   0.654   5.990  -4.247
  111    HE2  TYR  14           HE2      TYR  14  -3.197   5.374  -2.444
  112    HH   TYR  14           HH       TYR  14  -2.513   7.137  -4.091
  113    H    ASP  15           H        ASP  15   2.223   1.087   1.138
  114    HA   ASP  15           HA       ASP  15   4.789   2.564   1.303
  115   1HB   ASP  15          1HB       ASP  15   3.044   1.269   3.193
  116   2HB   ASP  15          2HB       ASP  15   4.651   0.547   3.293
  117    H    GLU  16           H        GLU  16   3.648  -0.828   1.168
  118    HA   GLU  16           HA       GLU  16   6.130  -2.118   0.958
  119   1HB   GLU  16          1HB       GLU  16   3.391  -2.780   0.489
  120   2HB   GLU  16          2HB       GLU  16   4.334  -3.362  -0.882
  121   1HG   GLU  16          1HG       GLU  16   5.850  -4.554   0.613
  122   2HG   GLU  16          2HG       GLU  16   5.016  -3.900   2.022
  123    H    TYR  17           H        TYR  17   4.330  -0.348  -1.499
  124    HA   TYR  17           HA       TYR  17   6.169  -1.149  -3.639
  125   1HB   TYR  17          1HB       TYR  17   4.129   1.086  -3.668
  126   2HB   TYR  17          2HB       TYR  17   4.812   0.236  -5.056
  127    HD1  TYR  17           HD1      TYR  17   4.677  -2.428  -3.084
  128    HD2  TYR  17           HD2      TYR  17   1.913   0.404  -4.751
  129    HE1  TYR  17           HE1      TYR  17   2.864  -4.120  -2.957
  130    HE2  TYR  17           HE2      TYR  17   0.099  -1.286  -4.626
  131    HH   TYR  17           HH       TYR  17   0.728  -4.605  -3.955
  132    H    ARG  18           H        ARG  18   5.347   2.031  -2.163
  133    HA   ARG  18           HA       ARG  18   7.538   3.452  -3.229
  134   1HB   ARG  18          1HB       ARG  18   5.567   4.073  -1.432
  135   2HB   ARG  18          2HB       ARG  18   6.970   3.985  -0.366
  136   1HG   ARG  18          1HG       ARG  18   8.188   5.502  -1.962
  137   2HG   ARG  18          2HG       ARG  18   6.675   5.699  -2.847
  138   1HD   ARG  18          1HD       ARG  18   6.263   7.417  -1.434
  139   2HD   ARG  18          2HD       ARG  18   5.919   6.176  -0.229
  140    HE   ARG  18           HE       ARG  18   8.607   6.422   0.039
  141   1HH1  ARG  18          1HH1      ARG  18   8.235   9.141  -1.314
  142   2HH1  ARG  18          2HH1      ARG  18   8.101  10.178   0.067
  143   1HH2  ARG  18          1HH2      ARG  18   7.500   7.581   2.288
  144   2HH2  ARG  18          2HH2      ARG  18   7.685   9.294   2.108
  145    H    TYR  19           H        TYR  19   7.334   0.957  -0.852
  146    HA   TYR  19           HA       TYR  19   9.804   1.234   0.519
  147   1HB   TYR  19          1HB       TYR  19   7.716  -0.744   0.203
  148   2HB   TYR  19          2HB       TYR  19   9.295  -1.519   0.141
  149    HD1  TYR  19           HD1      TYR  19  10.863   0.335   1.833
  150    HD2  TYR  19           HD2      TYR  19   6.936  -1.299   2.382
  151    HE1  TYR  19           HE1      TYR  19  11.121   0.569   4.291
  152    HE2  TYR  19           HE2      TYR  19   7.186  -1.069   4.846
  153    HH   TYR  19           HH       TYR  19   9.147   0.817   6.323
  154    H    ARG  20           H        ARG  20   8.965  -0.206  -2.610
  155    HA   ARG  20           HA       ARG  20  11.527  -1.444  -3.073
  156   1HB   ARG  20          1HB       ARG  20   9.532  -0.463  -5.139
  157   2HB   ARG  20          2HB       ARG  20  10.785  -1.680  -5.377
  158   1HG   ARG  20          1HG       ARG  20   9.585  -2.863  -3.338
  159   2HG   ARG  20          2HG       ARG  20   8.209  -1.889  -3.858
  160   1HD   ARG  20          1HD       ARG  20   8.010  -3.945  -5.048
  161   2HD   ARG  20          2HD       ARG  20   8.652  -2.789  -6.215
  162    HE   ARG  20           HE       ARG  20  10.597  -4.473  -4.738
  163   1HH1  ARG  20          1HH1      ARG  20   8.510  -5.050  -7.241
  164   2HH1  ARG  20          2HH1      ARG  20   9.721  -5.322  -8.449
  165   1HH2  ARG  20          1HH2      ARG  20  12.338  -4.221  -6.455
  166   2HH2  ARG  20          2HH2      ARG  20  11.888  -4.849  -8.005
  167    H    SER  21           H        SER  21  10.286   1.800  -3.497
  168    HA   SER  21           HA       SER  21  12.664   2.589  -5.066
  169   1HB   SER  21          1HB       SER  21  10.260   3.466  -5.470
  170   2HB   SER  21          2HB       SER  21  10.537   4.464  -4.046
  171    HG   SER  21           HG       SER  21  12.286   5.399  -5.083
  172    H    VAL  22           H        VAL  22  12.857   1.685  -2.276
  173    HA   VAL  22           HA       VAL  22  14.402   3.957  -1.235
  174    HB   VAL  22           HB       VAL  22  12.423   4.455  -0.136
  175   1HG1  VAL  22          1HG1      VAL  22  11.410   2.229  -1.088
  176   2HG1  VAL  22          2HG1      VAL  22  11.765   1.614   0.519
  177   3HG1  VAL  22          3HG1      VAL  22  10.683   2.992   0.320
  178   1HG2  VAL  22          1HG2      VAL  22  14.417   3.421   1.398
  179   2HG2  VAL  22          2HG2      VAL  22  12.956   4.155   2.061
  180   3HG2  VAL  22          3HG2      VAL  22  13.062   2.403   1.888
  181    H    ILE  23           H        ILE  23  13.344   0.568  -0.841
  182    HA   ILE  23           HA       ILE  23  15.723  -0.050   0.784
  183    HB   ILE  23           HB       ILE  23  13.922  -2.145  -0.412
  184   1HG1  ILE  23          1HG1      ILE  23  13.227  -0.892   2.220
  185   2HG1  ILE  23          2HG1      ILE  23  12.668  -0.108   0.743
  186   1HG2  ILE  23          1HG2      ILE  23  16.056  -2.486   1.070
  187   2HG2  ILE  23          2HG2      ILE  23  14.990  -2.013   2.393
  188   3HG2  ILE  23          3HG2      ILE  23  14.606  -3.429   1.416
  189   1HD1  ILE  23          1HD1      ILE  23  11.996  -2.629   0.131
  190   2HD1  ILE  23          2HD1      ILE  23  11.910  -2.753   1.888
  191   3HD1  ILE  23          3HD1      ILE  23  10.916  -1.572   1.037
  192    H    LYS  24           H        LYS  24  14.411  -1.214  -2.350
  193    HA   LYS  24           HA       LYS  24  16.806  -2.548  -3.149
  194   1HB   LYS  24          1HB       LYS  24  14.696  -2.991  -4.285
  195   2HB   LYS  24          2HB       LYS  24  14.595  -1.314  -4.820
  196   1HG   LYS  24          1HG       LYS  24  17.146  -2.394  -5.592
  197   2HG   LYS  24          2HG       LYS  24  15.867  -3.473  -6.149
  198   1HD   LYS  24          1HD       LYS  24  14.902  -0.890  -6.663
  199   2HD   LYS  24          2HD       LYS  24  16.598  -0.843  -7.139
  200   1HE   LYS  24          1HE       LYS  24  16.325  -2.640  -8.687
  201   2HE   LYS  24          2HE       LYS  24  14.747  -3.080  -8.008
  202   1HZ   LYS  24          1HZ       LYS  24  14.467  -0.444  -8.578
  203   2HZ   LYS  24          2HZ       LYS  24  15.407  -0.995  -9.881
  204   3HZ   LYS  24          3HZ       LYS  24  13.906  -1.715  -9.549
  205    H    ALA  25           H        ALA  25  18.544  -1.822  -4.460
  206    HA   ALA  25           HA       ALA  25  19.099   1.054  -4.236
  207   1HB   ALA  25          1HB       ALA  25  20.726  -1.187  -5.479
  208   2HB   ALA  25          2HB       ALA  25  21.300   0.454  -5.189
  209   3HB   ALA  25          3HB       ALA  25  20.893  -0.591  -3.827
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1 -21.281  -1.911   3.986
    2   2H    MET   1          2H        MET   1 -21.945  -2.692   2.632
    3   3H    MET   1          3H        MET   1 -21.074  -3.584   3.781
    4    HA   MET   1           HA       MET   1 -19.131  -3.157   2.790
    5   1HB   MET   1          1HB       MET   1 -19.375  -2.430   0.446
    6   2HB   MET   1          2HB       MET   1 -20.679  -3.535   0.881
    7   1HG   MET   1          1HG       MET   1 -21.595  -0.967   1.593
    8   2HG   MET   1          2HG       MET   1 -20.849  -0.782   0.004
    9   1HE   MET   1          1HE       MET   1 -23.885  -0.583   1.181
   10   2HE   MET   1          2HE       MET   1 -23.556  -0.054  -0.467
   11   3HE   MET   1          3HE       MET   1 -24.870  -1.194  -0.145
   12    HA   PRO   2           HA       PRO   2 -18.979   1.246   4.240
   13   1HB   PRO   2          1HB       PRO   2 -17.108   0.830   6.191
   14   2HB   PRO   2          2HB       PRO   2 -18.851   0.644   6.471
   15   1HG   PRO   2          1HG       PRO   2 -16.779  -1.435   5.990
   16   2HG   PRO   2          2HG       PRO   2 -18.178  -1.465   7.074
   17   1HD   PRO   2          1HD       PRO   2 -18.107  -2.727   4.649
   18   2HD   PRO   2          2HD       PRO   2 -19.602  -2.159   5.425
   19    H    GLY   3           H        GLY   3 -16.843  -1.079   2.984
   20   1HA   GLY   3          1HA       GLY   3 -14.694  -0.933   2.012
   21   2HA   GLY   3          2HA       GLY   3 -15.351   0.560   1.338
   22    H    THR   4           H        THR   4 -14.244  -0.475   4.595
   23    HA   THR   4           HA       THR   4 -12.657   2.060   4.678
   24    HB   THR   4           HB       THR   4 -14.318   2.219   6.377
   25    HG1  THR   4           HG1      THR   4 -13.055   2.091   8.255
   26   1HG2  THR   4          1HG2      THR   4 -13.850  -0.698   6.577
   27   2HG2  THR   4          2HG2      THR   4 -14.194   0.127   8.098
   28   3HG2  THR   4          3HG2      THR   4 -15.344   0.220   6.765
   29    H    ILE   5           H        ILE   5 -12.662  -1.410   5.315
   30    HA   ILE   5           HA       ILE   5 -10.026  -1.481   6.502
   31    HB   ILE   5           HB       ILE   5 -11.474  -3.702   5.028
   32   1HG1  ILE   5          1HG1      ILE   5 -11.517  -3.542   7.992
   33   2HG1  ILE   5          2HG1      ILE   5 -12.505  -2.349   7.147
   34   1HG2  ILE   5          1HG2      ILE   5  -8.923  -3.509   6.333
   35   2HG2  ILE   5          2HG2      ILE   5  -9.963  -4.582   7.271
   36   3HG2  ILE   5          3HG2      ILE   5  -9.659  -4.917   5.566
   37   1HD1  ILE   5          1HD1      ILE   5 -13.471  -4.267   5.794
   38   2HD1  ILE   5          2HD1      ILE   5 -12.652  -5.364   6.907
   39   3HD1  ILE   5          3HD1      ILE   5 -13.902  -4.272   7.504
   40    H    LYS   6           H        LYS   6 -11.263  -1.700   3.201
   41    HA   LYS   6           HA       LYS   6  -8.688  -2.412   2.048
   42   1HB   LYS   6          1HB       LYS   6  -9.803  -1.877  -0.113
   43   2HB   LYS   6          2HB       LYS   6 -10.766  -2.975   0.876
   44   1HG   LYS   6          1HG       LYS   6 -12.463  -1.507   0.597
   45   2HG   LYS   6          2HG       LYS   6 -11.594  -0.464   1.722
   46   1HD   LYS   6          1HD       LYS   6 -11.263   1.035   0.080
   47   2HD   LYS   6          2HD       LYS   6 -10.386  -0.179  -0.850
   48   1HE   LYS   6          1HE       LYS   6 -13.402  -0.204  -0.825
   49   2HE   LYS   6          2HE       LYS   6 -12.522   0.881  -1.922
   50   1HZ   LYS   6          1HZ       LYS   6 -11.603  -1.889  -1.691
   51   2HZ   LYS   6          2HZ       LYS   6 -13.017  -1.605  -2.585
   52   3HZ   LYS   6          3HZ       LYS   6 -11.565  -0.845  -3.031
   53    H    GLU   7           H        GLU   7 -10.330   0.557   2.889
   54    HA   GLU   7           HA       GLU   7  -8.789   2.342   1.248
   55   1HB   GLU   7          1HB       GLU   7 -10.958   2.758   2.684
   56   2HB   GLU   7          2HB       GLU   7  -9.803   3.146   3.959
   57   1HG   GLU   7          1HG       GLU   7  -8.750   4.526   1.840
   58   2HG   GLU   7          2HG       GLU   7 -10.478   4.651   1.512
   59    H    ASN   8           H        ASN   8  -8.132   0.679   4.236
   60    HA   ASN   8           HA       ASN   8  -5.832   2.378   4.911
   61   1HB   ASN   8          1HB       ASN   8  -7.282   1.192   6.625
   62   2HB   ASN   8          2HB       ASN   8  -6.564  -0.322   6.073
   63   1HD2  ASN   8          2HD2      ASN   8  -5.087   2.924   6.626
   64   2HD2  ASN   8          1HD2      ASN   8  -3.904   2.362   7.706
   65    H    ILE   9           H        ILE   9  -6.346  -0.986   3.798
   66    HA   ILE   9           HA       ILE   9  -3.674  -1.796   3.576
   67    HB   ILE   9           HB       ILE   9  -5.829  -2.385   1.524
   68   1HG1  ILE   9          1HG1      ILE   9  -6.720  -2.812   3.754
   69   2HG1  ILE   9          2HG1      ILE   9  -6.323  -4.355   2.997
   70   1HG2  ILE   9          1HG2      ILE   9  -3.264  -3.734   2.387
   71   2HG2  ILE   9          2HG2      ILE   9  -4.531  -4.608   1.524
   72   3HG2  ILE   9          3HG2      ILE   9  -3.736  -3.229   0.765
   73   1HD1  ILE   9          1HD1      ILE   9  -4.542  -2.851   4.938
   74   2HD1  ILE   9          2HD1      ILE   9  -5.517  -4.266   5.336
   75   3HD1  ILE   9          3HD1      ILE   9  -4.178  -4.410   4.198
   76    H    ILE  10           H        ILE  10  -5.577   0.231   1.379
   77    HA   ILE  10           HA       ILE  10  -3.818   0.401  -0.801
   78    HB   ILE  10           HB       ILE  10  -5.654   2.427   0.484
   79   1HG1  ILE  10          1HG1      ILE  10  -5.682   0.986  -2.189
   80   2HG1  ILE  10          2HG1      ILE  10  -6.611   0.504  -0.769
   81   1HG2  ILE  10          1HG2      ILE  10  -3.953   2.794  -2.004
   82   2HG2  ILE  10          2HG2      ILE  10  -5.266   3.866  -1.514
   83   3HG2  ILE  10          3HG2      ILE  10  -3.825   3.719  -0.508
   84   1HD1  ILE  10          1HD1      ILE  10  -7.159   3.239  -1.112
   85   2HD1  ILE  10          2HD1      ILE  10  -7.215   2.548  -2.733
   86   3HD1  ILE  10          3HD1      ILE  10  -8.244   1.893  -1.461
   87    H    GLY  11           H        GLY  11  -3.705   2.113   2.312
   88   1HA   GLY  11          1HA       GLY  11  -1.391   3.709   1.643
   89   2HA   GLY  11          2HA       GLY  11  -1.978   3.390   3.278
   90    H    VAL  12           H        VAL  12  -1.870   0.509   3.062
   91    HA   VAL  12           HA       VAL  12   0.935   0.117   3.715
   92    HB   VAL  12           HB       VAL  12  -1.370  -1.827   3.392
   93   1HG1  VAL  12          1HG1      VAL  12   1.530  -2.208   4.039
   94   2HG1  VAL  12          2HG1      VAL  12   0.342  -3.213   4.870
   95   3HG1  VAL  12          3HG1      VAL  12   0.445  -3.243   3.111
   96   1HG2  VAL  12          1HG2      VAL  12  -1.345  -0.067   5.273
   97   2HG2  VAL  12          2HG2      VAL  12  -1.530  -1.750   5.764
   98   3HG2  VAL  12          3HG2      VAL  12   0.035  -0.952   5.922
   99    H    SER  13           H        SER  13  -0.795   0.169   0.813
  100    HA   SER  13           HA       SER  13   1.117  -1.681  -0.528
  101   1HB   SER  13          1HB       SER  13  -1.647  -0.759  -1.085
  102   2HB   SER  13          2HB       SER  13  -0.608  -0.954  -2.492
  103    HG   SER  13           HG       SER  13  -1.064  -2.994  -2.271
  104    H    TYR  14           H        TYR  14  -0.254   1.608  -0.847
  105    HA   TYR  14           HA       TYR  14   1.308   2.484  -3.025
  106   1HB   TYR  14          1HB       TYR  14  -0.352   3.692  -1.009
  107   2HB   TYR  14          2HB       TYR  14   1.109   4.659  -1.215
  108    HD1  TYR  14           HD1      TYR  14  -1.425   2.825  -3.292
  109    HD2  TYR  14           HD2      TYR  14   1.147   6.245  -2.922
  110    HE1  TYR  14           HE1      TYR  14  -2.327   3.732  -5.417
  111    HE2  TYR  14           HE2      TYR  14   0.244   7.153  -5.046
  112    HH   TYR  14           HH       TYR  14  -0.908   6.518  -6.974
  113    H    ASP  15           H        ASP  15   2.106   2.437   0.440
  114    HA   ASP  15           HA       ASP  15   4.663   3.732   0.127
  115   1HB   ASP  15          1HB       ASP  15   3.125   3.032   2.283
  116   2HB   ASP  15          2HB       ASP  15   4.387   1.801   2.349
  117    H    GLU  16           H        GLU  16   3.695   0.304   0.420
  118    HA   GLU  16           HA       GLU  16   6.195  -0.926   0.320
  119   1HB   GLU  16          1HB       GLU  16   3.504  -1.703  -0.140
  120   2HB   GLU  16          2HB       GLU  16   4.441  -2.285  -1.515
  121   1HG   GLU  16          1HG       GLU  16   6.090  -2.872   0.620
  122   2HG   GLU  16          2HG       GLU  16   4.485  -3.176   1.283
  123    H    TYR  17           H        TYR  17   4.434   0.699  -2.249
  124    HA   TYR  17           HA       TYR  17   6.177  -0.191  -4.388
  125   1HB   TYR  17          1HB       TYR  17   4.332   0.609  -5.449
  126   2HB   TYR  17          2HB       TYR  17   3.866   1.593  -4.067
  127    HD1  TYR  17           HD1      TYR  17   6.371   1.472  -6.849
  128    HD2  TYR  17           HD2      TYR  17   4.058   3.923  -4.188
  129    HE1  TYR  17           HE1      TYR  17   7.161   3.502  -8.036
  130    HE2  TYR  17           HE2      TYR  17   4.845   5.956  -5.376
  131    HH   TYR  17           HH       TYR  17   7.323   5.779  -7.876
  132    H    ARG  18           H        ARG  18   5.779   3.089  -2.986
  133    HA   ARG  18           HA       ARG  18   8.129   4.231  -3.988
  134   1HB   ARG  18          1HB       ARG  18   6.261   5.196  -2.371
  135   2HB   ARG  18          2HB       ARG  18   7.407   4.734  -1.116
  136   1HG   ARG  18          1HG       ARG  18   9.175   6.037  -2.324
  137   2HG   ARG  18          2HG       ARG  18   7.934   6.599  -3.446
  138   1HD   ARG  18          1HD       ARG  18   7.869   8.327  -1.912
  139   2HD   ARG  18          2HD       ARG  18   6.689   7.241  -1.178
  140    HE   ARG  18           HE       ARG  18   8.628   6.418   0.263
  141   1HH1  ARG  18          1HH1      ARG  18  10.858   7.893  -0.939
  142   2HH1  ARG  18          2HH1      ARG  18  10.971   9.315   0.042
  143   1HH2  ARG  18          1HH2      ARG  18   7.801   8.953   1.399
  144   2HH2  ARG  18          2HH2      ARG  18   9.238   9.917   1.364
  145    H    TYR  19           H        TYR  19   7.690   1.827  -1.543
  146    HA   TYR  19           HA       TYR  19  10.241   1.964  -0.263
  147   1HB   TYR  19          1HB       TYR  19   7.941   0.116  -0.433
  148   2HB   TYR  19          2HB       TYR  19   9.480  -0.650  -0.057
  149    HD1  TYR  19           HD1      TYR  19   8.514   2.829   0.787
  150    HD2  TYR  19           HD2      TYR  19   9.134  -1.159   2.250
  151    HE1  TYR  19           HE1      TYR  19   8.367   3.661   3.122
  152    HE2  TYR  19           HE2      TYR  19   8.988  -0.332   4.585
  153    HH   TYR  19           HH       TYR  19   7.658   2.290   5.521
  154    H    ARG  20           H        ARG  20   9.016  -0.091  -2.926
  155    HA   ARG  20           HA       ARG  20  11.352  -1.586  -3.406
  156   1HB   ARG  20          1HB       ARG  20   8.942  -0.851  -4.915
  157   2HB   ARG  20          2HB       ARG  20  10.346  -1.140  -5.943
  158   1HG   ARG  20          1HG       ARG  20  10.701  -3.290  -4.588
  159   2HG   ARG  20          2HG       ARG  20   9.076  -3.027  -3.952
  160   1HD   ARG  20          1HD       ARG  20   8.818  -2.658  -6.717
  161   2HD   ARG  20          2HD       ARG  20   9.883  -4.054  -6.549
  162    HE   ARG  20           HE       ARG  20   7.101  -3.882  -5.505
  163   1HH1  ARG  20          1HH2      ARG  20   8.950  -5.752  -7.435
  164   2HH1  ARG  20          2HH2      ARG  20   8.735  -7.240  -6.575
  165   1HH2  ARG  20          1HH1      ARG  20   7.275  -5.743  -3.809
  166   2HH2  ARG  20          2HH1      ARG  20   7.789  -7.236  -4.524
  167    H    SER  21           H        SER  21  10.782   1.782  -3.917
  168    HA   SER  21           HA       SER  21  12.971   2.048  -5.867
  169   1HB   SER  21          1HB       SER  21  10.767   3.459  -5.730
  170   2HB   SER  21          2HB       SER  21  11.658   4.374  -4.516
  171    HG   SER  21           HG       SER  21  13.268   4.745  -6.056
  172    H    VAL  22           H        VAL  22  12.558   2.210  -2.460
  173    HA   VAL  22           HA       VAL  22  15.281   3.379  -2.221
  174    HB   VAL  22           HB       VAL  22  14.264   4.998  -1.059
  175   1HG1  VAL  22          1HG1      VAL  22  11.816   3.234  -1.059
  176   2HG1  VAL  22          2HG1      VAL  22  11.835   4.896  -0.469
  177   3HG1  VAL  22          3HG1      VAL  22  12.173   4.558  -2.167
  178   1HG2  VAL  22          1HG2      VAL  22  13.575   2.754   0.859
  179   2HG2  VAL  22          2HG2      VAL  22  15.007   3.782   0.915
  180   3HG2  VAL  22          3HG2      VAL  22  13.417   4.468   1.248
  181    H    ILE  23           H        ILE  23  13.411   0.602  -1.713
  182    HA   ILE  23           HA       ILE  23  15.347  -0.338   0.369
  183    HB   ILE  23           HB       ILE  23  12.468  -1.147  -0.111
  184   1HG1  ILE  23          1HG1      ILE  23  13.082  -0.473   2.587
  185   2HG1  ILE  23          2HG1      ILE  23  13.766   0.790   1.564
  186   1HG2  ILE  23          1HG2      ILE  23  14.669  -2.387   1.533
  187   2HG2  ILE  23          2HG2      ILE  23  12.984  -2.536   2.031
  188   3HG2  ILE  23          3HG2      ILE  23  13.503  -3.180   0.473
  189   1HD1  ILE  23          1HD1      ILE  23  11.049  -0.119   0.826
  190   2HD1  ILE  23          2HD1      ILE  23  11.169   0.755   2.352
  191   3HD1  ILE  23          3HD1      ILE  23  11.719   1.511   0.857
  192    H    LYS  24           H        LYS  24  13.687  -1.114  -2.649
  193    HA   LYS  24           HA       LYS  24  15.216  -3.657  -2.830
  194   1HB   LYS  24          1HB       LYS  24  12.838  -2.516  -4.263
  195   2HB   LYS  24          2HB       LYS  24  13.803  -3.765  -5.050
  196   1HG   LYS  24          1HG       LYS  24  12.559  -3.995  -2.292
  197   2HG   LYS  24          2HG       LYS  24  11.932  -4.751  -3.759
  198   1HD   LYS  24          1HD       LYS  24  14.437  -5.675  -3.903
  199   2HD   LYS  24          2HD       LYS  24  14.356  -5.444  -2.156
  200   1HE   LYS  24          1HE       LYS  24  12.147  -6.895  -3.628
  201   2HE   LYS  24          2HE       LYS  24  13.597  -7.749  -3.063
  202   1HZ   LYS  24          1HZ       LYS  24  12.881  -6.106  -0.982
  203   2HZ   LYS  24          2HZ       LYS  24  11.405  -6.733  -1.540
  204   3HZ   LYS  24          3HZ       LYS  24  12.645  -7.786  -1.063
  205    H    ALA  25           H        ALA  25  16.008  -4.057  -5.230
  206    HA   ALA  25           HA       ALA  25  17.548  -3.453  -6.893
  207   1HB   ALA  25          1HB       ALA  25  15.618  -1.315  -6.729
  208   2HB   ALA  25          2HB       ALA  25  17.212  -0.648  -7.081
  209   3HB   ALA  25          3HB       ALA  25  16.520  -1.881  -8.134
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1 -17.627   7.787   2.909
    2   2H    MET   1          2H        MET   1 -16.318   8.537   2.127
    3   3H    MET   1          3H        MET   1 -17.592   7.888   1.214
    4    HA   MET   1           HA       MET   1 -16.775   5.806   1.284
    5   1HB   MET   1          1HB       MET   1 -14.357   7.283   2.358
    6   2HB   MET   1          2HB       MET   1 -14.364   5.879   1.290
    7   1HG   MET   1          1HG       MET   1 -15.754   7.417  -0.305
    8   2HG   MET   1          2HG       MET   1 -15.087   8.731   0.663
    9   1HE   MET   1          1HE       MET   1 -13.711   9.971  -0.687
   10   2HE   MET   1          2HE       MET   1 -12.552   9.418  -1.904
   11   3HE   MET   1          3HE       MET   1 -14.279   9.172  -2.150
   12    HA   PRO   2           HA       PRO   2 -17.119   5.215   5.871
   13   1HB   PRO   2          1HB       PRO   2 -19.281   3.544   5.781
   14   2HB   PRO   2          2HB       PRO   2 -19.431   5.311   5.844
   15   1HG   PRO   2          1HG       PRO   2 -19.702   3.471   3.528
   16   2HG   PRO   2          2HG       PRO   2 -20.593   4.952   3.906
   17   1HD   PRO   2          1HD       PRO   2 -18.560   4.798   2.068
   18   2HD   PRO   2          2HD       PRO   2 -19.041   6.289   2.906
   19    H    GLY   3           H        GLY   3 -16.313   3.469   3.163
   20   1HA   GLY   3          1HA       GLY   3 -16.170   0.822   4.446
   21   2HA   GLY   3          2HA       GLY   3 -15.649   1.206   2.804
   22    H    THR   4           H        THR   4 -14.370   0.035   5.459
   23    HA   THR   4           HA       THR   4 -11.825   1.574   5.140
   24    HB   THR   4           HB       THR   4 -13.038   1.930   7.357
   25    HG1  THR   4           HG1      THR   4 -10.475   0.720   7.317
   26   1HG2  THR   4          1HG2      THR   4 -13.752  -0.521   7.454
   27   2HG2  THR   4          2HG2      THR   4 -12.092  -0.884   7.929
   28   3HG2  THR   4          3HG2      THR   4 -13.094   0.151   8.947
   29    H    ILE   5           H        ILE   5 -13.106  -1.128   4.157
   30    HA   ILE   5           HA       ILE   5 -11.205  -3.093   5.224
   31    HB   ILE   5           HB       ILE   5 -12.949  -3.461   2.787
   32   1HG1  ILE   5          1HG1      ILE   5 -13.781  -3.818   5.684
   33   2HG1  ILE   5          2HG1      ILE   5 -14.297  -2.478   4.658
   34   1HG2  ILE   5          1HG2      ILE   5 -11.260  -5.115   4.453
   35   2HG2  ILE   5          2HG2      ILE   5 -12.923  -5.701   4.503
   36   3HG2  ILE   5          3HG2      ILE   5 -12.094  -5.536   2.956
   37   1HD1  ILE   5          1HD1      ILE   5 -14.986  -4.452   3.018
   38   2HD1  ILE   5          2HD1      ILE   5 -15.049  -5.371   4.522
   39   3HD1  ILE   5          3HD1      ILE   5 -16.061  -3.940   4.319
   40    H    LYS   6           H        LYS   6 -11.503  -1.007   2.418
   41    HA   LYS   6           HA       LYS   6  -9.321  -2.344   0.978
   42   1HB   LYS   6          1HB       LYS   6 -10.386   0.402   0.339
   43   2HB   LYS   6          2HB       LYS   6  -9.732  -0.811  -0.760
   44   1HG   LYS   6          1HG       LYS   6 -11.840  -2.164   0.352
   45   2HG   LYS   6          2HG       LYS   6 -12.467  -0.516   0.295
   46   1HD   LYS   6          1HD       LYS   6 -12.568  -0.503  -1.976
   47   2HD   LYS   6          2HD       LYS   6 -11.031  -1.353  -2.141
   48   1HE   LYS   6          1HE       LYS   6 -13.531  -2.774  -1.191
   49   2HE   LYS   6          2HE       LYS   6 -13.109  -2.653  -2.911
   50   1HZ   LYS   6          1HZ       LYS   6 -10.864  -3.483  -2.306
   51   2HZ   LYS   6          2HZ       LYS   6 -11.430  -3.779  -0.735
   52   3HZ   LYS   6          3HZ       LYS   6 -12.098  -4.624  -2.050
   53    H    GLU   7           H        GLU   7  -9.786   0.732   2.730
   54    HA   GLU   7           HA       GLU   7  -7.249   1.865   2.340
   55   1HB   GLU   7          1HB       GLU   7  -9.340   2.703   3.708
   56   2HB   GLU   7          2HB       GLU   7  -8.503   1.952   5.067
   57   1HG   GLU   7          1HG       GLU   7  -6.431   3.292   4.017
   58   2HG   GLU   7          2HG       GLU   7  -7.736   4.339   3.454
   59    H    ASN   8           H        ASN   8  -8.105  -0.979   4.116
   60    HA   ASN   8           HA       ASN   8  -5.604  -0.986   5.675
   61   1HB   ASN   8          1HB       ASN   8  -7.805  -1.916   6.538
   62   2HB   ASN   8          2HB       ASN   8  -7.616  -3.229   5.376
   63   1HD2  ASN   8          2HD2      ASN   8  -5.279  -1.570   7.583
   64   2HD2  ASN   8          1HD2      ASN   8  -4.714  -3.004   8.292
   65    H    ILE   9           H        ILE   9  -7.036  -2.784   2.947
   66    HA   ILE   9           HA       ILE   9  -4.645  -4.423   2.611
   67    HB   ILE   9           HB       ILE   9  -6.817  -3.977   0.556
   68   1HG1  ILE   9          1HG1      ILE   9  -7.964  -4.503   2.626
   69   2HG1  ILE   9          2HG1      ILE   9  -7.925  -5.969   1.645
   70   1HG2  ILE   9          1HG2      ILE   9  -4.764  -5.241  -0.091
   71   2HG2  ILE   9          2HG2      ILE   9  -5.080  -6.374   1.224
   72   3HG2  ILE   9          3HG2      ILE   9  -6.212  -6.247  -0.124
   73   1HD1  ILE   9          1HD1      ILE   9  -5.535  -6.034   3.105
   74   2HD1  ILE   9          2HD1      ILE   9  -6.751  -5.484   4.259
   75   3HD1  ILE   9          3HD1      ILE   9  -6.974  -7.010   3.403
   76    H    ILE  10           H        ILE  10  -5.997  -1.519   1.066
   77    HA   ILE  10           HA       ILE  10  -4.215  -1.310  -1.111
   78    HB   ILE  10           HB       ILE  10  -5.672   0.718   0.573
   79   1HG1  ILE  10          1HG1      ILE  10  -6.127   0.946  -2.221
   80   2HG1  ILE  10          2HG1      ILE  10  -6.118  -0.778  -1.844
   81   1HG2  ILE  10          1HG2      ILE  10  -3.506   1.764  -0.054
   82   2HG2  ILE  10          2HG2      ILE  10  -3.817   1.363  -1.743
   83   3HG2  ILE  10          3HG2      ILE  10  -4.861   2.510  -0.901
   84   1HD1  ILE  10          1HD1      ILE  10  -7.629   1.097  -0.055
   85   2HD1  ILE  10          2HD1      ILE  10  -8.346   0.608  -1.591
   86   3HD1  ILE  10          3HD1      ILE  10  -7.923  -0.609  -0.388
   87    H    GLY  11           H        GLY  11  -3.784  -0.283   2.273
   88   1HA   GLY  11          1HA       GLY  11  -1.256   0.979   1.960
   89   2HA   GLY  11          2HA       GLY  11  -1.819   0.228   3.454
   90    H    VAL  12           H        VAL  12  -2.138  -2.426   2.352
   91    HA   VAL  12           HA       VAL  12   0.454  -3.491   2.800
   92    HB   VAL  12           HB       VAL  12  -2.022  -4.607   1.472
   93   1HG1  VAL  12          1HG1      VAL  12   0.707  -5.607   1.320
   94   2HG1  VAL  12          2HG1      VAL  12  -0.351  -6.750   2.146
   95   3HG1  VAL  12          3HG1      VAL  12  -0.745  -6.202   0.517
   96   1HG2  VAL  12          1HG2      VAL  12  -1.456  -4.162   4.090
   97   2HG2  VAL  12          2HG2      VAL  12  -2.484  -5.484   3.537
   98   3HG2  VAL  12          3HG2      VAL  12  -0.785  -5.782   3.902
   99    H    SER  13           H        SER  13  -1.235  -2.740  -0.253
  100    HA   SER  13           HA       SER  13   1.101  -3.586  -1.830
  101   1HB   SER  13          1HB       SER  13  -1.337  -3.809  -2.581
  102   2HB   SER  13          2HB       SER  13  -1.316  -2.065  -2.828
  103    HG   SER  13           HG       SER  13   0.726  -2.624  -4.069
  104    H    TYR  14           H        TYR  14  -0.070  -0.708  -0.337
  105    HA   TYR  14           HA       TYR  14   1.345   1.150  -2.090
  106   1HB   TYR  14          1HB       TYR  14  -0.340   1.307   0.330
  107   2HB   TYR  14          2HB       TYR  14   0.929   2.530   0.243
  108    HD1  TYR  14           HD1      TYR  14  -0.940   0.882  -2.536
  109    HD2  TYR  14           HD2      TYR  14  -0.207   4.515  -0.365
  110    HE1  TYR  14           HE1      TYR  14  -2.277   2.145  -4.200
  111    HE2  TYR  14           HE2      TYR  14  -1.543   5.779  -2.029
  112    HH   TYR  14           HH       TYR  14  -3.445   4.176  -4.459
  113    H    ASP  15           H        ASP  15   2.144  -0.807   0.656
  114    HA   ASP  15           HA       ASP  15   4.436   0.753   1.526
  115   1HB   ASP  15          1HB       ASP  15   3.757  -2.172   1.970
  116   2HB   ASP  15          2HB       ASP  15   5.017  -1.278   2.822
  117    H    GLU  16           H        GLU  16   4.165  -2.359  -0.241
  118    HA   GLU  16           HA       GLU  16   6.875  -2.710  -0.870
  119   1HB   GLU  16          1HB       GLU  16   4.471  -3.911  -1.624
  120   2HB   GLU  16          2HB       GLU  16   5.150  -3.332  -3.144
  121   1HG   GLU  16          1HG       GLU  16   5.970  -5.591  -2.690
  122   2HG   GLU  16          2HG       GLU  16   7.304  -4.442  -2.571
  123    H    TYR  17           H        TYR  17   4.441  -0.734  -2.540
  124    HA   TYR  17           HA       TYR  17   6.204   0.099  -4.664
  125   1HB   TYR  17          1HB       TYR  17   4.205   0.852  -5.407
  126   2HB   TYR  17          2HB       TYR  17   3.484   0.587  -3.826
  127    HD1  TYR  17           HD1      TYR  17   5.747   3.004  -5.587
  128    HD2  TYR  17           HD2      TYR  17   2.672   2.428  -2.646
  129    HE1  TYR  17           HE1      TYR  17   5.611   5.458  -5.251
  130    HE2  TYR  17           HE2      TYR  17   2.533   4.883  -2.311
  131    HH   TYR  17           HH       TYR  17   4.099   6.870  -2.636
  132    H    ARG  18           H        ARG  18   5.009   1.949  -1.840
  133    HA   ARG  18           HA       ARG  18   6.808   4.102  -2.023
  134   1HB   ARG  18          1HB       ARG  18   4.854   3.488  -0.284
  135   2HB   ARG  18          2HB       ARG  18   6.240   3.008   0.697
  136   1HG   ARG  18          1HG       ARG  18   6.482   5.619  -0.692
  137   2HG   ARG  18          2HG       ARG  18   5.300   5.546   0.616
  138   1HD   ARG  18          1HD       ARG  18   7.087   4.548   2.079
  139   2HD   ARG  18          2HD       ARG  18   8.244   4.851   0.784
  140    HE   ARG  18           HE       ARG  18   7.624   7.303   1.044
  141   1HH1  ARG  18          1HH1      ARG  18   5.504   6.210   3.151
  142   2HH1  ARG  18          2HH1      ARG  18   6.222   6.836   4.597
  143   1HH2  ARG  18          1HH2      ARG  18   9.248   7.592   3.082
  144   2HH2  ARG  18          2HH2      ARG  18   8.342   7.618   4.558
  145    H    TYR  19           H        TYR  19   7.344   0.806  -1.144
  146    HA   TYR  19           HA       TYR  19   9.924   1.294   0.142
  147   1HB   TYR  19          1HB       TYR  19   8.139  -1.014  -0.430
  148   2HB   TYR  19          2HB       TYR  19   9.855  -1.361  -0.272
  149    HD1  TYR  19           HD1      TYR  19   7.615   1.125   1.410
  150    HD2  TYR  19           HD2      TYR  19  10.263  -2.225   1.853
  151    HE1  TYR  19           HE1      TYR  19   7.424   1.299   3.879
  152    HE2  TYR  19           HE2      TYR  19  10.074  -2.054   4.323
  153    HH   TYR  19           HH       TYR  19   8.445   0.645   5.854
  154    H    ARG  20           H        ARG  20   8.684   0.480  -3.035
  155    HA   ARG  20           HA       ARG  20  11.268  -0.402  -4.075
  156   1HB   ARG  20          1HB       ARG  20   8.518  -0.024  -5.126
  157   2HB   ARG  20          2HB       ARG  20   9.822   0.171  -6.298
  158   1HG   ARG  20          1HG       ARG  20  10.567  -2.090  -4.856
  159   2HG   ARG  20          2HG       ARG  20   8.820  -2.264  -5.035
  160   1HD   ARG  20          1HD       ARG  20   9.516  -1.426  -7.539
  161   2HD   ARG  20          2HD       ARG  20  10.941  -2.361  -7.089
  162    HE   ARG  20           HE       ARG  20   8.466  -3.774  -6.508
  163   1HH1  ARG  20          1HH1      ARG  20  11.042  -5.017  -7.468
  164   2HH1  ARG  20          2HH1      ARG  20  10.625  -5.489  -9.081
  165   1HH2  ARG  20          1HH2      ARG  20   7.805  -3.476  -9.224
  166   2HH2  ARG  20          2HH2      ARG  20   8.791  -4.619 -10.074
  167    H    SER  21           H        SER  21  10.324   2.542  -3.054
  168    HA   SER  21           HA       SER  21  11.683   3.975  -5.290
  169   1HB   SER  21          1HB       SER  21   9.278   4.591  -4.530
  170   2HB   SER  21          2HB       SER  21  10.076   5.328  -3.144
  171    HG   SER  21           HG       SER  21  10.142   6.938  -4.553
  172    H    VAL  22           H        VAL  22  11.741   3.412  -1.834
  173    HA   VAL  22           HA       VAL  22  14.121   5.168  -1.645
  174    HB   VAL  22           HB       VAL  22  13.222   5.941   0.252
  175   1HG1  VAL  22          1HG1      VAL  22  11.165   5.635  -1.139
  176   2HG1  VAL  22          2HG1      VAL  22  10.877   4.121  -0.283
  177   3HG1  VAL  22          3HG1      VAL  22  10.852   5.649   0.597
  178   1HG2  VAL  22          1HG2      VAL  22  12.671   3.075   1.070
  179   2HG2  VAL  22          2HG2      VAL  22  14.084   4.027   1.524
  180   3HG2  VAL  22          3HG2      VAL  22  12.489   4.475   2.127
  181    H    ILE  23           H        ILE  23  12.887   1.935  -0.814
  182    HA   ILE  23           HA       ILE  23  15.482   1.157   0.323
  183    HB   ILE  23           HB       ILE  23  13.011  -0.487  -0.300
  184   1HG1  ILE  23          1HG1      ILE  23  13.424  -0.307   2.460
  185   2HG1  ILE  23          2HG1      ILE  23  13.751   1.322   1.866
  186   1HG2  ILE  23          1HG2      ILE  23  15.534  -1.124   1.260
  187   2HG2  ILE  23          2HG2      ILE  23  14.085  -2.132   1.250
  188   3HG2  ILE  23          3HG2      ILE  23  15.003  -1.892  -0.237
  189   1HD1  ILE  23          1HD1      ILE  23  11.310  -0.207   0.970
  190   2HD1  ILE  23          2HD1      ILE  23  11.302   0.742   2.457
  191   3HD1  ILE  23          3HD1      ILE  23  11.602   1.532   0.909
  192    H    LYS  24           H        LYS  24  13.576   0.352  -2.591
  193    HA   LYS  24           HA       LYS  24  16.095  -0.772  -3.752
  194   1HB   LYS  24          1HB       LYS  24  13.335  -1.440  -4.759
  195   2HB   LYS  24          2HB       LYS  24  14.830  -2.355  -4.949
  196   1HG   LYS  24          1HG       LYS  24  14.362  -2.046  -2.152
  197   2HG   LYS  24          2HG       LYS  24  12.858  -2.601  -2.888
  198   1HD   LYS  24          1HD       LYS  24  14.006  -4.476  -3.934
  199   2HD   LYS  24          2HD       LYS  24  15.564  -3.888  -3.351
  200   1HE   LYS  24          1HE       LYS  24  14.433  -4.034  -0.979
  201   2HE   LYS  24          2HE       LYS  24  13.326  -5.156  -1.793
  202   1HZ   LYS  24          1HZ       LYS  24  15.625  -5.986  -2.789
  203   2HZ   LYS  24          2HZ       LYS  24  16.190  -5.414  -1.296
  204   3HZ   LYS  24          3HZ       LYS  24  14.985  -6.612  -1.345
  205    H    ALA  25           H        ALA  25  16.433  -0.344  -6.048
  206    HA   ALA  25           HA       ALA  25  16.581   1.168  -7.838
  207   1HB   ALA  25          1HB       ALA  25  14.106   0.191  -7.877
  208   2HB   ALA  25          2HB       ALA  25  13.692   1.859  -7.484
  209   3HB   ALA  25          3HB       ALA  25  14.582   1.497  -8.962
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1 -15.483  -1.947  12.871
    2   2H    MET   1          2H        MET   1 -16.521  -3.277  12.703
    3   3H    MET   1          3H        MET   1 -14.865  -3.446  12.363
    4    HA   MET   1           HA       MET   1 -15.613  -3.213  10.231
    5   1HB   MET   1          1HB       MET   1 -17.712  -1.967   9.784
    6   2HB   MET   1          2HB       MET   1 -17.940  -3.172  11.051
    7   1HG   MET   1          1HG       MET   1 -17.091  -0.921  12.444
    8   2HG   MET   1          2HG       MET   1 -18.154  -0.260  11.203
    9   1HE   MET   1          1HE       MET   1 -20.249  -1.394  10.501
   10   2HE   MET   1          2HE       MET   1 -20.091  -3.105  10.891
   11   3HE   MET   1          3HE       MET   1 -21.415  -2.154  11.580
   12    HA   PRO   2           HA       PRO   2 -13.344   0.794  10.716
   13   1HB   PRO   2          1HB       PRO   2 -11.029  -0.047   9.524
   14   2HB   PRO   2          2HB       PRO   2 -11.350  -0.247  11.259
   15   1HG   PRO   2          1HG       PRO   2 -11.545  -2.234   9.057
   16   2HG   PRO   2          2HG       PRO   2 -11.001  -2.447  10.728
   17   1HD   PRO   2          1HD       PRO   2 -13.477  -3.189   9.811
   18   2HD   PRO   2          2HD       PRO   2 -13.118  -2.789  11.505
   19    H    GLY   3           H        GLY   3 -14.475  -1.201   8.253
   20   1HA   GLY   3          1HA       GLY   3 -14.955  -0.833   5.984
   21   2HA   GLY   3          2HA       GLY   3 -14.912   0.883   6.387
   22    H    THR   4           H        THR   4 -13.551   1.904   5.017
   23    HA   THR   4           HA       THR   4 -11.765   2.222   3.512
   24    HB   THR   4           HB       THR   4 -10.688   2.835   5.594
   25    HG1  THR   4           HG1      THR   4  -8.746   2.661   4.788
   26   1HG2  THR   4          1HG2      THR   4 -10.222  -0.140   5.928
   27   2HG2  THR   4          2HG2      THR   4  -9.499   1.105   6.945
   28   3HG2  THR   4          3HG2      THR   4 -11.247   0.882   6.934
   29    H    ILE   5           H        ILE   5 -13.124  -0.312   3.231
   30    HA   ILE   5           HA       ILE   5 -11.275  -2.490   2.985
   31    HB   ILE   5           HB       ILE   5 -13.780  -2.049   1.339
   32   1HG1  ILE   5          1HG1      ILE   5 -14.346  -3.727   3.517
   33   2HG1  ILE   5          2HG1      ILE   5 -13.428  -2.389   4.207
   34   1HG2  ILE   5          1HG2      ILE   5 -11.919  -4.022   1.136
   35   2HG2  ILE   5          2HG2      ILE   5 -12.979  -4.712   2.366
   36   3HG2  ILE   5          3HG2      ILE   5 -13.633  -4.263   0.790
   37   1HD1  ILE   5          1HD1      ILE   5 -15.439  -1.543   2.238
   38   2HD1  ILE   5          2HD1      ILE   5 -16.127  -2.326   3.659
   39   3HD1  ILE   5          3HD1      ILE   5 -15.102  -0.903   3.845
   40    H    LYS   6           H        LYS   6 -11.724   0.343   1.090
   41    HA   LYS   6           HA       LYS   6 -10.137  -0.900  -1.122
   42   1HB   LYS   6          1HB       LYS   6 -12.568   0.260  -1.404
   43   2HB   LYS   6          2HB       LYS   6 -11.534   1.675  -1.607
   44   1HG   LYS   6          1HG       LYS   6 -10.276   0.551  -3.374
   45   2HG   LYS   6          2HG       LYS   6 -11.211  -0.925  -3.134
   46   1HD   LYS   6          1HD       LYS   6 -13.218   0.875  -3.508
   47   2HD   LYS   6          2HD       LYS   6 -11.960   1.576  -4.528
   48   1HE   LYS   6          1HE       LYS   6 -11.677  -0.610  -5.673
   49   2HE   LYS   6          2HE       LYS   6 -12.983  -1.283  -4.678
   50   1HZ   LYS   6          1HZ       LYS   6 -13.360   1.228  -6.183
   51   2HZ   LYS   6          2HZ       LYS   6 -13.602  -0.274  -6.938
   52   3HZ   LYS   6          3HZ       LYS   6 -14.539   0.157  -5.591
   53    H    GLU   7           H        GLU   7 -10.418   1.804   1.109
   54    HA   GLU   7           HA       GLU   7  -8.174   3.266  -0.056
   55   1HB   GLU   7          1HB       GLU   7 -10.113   3.661   2.095
   56   2HB   GLU   7          2HB       GLU   7  -8.490   4.173   2.557
   57   1HG   GLU   7          1HG       GLU   7  -9.404   4.961  -0.162
   58   2HG   GLU   7          2HG       GLU   7 -10.176   5.777   1.198
   59    H    ASN   8           H        ASN   8  -8.597   0.763   2.341
   60    HA   ASN   8           HA       ASN   8  -5.931   1.153   3.502
   61   1HB   ASN   8          1HB       ASN   8  -8.092   0.124   4.607
   62   2HB   ASN   8          2HB       ASN   8  -7.536  -1.363   3.839
   63   1HD2  ASN   8          1HD2      ASN   8  -5.003  -1.724   4.230
   64   2HD2  ASN   8          2HD2      ASN   8  -4.478  -1.447   5.821
   65    H    ILE   9           H        ILE   9  -7.396  -0.728   0.944
   66    HA   ILE   9           HA       ILE   9  -5.063  -2.506   0.706
   67    HB   ILE   9           HB       ILE   9  -7.329  -2.187  -1.273
   68   1HG1  ILE   9          1HG1      ILE   9  -8.273  -2.570   0.972
   69   2HG1  ILE   9          2HG1      ILE   9  -8.456  -4.010  -0.029
   70   1HG2  ILE   9          1HG2      ILE   9  -5.188  -3.510  -1.795
   71   2HG2  ILE   9          2HG2      ILE   9  -5.725  -4.649  -0.560
   72   3HG2  ILE   9          3HG2      ILE   9  -6.715  -4.370  -1.993
   73   1HD1  ILE   9          1HD1      ILE   9  -5.930  -4.254   1.193
   74   2HD1  ILE   9          2HD1      ILE   9  -7.023  -3.707   2.465
   75   3HD1  ILE   9          3HD1      ILE   9  -7.382  -5.180   1.564
   76    H    ILE  10           H        ILE  10  -6.580   0.087  -1.238
   77    HA   ILE  10           HA       ILE  10  -4.796   0.158  -3.377
   78    HB   ILE  10           HB       ILE  10  -6.849   1.750  -2.529
   79   1HG1  ILE  10          1HG1      ILE  10  -6.017   1.195  -4.836
   80   2HG1  ILE  10          2HG1      ILE  10  -6.542   2.860  -4.639
   81   1HG2  ILE  10          1HG2      ILE  10  -5.094   3.017  -1.122
   82   2HG2  ILE  10          2HG2      ILE  10  -4.467   3.605  -2.661
   83   3HG2  ILE  10          3HG2      ILE  10  -6.122   3.980  -2.181
   84   1HD1  ILE  10          1HD1      ILE  10  -3.669   1.935  -4.428
   85   2HD1  ILE  10          2HD1      ILE  10  -4.374   2.683  -5.860
   86   3HD1  ILE  10          3HD1      ILE  10  -4.236   3.603  -4.362
   87    H    GLY  11           H        GLY  11  -4.288   1.243  -0.075
   88   1HA   GLY  11          1HA       GLY  11  -1.768   2.584  -0.645
   89   2HA   GLY  11          2HA       GLY  11  -2.376   2.161   0.958
   90    H    VAL  12           H        VAL  12  -2.792  -0.674   0.093
   91    HA   VAL  12           HA       VAL  12  -0.375  -1.806   1.022
   92    HB   VAL  12           HB       VAL  12  -2.579  -2.949  -0.713
   93   1HG1  VAL  12          1HG1      VAL  12  -0.234  -4.369   0.587
   94   2HG1  VAL  12          2HG1      VAL  12  -1.613  -5.170  -0.164
   95   3HG1  VAL  12          3HG1      VAL  12  -0.514  -4.201  -1.145
   96   1HG2  VAL  12          1HG2      VAL  12  -2.625  -2.244   1.912
   97   2HG2  VAL  12          2HG2      VAL  12  -3.570  -3.579   1.253
   98   3HG2  VAL  12          3HG2      VAL  12  -2.026  -3.898   2.045
   99    H    SER  13           H        SER  13  -1.308  -0.736  -2.172
  100    HA   SER  13           HA       SER  13   1.229  -1.857  -3.276
  101   1HB   SER  13          1HB       SER  13  -1.361  -1.909  -4.300
  102   2HB   SER  13          2HB       SER  13  -0.582  -0.613  -5.204
  103    HG   SER  13           HG       SER  13   0.668  -3.113  -4.781
  104    H    TYR  14           H        TYR  14  -0.036   0.966  -2.014
  105    HA   TYR  14           HA       TYR  14   1.537   2.716  -3.833
  106   1HB   TYR  14          1HB       TYR  14  -0.864   3.044  -2.236
  107   2HB   TYR  14          2HB       TYR  14   0.323   4.292  -1.853
  108    HD1  TYR  14           HD1      TYR  14  -0.112   2.512  -5.095
  109    HD2  TYR  14           HD2      TYR  14  -0.595   6.200  -2.946
  110    HE1  TYR  14           HE1      TYR  14  -0.650   3.677  -7.216
  111    HE2  TYR  14           HE2      TYR  14  -1.132   7.365  -5.070
  112    HH   TYR  14           HH       TYR  14  -0.406   6.368  -7.946
  113    H    ASP  15           H        ASP  15   1.611   1.294  -0.674
  114    HA   ASP  15           HA       ASP  15   3.718   3.178   0.236
  115   1HB   ASP  15          1HB       ASP  15   3.481   2.161   2.401
  116   2HB   ASP  15          2HB       ASP  15   1.848   2.389   1.774
  117    H    GLU  16           H        GLU  16   3.263  -0.309  -0.404
  118    HA   GLU  16           HA       GLU  16   5.899  -1.149   0.204
  119   1HB   GLU  16          1HB       GLU  16   3.585  -2.243  -1.104
  120   2HB   GLU  16          2HB       GLU  16   5.013  -2.610  -2.068
  121   1HG   GLU  16          1HG       GLU  16   5.263  -4.343  -0.611
  122   2HG   GLU  16          2HG       GLU  16   5.948  -3.111   0.449
  123    H    TYR  17           H        TYR  17   4.542   0.071  -2.871
  124    HA   TYR  17           HA       TYR  17   6.947  -0.162  -4.387
  125   1HB   TYR  17          1HB       TYR  17   5.651   0.718  -6.024
  126   2HB   TYR  17          2HB       TYR  17   4.346   0.761  -4.845
  127    HD1  TYR  17           HD1      TYR  17   7.308   2.759  -5.984
  128    HD2  TYR  17           HD2      TYR  17   3.357   2.802  -4.307
  129    HE1  TYR  17           HE1      TYR  17   7.285   5.238  -6.104
  130    HE2  TYR  17           HE2      TYR  17   3.330   5.282  -4.428
  131    HH   TYR  17           HH       TYR  17   4.939   7.051  -6.197
  132    H    ARG  18           H        ARG  18   5.580   2.695  -2.734
  133    HA   ARG  18           HA       ARG  18   7.803   4.411  -3.029
  134   1HB   ARG  18          1HB       ARG  18   5.373   4.452  -1.605
  135   2HB   ARG  18          2HB       ARG  18   6.626   4.670  -0.384
  136   1HG   ARG  18          1HG       ARG  18   7.366   6.254  -2.625
  137   2HG   ARG  18          2HG       ARG  18   5.660   6.571  -2.308
  138   1HD   ARG  18          1HD       ARG  18   6.219   7.837  -0.537
  139   2HD   ARG  18          2HD       ARG  18   7.018   6.452   0.205
  140    HE   ARG  18           HE       ARG  18   9.059   7.149  -1.170
  141   1HH1  ARG  18          1HH1      ARG  18   7.841   9.372  -2.691
  142   2HH1  ARG  18          2HH1      ARG  18   8.261  10.761  -1.744
  143   1HH2  ARG  18          1HH2      ARG  18   9.034   8.923   1.091
  144   2HH2  ARG  18          2HH2      ARG  18   8.930  10.506   0.398
  145    H    TYR  19           H        TYR  19   7.386   1.567  -1.140
  146    HA   TYR  19           HA       TYR  19   9.672   2.118   0.629
  147   1HB   TYR  19          1HB       TYR  19   7.510   0.088   0.386
  148   2HB   TYR  19          2HB       TYR  19   9.020  -0.446   1.106
  149    HD1  TYR  19           HD1      TYR  19   8.116   3.076   1.380
  150    HD2  TYR  19           HD2      TYR  19   7.838  -0.769   3.275
  151    HE1  TYR  19           HE1      TYR  19   7.481   4.172   3.514
  152    HE2  TYR  19           HE2      TYR  19   7.206   0.327   5.409
  153    HH   TYR  19           HH       TYR  19   6.078   2.609   6.035
  154    H    ARG  20           H        ARG  20   9.068   0.790  -2.452
  155    HA   ARG  20           HA       ARG  20  11.105  -1.254  -2.490
  156   1HB   ARG  20          1HB       ARG  20   9.200  -1.150  -4.092
  157   2HB   ARG  20          2HB       ARG  20   9.918   0.293  -4.810
  158   1HG   ARG  20          1HG       ARG  20  11.998  -1.591  -4.703
  159   2HG   ARG  20          2HG       ARG  20  10.584  -2.490  -5.256
  160   1HD   ARG  20          1HD       ARG  20  10.190  -0.597  -6.916
  161   2HD   ARG  20          2HD       ARG  20  11.795  -0.007  -6.486
  162    HE   ARG  20           HE       ARG  20  12.401  -2.544  -7.139
  163   1HH1  ARG  20          1HH2      ARG  20  12.389  -0.085  -9.076
  164   2HH1  ARG  20          2HH2      ARG  20  11.640  -0.809 -10.460
  165   1HH2  ARG  20          1HH1      ARG  20  10.500  -3.586  -8.722
  166   2HH2  ARG  20          2HH1      ARG  20  10.571  -2.791 -10.260
  167    H    SER  21           H        SER  21  11.117   2.221  -3.152
  168    HA   SER  21           HA       SER  21  13.921   2.028  -4.088
  169   1HB   SER  21          1HB       SER  21  12.055   3.531  -5.142
  170   2HB   SER  21          2HB       SER  21  12.414   4.609  -3.796
  171    HG   SER  21           HG       SER  21  14.330   3.553  -5.610
  172    H    VAL  22           H        VAL  22  12.997   1.618  -1.244
  173    HA   VAL  22           HA       VAL  22  15.008   3.371  -0.012
  174    HB   VAL  22           HB       VAL  22  13.217   4.748   0.423
  175   1HG1  VAL  22          1HG1      VAL  22  11.599   2.237   0.256
  176   2HG1  VAL  22          2HG1      VAL  22  10.910   3.671   1.013
  177   3HG1  VAL  22          3HG1      VAL  22  11.440   3.728  -0.667
  178   1HG2  VAL  22          1HG2      VAL  22  14.108   3.327   2.572
  179   2HG2  VAL  22          2HG2      VAL  22  12.971   4.669   2.695
  180   3HG2  VAL  22          3HG2      VAL  22  12.375   3.010   2.661
  181    H    ILE  23           H        ILE  23  12.654   0.725   0.377
  182    HA   ILE  23           HA       ILE  23  14.438  -0.440   2.471
  183    HB   ILE  23           HB       ILE  23  11.496  -0.860   1.874
  184   1HG1  ILE  23          1HG1      ILE  23  12.498  -0.185   4.580
  185   2HG1  ILE  23          2HG1      ILE  23  12.703   1.078   3.365
  186   1HG2  ILE  23          1HG2      ILE  23  13.388  -2.352   3.704
  187   2HG2  ILE  23          2HG2      ILE  23  11.642  -2.355   3.945
  188   3HG2  ILE  23          3HG2      ILE  23  12.327  -3.021   2.462
  189   1HD1  ILE  23          1HD1      ILE  23  10.067  -0.348   3.628
  190   2HD1  ILE  23          2HD1      ILE  23  10.466   0.984   4.713
  191   3HD1  ILE  23          3HD1      ILE  23  10.399   1.254   2.970
  192    H    LYS  24           H        LYS  24  12.224  -1.585  -0.111
  193    HA   LYS  24           HA       LYS  24  13.862  -4.006  -0.441
  194   1HB   LYS  24          1HB       LYS  24  11.332  -2.994  -1.757
  195   2HB   LYS  24          2HB       LYS  24  12.153  -4.462  -2.288
  196   1HG   LYS  24          1HG       LYS  24  12.033  -4.776   0.462
  197   2HG   LYS  24          2HG       LYS  24  10.487  -4.017   0.078
  198   1HD   LYS  24          1HD       LYS  24  10.174  -6.398  -0.112
  199   2HD   LYS  24          2HD       LYS  24  10.204  -5.744  -1.750
  200   1HE   LYS  24          1HE       LYS  24  11.667  -7.594  -1.910
  201   2HE   LYS  24          2HE       LYS  24  12.788  -6.250  -1.610
  202   1HZ   LYS  24          1HZ       LYS  24  11.997  -6.889   0.877
  203   2HZ   LYS  24          2HZ       LYS  24  12.008  -8.419   0.139
  204   3HZ   LYS  24          3HZ       LYS  24  13.417  -7.468   0.152
  205    H    ALA  25           H        ALA  25  14.068  -4.531  -3.032
  206    HA   ALA  25           HA       ALA  25  14.775  -2.270  -4.694
  207   1HB   ALA  25          1HB       ALA  25  16.927  -3.710  -3.162
  208   2HB   ALA  25          2HB       ALA  25  17.274  -3.046  -4.759
  209   3HB   ALA  25          3HB       ALA  25  16.746  -1.982  -3.456
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1 -18.966   1.019   8.964
    2   2H    MET   1          2H        MET   1 -19.639   2.574   8.895
    3   3H    MET   1          3H        MET   1 -20.088   1.404   7.748
    4    HA   MET   1           HA       MET   1 -18.579   2.755   6.595
    5   1HB   MET   1          1HB       MET   1 -17.981   3.803   8.866
    6   2HB   MET   1          2HB       MET   1 -16.752   2.543   8.996
    7   1HG   MET   1          1HG       MET   1 -16.231   3.420   6.493
    8   2HG   MET   1          2HG       MET   1 -16.852   4.909   7.203
    9   1HE   MET   1          1HE       MET   1 -15.289   6.410   7.458
   10   2HE   MET   1          2HE       MET   1 -13.654   6.287   8.104
   11   3HE   MET   1          3HE       MET   1 -14.030   5.622   6.510
   12    HA   PRO   2           HA       PRO   2 -16.841  -1.500   6.239
   13   1HB   PRO   2          1HB       PRO   2 -17.943  -2.074   3.809
   14   2HB   PRO   2          2HB       PRO   2 -18.794  -2.346   5.343
   15   1HG   PRO   2          1HG       PRO   2 -19.151  -0.195   3.343
   16   2HG   PRO   2          2HG       PRO   2 -20.335  -0.954   4.415
   17   1HD   PRO   2          1HD       PRO   2 -19.148   1.531   4.812
   18   2HD   PRO   2          2HD       PRO   2 -19.986   0.573   6.050
   19    H    GLY   3           H        GLY   3 -16.199   1.436   5.031
   20   1HA   GLY   3          1HA       GLY   3 -14.699   0.639   2.626
   21   2HA   GLY   3          2HA       GLY   3 -14.818   2.273   3.279
   22    H    THR   4           H        THR   4 -13.904  -0.549   5.196
   23    HA   THR   4           HA       THR   4 -11.414   0.806   5.959
   24    HB   THR   4           HB       THR   4 -12.599  -0.321   7.730
   25    HG1  THR   4           HG1      THR   4 -10.653  -0.814   8.321
   26   1HG2  THR   4          1HG2      THR   4 -13.108  -2.245   5.647
   27   2HG2  THR   4          2HG2      THR   4 -12.425  -3.061   7.054
   28   3HG2  THR   4          3HG2      THR   4 -13.888  -2.090   7.222
   29    H    ILE   5           H        ILE   5 -12.409  -1.420   3.580
   30    HA   ILE   5           HA       ILE   5  -9.682  -2.577   3.316
   31    HB   ILE   5           HB       ILE   5 -12.169  -3.222   1.707
   32   1HG1  ILE   5          1HG1      ILE   5 -11.053  -4.566   4.191
   33   2HG1  ILE   5          2HG1      ILE   5 -12.564  -3.662   4.099
   34   1HG2  ILE   5          1HG2      ILE   5  -9.864  -3.829   0.815
   35   2HG2  ILE   5          2HG2      ILE   5  -9.693  -4.886   2.216
   36   3HG2  ILE   5          3HG2      ILE   5 -10.969  -5.186   1.037
   37   1HD1  ILE   5          1HD1      ILE   5 -12.244  -5.826   2.100
   38   2HD1  ILE   5          2HD1      ILE   5 -12.420  -6.352   3.774
   39   3HD1  ILE   5          3HD1      ILE   5 -13.667  -5.352   3.028
   40    H    LYS   6           H        LYS   6 -11.753  -0.172   1.974
   41    HA   LYS   6           HA       LYS   6 -10.078   0.012  -0.484
   42   1HB   LYS   6          1HB       LYS   6 -12.854   0.462   0.078
   43   2HB   LYS   6          2HB       LYS   6 -12.138   1.984  -0.452
   44   1HG   LYS   6          1HG       LYS   6 -11.159   0.801  -2.417
   45   2HG   LYS   6          2HG       LYS   6 -11.992  -0.669  -1.910
   46   1HD   LYS   6          1HD       LYS   6 -13.674   0.092  -3.240
   47   2HD   LYS   6          2HD       LYS   6 -14.043   1.141  -1.870
   48   1HE   LYS   6          1HE       LYS   6 -12.575   2.903  -2.842
   49   2HE   LYS   6          2HE       LYS   6 -12.295   1.860  -4.250
   50   1HZ   LYS   6          1HZ       LYS   6 -14.749   1.706  -4.481
   51   2HZ   LYS   6          2HZ       LYS   6 -14.903   2.897  -3.279
   52   3HZ   LYS   6          3HZ       LYS   6 -14.139   3.270  -4.748
   53    H    GLU   7           H        GLU   7  -9.483   0.935   2.424
   54    HA   GLU   7           HA       GLU   7  -8.547   3.646   1.610
   55   1HB   GLU   7          1HB       GLU   7 -10.564   3.944   3.002
   56   2HB   GLU   7          2HB       GLU   7  -9.833   2.959   4.271
   57   1HG   GLU   7          1HG       GLU   7  -7.946   4.974   3.544
   58   2HG   GLU   7          2HG       GLU   7  -9.503   5.762   3.802
   59    H    ASN   8           H        ASN   8  -8.247   0.923   3.873
   60    HA   ASN   8           HA       ASN   8  -5.524   1.834   4.613
   61   1HB   ASN   8          1HB       ASN   8  -7.130   0.971   6.352
   62   2HB   ASN   8          2HB       ASN   8  -7.033  -0.612   5.578
   63   1HD2  ASN   8          2HD2      ASN   8  -5.058   1.852   7.265
   64   2HD2  ASN   8          1HD2      ASN   8  -3.827   0.778   7.724
   65    H    ILE   9           H        ILE   9  -7.075  -1.141   3.352
   66    HA   ILE   9           HA       ILE   9  -4.697  -2.543   2.745
   67    HB   ILE   9           HB       ILE   9  -7.241  -2.608   1.097
   68   1HG1  ILE   9          1HG1      ILE   9  -7.834  -2.842   3.454
   69   2HG1  ILE   9          2HG1      ILE   9  -7.924  -4.427   2.683
   70   1HG2  ILE   9          1HG2      ILE   9  -4.773  -4.012   0.953
   71   2HG2  ILE   9          2HG2      ILE   9  -5.973  -5.143   1.577
   72   3HG2  ILE   9          3HG2      ILE   9  -6.248  -4.326   0.038
   73   1HD1  ILE   9          1HD1      ILE   9  -5.257  -4.172   3.542
   74   2HD1  ILE   9          2HD1      ILE   9  -6.238  -3.561   4.875
   75   3HD1  ILE   9          3HD1      ILE   9  -6.507  -5.191   4.258
   76    H    ILE  10           H        ILE  10  -6.100   0.230   1.224
   77    HA   ILE  10           HA       ILE  10  -4.881  -0.082  -1.372
   78    HB   ILE  10           HB       ILE  10  -5.952   2.298   0.155
   79   1HG1  ILE  10          1HG1      ILE  10  -6.835   0.826  -2.350
   80   2HG1  ILE  10          2HG1      ILE  10  -7.582   0.693  -0.757
   81   1HG2  ILE  10          1HG2      ILE  10  -4.081   3.071  -1.263
   82   2HG2  ILE  10          2HG2      ILE  10  -4.799   2.255  -2.653
   83   3HG2  ILE  10          3HG2      ILE  10  -5.630   3.620  -1.906
   84   1HD1  ILE  10          1HD1      ILE  10  -7.808   3.297  -0.934
   85   2HD1  ILE  10          2HD1      ILE  10  -7.600   3.019  -2.663
   86   3HD1  ILE  10          3HD1      ILE  10  -8.950   2.276  -1.806
   87    H    GLY  11           H        GLY  11  -3.883   1.593   1.615
   88   1HA   GLY  11          1HA       GLY  11  -1.442   2.652   0.536
   89   2HA   GLY  11          2HA       GLY  11  -1.780   2.422   2.253
   90    H    VAL  12           H        VAL  12  -2.319  -0.457   1.932
   91    HA   VAL  12           HA       VAL  12   0.280  -1.484   2.432
   92    HB   VAL  12           HB       VAL  12  -2.305  -2.820   1.605
   93   1HG1  VAL  12          1HG1      VAL  12  -0.333  -4.158   0.844
   94   2HG1  VAL  12          2HG1      VAL  12   0.261  -4.167   2.505
   95   3HG1  VAL  12          3HG1      VAL  12  -1.261  -4.965   2.107
   96   1HG2  VAL  12          1HG2      VAL  12  -1.675  -1.674   3.950
   97   2HG2  VAL  12          2HG2      VAL  12  -2.644  -3.144   3.863
   98   3HG2  VAL  12          3HG2      VAL  12  -0.919  -3.246   4.214
   99    H    SER  13           H        SER  13  -1.490  -1.044  -0.565
  100    HA   SER  13           HA       SER  13   0.436  -2.656  -2.102
  101   1HB   SER  13          1HB       SER  13  -1.977  -0.996  -2.842
  102   2HB   SER  13          2HB       SER  13  -0.913  -1.687  -4.065
  103    HG   SER  13           HG       SER  13  -2.452  -3.015  -2.089
  104    H    TYR  14           H        TYR  14  -0.256   0.740  -1.446
  105    HA   TYR  14           HA       TYR  14   1.638   1.739  -3.413
  106   1HB   TYR  14          1HB       TYR  14  -0.372   2.849  -1.782
  107   2HB   TYR  14          2HB       TYR  14   1.135   3.585  -1.237
  108    HD1  TYR  14           HD1      TYR  14  -1.095   3.059  -4.145
  109    HD2  TYR  14           HD2      TYR  14   2.413   5.053  -2.670
  110    HE1  TYR  14           HE1      TYR  14  -1.080   4.517  -6.151
  111    HE2  TYR  14           HE2      TYR  14   2.428   6.511  -4.676
  112    HH   TYR  14           HH       TYR  14   0.467   5.879  -7.421
  113    H    ASP  15           H        ASP  15   1.783   0.721  -0.074
  114    HA   ASP  15           HA       ASP  15   4.210   2.017   0.681
  115   1HB   ASP  15          1HB       ASP  15   2.576  -0.235   1.654
  116   2HB   ASP  15          2HB       ASP  15   4.293  -0.378   2.030
  117    H    GLU  16           H        GLU  16   3.627  -1.158  -0.843
  118    HA   GLU  16           HA       GLU  16   6.349  -1.990  -0.953
  119   1HB   GLU  16          1HB       GLU  16   3.841  -2.916  -1.939
  120   2HB   GLU  16          2HB       GLU  16   4.957  -2.869  -3.305
  121   1HG   GLU  16          1HG       GLU  16   6.023  -4.696  -2.544
  122   2HG   GLU  16          2HG       GLU  16   6.329  -3.906  -0.997
  123    H    TYR  17           H        TYR  17   4.398  -0.053  -3.215
  124    HA   TYR  17           HA       TYR  17   6.452   0.173  -5.224
  125   1HB   TYR  17          1HB       TYR  17   4.376   2.299  -4.727
  126   2HB   TYR  17          2HB       TYR  17   5.037   1.739  -6.264
  127    HD1  TYR  17           HD1      TYR  17   4.873  -1.285  -5.362
  128    HD2  TYR  17           HD2      TYR  17   2.062   1.959  -5.465
  129    HE1  TYR  17           HE1      TYR  17   3.009  -2.907  -5.584
  130    HE2  TYR  17           HE2      TYR  17   0.195   0.338  -5.688
  131    HH   TYR  17           HH       TYR  17  -0.358  -1.799  -5.953
  132    H    ARG  18           H        ARG  18   5.524   2.191  -2.451
  133    HA   ARG  18           HA       ARG  18   7.678   4.109  -2.975
  134   1HB   ARG  18          1HB       ARG  18   5.315   4.202  -1.533
  135   2HB   ARG  18          2HB       ARG  18   6.536   4.076  -0.268
  136   1HG   ARG  18          1HG       ARG  18   7.588   5.909  -2.122
  137   2HG   ARG  18          2HG       ARG  18   5.886   6.343  -1.953
  138   1HD   ARG  18          1HD       ARG  18   6.781   7.522  -0.169
  139   2HD   ARG  18          2HD       ARG  18   6.403   5.994   0.628
  140    HE   ARG  18           HE       ARG  18   9.001   5.669  -0.326
  141   1HH1  ARG  18          1HH1      ARG  18   8.607   8.741   0.411
  142   2HH1  ARG  18          2HH1      ARG  18   9.405   8.747   1.948
  143   1HH2  ARG  18          1HH2      ARG  18   9.477   5.290   2.220
  144   2HH2  ARG  18          2HH2      ARG  18   9.896   6.794   2.973
  145    H    TYR  19           H        TYR  19   7.809   1.010  -2.098
  146    HA   TYR  19           HA       TYR  19   9.792   1.318   0.088
  147   1HB   TYR  19          1HB       TYR  19   7.991  -0.839  -0.937
  148   2HB   TYR  19          2HB       TYR  19   9.500  -1.322  -0.184
  149    HD1  TYR  19           HD1      TYR  19   8.188   1.831   0.969
  150    HD2  TYR  19           HD2      TYR  19   7.981  -2.419   1.544
  151    HE1  TYR  19           HE1      TYR  19   7.197   2.183   3.218
  152    HE2  TYR  19           HE2      TYR  19   6.992  -2.071   3.792
  153    HH   TYR  19           HH       TYR  19   7.193   0.401   5.527
  154    H    ARG  20           H        ARG  20   9.332  -0.134  -3.128
  155    HA   ARG  20           HA       ARG  20  11.867  -1.330  -3.436
  156   1HB   ARG  20          1HB       ARG  20   9.959  -0.098  -5.430
  157   2HB   ARG  20          2HB       ARG  20  11.451  -0.894  -5.931
  158   1HG   ARG  20          1HG       ARG  20  10.652  -2.888  -4.501
  159   2HG   ARG  20          2HG       ARG  20   9.075  -2.098  -4.512
  160   1HD   ARG  20          1HD       ARG  20   9.383  -3.787  -6.357
  161   2HD   ARG  20          2HD       ARG  20   8.982  -2.167  -6.927
  162    HE   ARG  20           HE       ARG  20  11.810  -3.139  -6.880
  163   1HH1  ARG  20          1HH2      ARG  20  10.428  -3.852  -9.376
  164   2HH1  ARG  20          2HH2      ARG  20  10.683  -2.464 -10.380
  165   1HH2  ARG  20          1HH1      ARG  20  11.573  -0.393  -7.745
  166   2HH2  ARG  20          2HH1      ARG  20  11.333  -0.506  -9.456
  167    H    SER  21           H        SER  21  10.899   2.049  -3.848
  168    HA   SER  21           HA       SER  21  13.512   2.782  -4.951
  169   1HB   SER  21          1HB       SER  21  11.391   3.956  -5.596
  170   2HB   SER  21          2HB       SER  21  11.303   4.593  -3.956
  171    HG   SER  21           HG       SER  21  13.107   5.159  -6.026
  172    H    VAL  22           H        VAL  22  12.876   1.774  -2.017
  173    HA   VAL  22           HA       VAL  22  14.843   3.586  -0.792
  174    HB   VAL  22           HB       VAL  22  13.069   4.690   0.082
  175   1HG1  VAL  22          1HG1      VAL  22  11.448   2.163  -0.183
  176   2HG1  VAL  22          2HG1      VAL  22  10.819   3.698   0.406
  177   3HG1  VAL  22          3HG1      VAL  22  11.402   3.562  -1.252
  178   1HG2  VAL  22          1HG2      VAL  22  14.149   3.023   1.906
  179   2HG2  VAL  22          2HG2      VAL  22  12.863   4.161   2.309
  180   3HG2  VAL  22          3HG2      VAL  22  12.474   2.476   1.970
  181    H    ILE  23           H        ILE  23  12.693   1.143   0.677
  182    HA   ILE  23           HA       ILE  23  14.561  -0.113   2.276
  183    HB   ILE  23           HB       ILE  23  12.222  -1.285   0.757
  184   1HG1  ILE  23          1HG1      ILE  23  11.857  -1.392   3.536
  185   2HG1  ILE  23          2HG1      ILE  23  12.633   0.165   3.248
  186   1HG2  ILE  23          1HG2      ILE  23  14.371  -2.661   2.141
  187   2HG2  ILE  23          2HG2      ILE  23  12.827  -2.938   2.947
  188   3HG2  ILE  23          3HG2      ILE  23  13.015  -3.340   1.240
  189   1HD1  ILE  23          1HD1      ILE  23  10.763  -0.026   1.196
  190   2HD1  ILE  23          2HD1      ILE  23   9.925  -0.702   2.593
  191   3HD1  ILE  23          3HD1      ILE  23  10.589   0.929   2.668
  192    H    LYS  24           H        LYS  24  14.256  -0.331  -1.191
  193    HA   LYS  24           HA       LYS  24  16.480  -2.335  -1.214
  194   1HB   LYS  24          1HB       LYS  24  14.052  -2.019  -2.851
  195   2HB   LYS  24          2HB       LYS  24  15.522  -2.284  -3.789
  196   1HG   LYS  24          1HG       LYS  24  16.006  -4.324  -2.623
  197   2HG   LYS  24          2HG       LYS  24  14.756  -4.005  -1.421
  198   1HD   LYS  24          1HD       LYS  24  13.075  -4.722  -2.784
  199   2HD   LYS  24          2HD       LYS  24  13.819  -4.030  -4.226
  200   1HE   LYS  24          1HE       LYS  24  13.797  -6.523  -4.312
  201   2HE   LYS  24          2HE       LYS  24  15.457  -5.895  -4.272
  202   1HZ   LYS  24          1HZ       LYS  24  13.931  -6.606  -1.830
  203   2HZ   LYS  24          2HZ       LYS  24  14.968  -7.695  -2.613
  204   3HZ   LYS  24          3HZ       LYS  24  15.589  -6.258  -1.951
  205    H    ALA  25           H        ALA  25  15.459  -0.344  -3.935
  206    HA   ALA  25           HA       ALA  25  18.156   0.941  -3.868
  207   1HB   ALA  25          1HB       ALA  25  16.487  -0.176  -6.013
  208   2HB   ALA  25          2HB       ALA  25  17.122   1.428  -6.382
  209   3HB   ALA  25          3HB       ALA  25  18.226   0.113  -5.978