*HEADER    RNA                                     19-JAN-05   1YLG              
*TITLE     NMR STRUCTURE OF THE APOB MRNA STEM-LOOP AND ITS                      
*TITLE    2 INTERACTION WITH THE C TO U EDITING APOBEC1 COMPLEMENTARY            
*TITLE    3 FACTOR                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: APOLIPOPROTEIN B MRNA;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: EDITING SITE OF APOBEC-1 ENZYME;                           
*COMPND   5 SYNONYM: APOB MRNA;                                                  
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: IN VITRO T7 POLYMERASE TRANSCRIPTION. THE             
*SOURCE   4 SEQUENCE OF THIS RNA NATURALLY EXISTS IN HOMO SAPIENS                
*SOURCE   5 (HUMAN)                                                              
*KEYWDS    RNA EDITING, APOB MRNA, APOBEC1, ACF, NMR STRUCTURE                   
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.MARIS, J.E.MASSE, F.H.T.ALLAIN, A.CHESTER, N.NAVARATNAM             
*REVDAT   1   01-FEB-05 1YLG    0                                                


#
# 1     GUA   H8    1     GUA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  29, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00, 
      rk2=50.0, rk3=50.0, ir6=1, ialtd=0,
 &end
#
# 1     GUA   H8    1     GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  27, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 1     GUA   H8    1     GUA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  13,   7, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 1     GUA   H8    1     GUA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat=  13,   4, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 1     GUA   H8    1     GUA  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  13,   5, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 1     GUA   H1'   1     GUA   H8    3.7    
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  13, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 2     GUA   H8    1     GUA   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  13, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 2     GUA   H8    3     ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  81, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 2     GUA   H8    1     GUA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  10, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 2     GUA   H8    1     GUA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  29, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 2     GUA   H8    1     GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  27, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 2     GUA   H8    2     GUA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  44, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 2     GUA   H8    2     GUA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  63, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 2     GUA   H8    2     GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  61, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 2     GUA   H8    2     GUA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  41, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 2     GUA   H8    2     GUA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  38, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 2     GUA   H8    2     GUA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  47,  39, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 2     GUA   H1'   1     GUA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  44,  29, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H8    2     GUA   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  47, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 3     ADE   H8    2     GUA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  44, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H8    3     ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  78, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 3     ADE   H8    3     ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  96, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H8    3     ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  94, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 3     ADE   H8    3     ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  75, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H8    3     ADE  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  72, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 3     ADE   H8    3     ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  73, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H1'   2     GUA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  63, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H2    3     ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  90,  78, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 3     ADE   H2    3     ADE  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  90,  96, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 3     ADE   H2    30    CYT   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 3     ADE   H2    4     URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 111, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 3     ADE   H2    4     URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 114, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 3     ADE   H2    30    CYT   H6    6.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 938, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 3     ADE   H2    28    ADE   H2    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 884, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 3     ADE   H8    4     URA   H5    6    
 &rst
  ixpk= 0, nxpk= 0, iat=  81, 116, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 3     ADE   H8    2     GUA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  63, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 3     ADE   H8    2     GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  61, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 3     ADE   H8    2     GUA   H4'   6    
 &rst
  ixpk= 0, nxpk= 0, iat=  81,  41, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4     URA   H6    3     ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  81, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 4     URA   H6    3     ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  78, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4     URA   H6    4     URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 111, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 4     URA   H6    4     URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 126, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4     URA   H6    4     URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 124, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4     URA   H6    4     URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 108, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4     URA   H6    4     URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 105, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 4     URA   H6    4     URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 106, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4     URA   H1'   5     ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 111, 141, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4     URA   H1'   3     ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 111,  96, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 4     URA   H5    4     URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 111, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4     URA   H5    4     URA  1H2'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 126, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4     URA   H5    4     URA   H3'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 116, 124, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4     URA   H5    3     ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  78, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 4     URA   H5    3     ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  96, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 4     URA   H5    3     ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 116,  94, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 4     URA   H6    3     ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  96, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 4     URA   H6    3     ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 114,  94, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 5     ADE   H8    4     URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 111, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5     ADE   H8    5     ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 141, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 5     ADE   H8    5     ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 159, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5     ADE   H8    5     ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 157, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 5     ADE   H8    5     ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 138, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5     ADE   H8    5     ADE  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 135, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 5     ADE   H8    5     ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 136, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5     ADE   H1'   6     URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 174, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 5     ADE   H1'   4     URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 141, 126, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5     ADE   H8    4     URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 114, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 5     ADE   H8    6     URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 177, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 5     ADE   H8    4     URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 126, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 5     ADE   H8    4     URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 124, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 5     ADE   H8    4     URA   H4'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 108, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 5     ADE   H2    5     ADE  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 159, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 5     ADE   H2    5     ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 141, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 5     ADE   H2    6     URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 174, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 5     ADE   H2    6     URA  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 189, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 5     ADE   H2    28    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 872, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 5     ADE   H2    6     URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 177, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 5     ADE   H2    28    ADE   H8    6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 875, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 5     ADE   H2    26    ADE   H2    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 821, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6     URA   H6    5     ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 141, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6     URA   H6    6     URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 174, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 6     URA   H6    6     URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 189, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6     URA   H6    6     URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 187, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 6     URA   H6    6     URA   H4'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 171, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6     URA   H6    6     URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 168, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 6     URA   H6    6     URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 169, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6     URA   H1'   7     ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 204, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 6     URA   H1'   5     ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 174, 159, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 6     URA   H5    6     URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 174, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 6     URA   H5    6     URA  1H2'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 189, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 6     URA   H5    6     URA   H3'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 187, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 6     URA   H5    5     ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 141, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 6     URA   H5    5     ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 159, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 6     URA   H5    5     ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 157, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 6     URA   H6    5     ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 159, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 6     URA   H6    5     ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 157, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 6     URA   H6    7     ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 177, 207, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6     URA   H5    5     ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 179, 144, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H8    6     URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 174, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H8    7     ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 204, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 7     ADE   H8    7     ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 222, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H8    7     ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 220, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 7     ADE   H8    7     ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 201, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H8    7     ADE  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 198, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 7     ADE   H8    7     ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 199, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H1'   8     URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 237, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 7     ADE   H1'   6     URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 204, 189, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H8    6     URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 189, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 7     ADE   H8    6     URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 187, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7     ADE   H8    8     URA   H5    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 242, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H8    8     URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 207, 240, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 7     ADE   H2    7     ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 204, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 7     ADE   H2    7     ADE  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 222, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 7     ADE   H2    8     URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 237, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 7     ADE   H2    8     URA  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 252, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 7     ADE   H2    26    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 809, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 7     ADE   H2    8     URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 240, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 7     ADE   H2    26    ADE   H2    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 821, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 7     ADE   H2    26    ADE   H8    6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 812, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H6    7     ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8     URA   H6    8     URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 237, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 8     URA   H6    8     URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 252, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8     URA   H6    8     URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 250, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8     URA   H6    8     URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 234, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8     URA   H6    8     URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 231, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 8     URA   H6    8     URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 232, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8     URA   H1'   9     GUA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 267, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H1'   7     ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 237, 222, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 8     URA   H5    8     URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 237, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H5    8     URA  1H2'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 252, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H5    8     URA   H3'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 250, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H5    7     ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 204, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H5    7     ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 222, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 8     URA   H5    7     ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 220, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 8     URA   H6    7     ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 222, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 8     URA   H6    7     ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 220, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8     URA   H6    7     ADE   H4'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 201, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 8     URA   H6    9     GUA   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 240, 270, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 9     GUA   H1'   10    ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 301, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 9     GUA   H1'   8     URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 267, 252, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9     GUA   H8    9     GUA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 267, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9     GUA   H8    9     GUA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 286, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9     GUA   H8    9     GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 284, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 9     GUA   H8    9     GUA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 264, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9     GUA   H8    9     GUA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 261, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 9     GUA   H8    9     GUA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 262, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9     GUA   H8    8     URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 237, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 9     GUA   H8    8     URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 252, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 9     GUA   H8    8     URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 250, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 9     GUA   H8    8     URA   H4'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 234, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 9     GUA   H8    10    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 270, 304, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 10    ADE   H8    9     GUA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 267, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H8    10    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 301, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 10    ADE   H8    10    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 319, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H8    10    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 317, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 10    ADE   H8    10    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 298, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H8    10    ADE  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 295, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 10    ADE   H8    10    ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 296, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H1'   9     GUA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 301, 286, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H1'   11    URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 301, 334, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 10    ADE   H1'   11    URA   H6    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 301, 337, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H8    11    URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 337, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 10    ADE   H8    9     GUA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 286, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 10    ADE   H8    9     GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 284, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 10    ADE   H8    9     GUA   H4'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 304, 264, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 10    ADE   H2    10    ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 301, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 10    ADE   H2    11    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 334, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H2    22    CYT   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 681, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 10    ADE   H2    20    ADE   H2    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 630, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 10    ADE   H2    11    URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 313, 337, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11    URA   H1'   12    ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 364, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 11    URA   H1'   10    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 319, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11    URA   H5    11    URA   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 334, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 11    URA   H5    10    ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 301, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 11    URA   H5    10    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 319, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 11    URA   H6    11    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 334, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 11    URA   H6    11    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 349, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11    URA   H6    11    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 347, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11    URA   H6    11    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 331, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11    URA   H6    11    URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 328, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 11    URA   H6    11    URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 329, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11    URA   H6    12    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 367, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11    URA   H6    10    ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 319, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 11    URA   H6    10    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 317, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11    URA   H6    10    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 301, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 11    URA   H5    10    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 304, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H8    11    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 334, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H8    12    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 364, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 12    ADE   H8    12    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 382, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H8    12    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 380, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12    ADE   H8    12    ADE  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 358, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H8    12    ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 359, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H1'   13    CYT   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 397, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 12    ADE   H1'   13    CYT   H6    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 400, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H1'   11    URA  1H2'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 349, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12    ADE   H1'   13    CYT  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 391, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H8    13    CYT   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 400, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12    ADE   H8    11    URA  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 349, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 12    ADE   H8    11    URA   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 347, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 12    ADE   H8    13    CYT   H5    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 402, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H2    13    CYT   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 397, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H2    20    ADE   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 618, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12    ADE   H2    20    ADE   H2    5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 630, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    CYT   H1'   14    ADE   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 428, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    CYT   H1'   14    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 431, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H1'   12    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 382, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H5    12    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 367, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H5    12    ADE   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 364, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    CYT   H5    12    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 382, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H5    12    ADE   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 380, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H5    14    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 431, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    CYT   H6    13    CYT   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 397, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 13    CYT   H6    13    CYT  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 413, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H6    13    CYT   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 411, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 13    CYT   H6    13    CYT   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 394, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    CYT   H6    13    CYT  1H5'   3.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 391, r1= 1.30, r2= 1.80, r3= 3.50, r4= 4.00,  &end
#
# 13    CYT   H6    13    CYT  2H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 392, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    CYT   H6    14    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 431, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    CYT   H6    12    ADE  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 382, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 13    CYT   H6    12    ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 380, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H8    14    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 428, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H8    14    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 446, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H8    14    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 444, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 14    ADE   H8    14    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 425, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H8    14    ADE  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 422, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H8    14    ADE  2H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 423, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 14    ADE   H1'   13    CYT  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 428, 413, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H2    15    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 461, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H2    15    ADE   H2    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 473, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 14    ADE   H8    13    CYT   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 397, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H8    13    CYT  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 413, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 14    ADE   H8    13    CYT   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 411, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H8    13    CYT   H4'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 431, 394, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H8    16    URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 497, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H8    16    URA   H5    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 499, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H8    14    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 428, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 461, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 479, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 15    ADE   H8    15    ADE   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 477, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE   H4'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 458, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H8    15    ADE  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 455, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE  2H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 456, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H8    14    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 446, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 15    ADE   H8    14    ADE   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 444, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    14    ADE   H4'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 464, 425, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H2    16    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 494, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H2    16    URA   H5    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 499, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 16    URA   H5    16    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 499, 509, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16    URA   H5    16    URA   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 499, 507, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16    URA   H5    15    ADE   H3'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 499, 477, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 16    URA   H6    16    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 494, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 16    URA   H6    16    URA  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 509, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 16    URA   H6    16    URA   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 507, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16    URA   H6    16    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 491, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16    URA   H6    16    URA  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 488, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16    URA   H6    16    URA  2H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 489, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 16    URA   H6    15    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 461, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H5    17    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 539, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H5    17    URA   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 537, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H5    17    URA  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 518, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H5    17    URA  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 529, 519, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H6    17    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 524, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 17    URA   H6    17    URA  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 539, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 17    URA   H6    17    URA   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 537, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H6    17    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 521, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H6    17    URA  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 518, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H6    17    URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 527, 519, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H6    17    URA   H1'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 524, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 18    URA   H6    18    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 554, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 18    URA   H6    18    URA  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 569, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 18    URA   H6    18    URA   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 567, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H6    18    URA   H4'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 551, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 18    URA   H6    18    URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 548, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 18    URA   H6    18    URA  2H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 557, 549, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 18    URA   H5    18    URA  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 569, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H5    18    URA   H3'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 567, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H5    18    URA  1H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 548, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H5    18    URA  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 559, 549, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19    GUA   H8    18    URA  1H2'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 569, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 19    GUA   H8    18    URA   H3'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 567, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19    GUA   H8    19    GUA   H1'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 584, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 19    GUA   H8    19    GUA   H3'   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 587, 601, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20    ADE   H8    20    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 618, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 20    ADE   H8    20    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 636, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20    ADE   H8    20    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 634, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20    ADE   H8    20    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 615, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20    ADE   H8    20    ADE  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 612, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 20    ADE   H8    20    ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 613, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20    ADE   H1'   21    URA   H1'   6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 618, 651, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 20    ADE   H8    19    GUA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 584, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20    ADE   H8    19    GUA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 603, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 20    ADE   H8    19    GUA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 621, 601, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 20    ADE   H2    20    ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 618, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 20    ADE   H2    21    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 651, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 20    ADE   H2    12    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 630, 364, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H1'   22    CYT   H6    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 684, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H1'   20    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 636, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H5    21    URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 651, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 21    URA   H5    21    URA  1H2'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 666, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 21    URA   H5    21    URA   H3'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 664, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 21    URA   H6    21    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 666, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H6    21    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 664, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21    URA   H6    21    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 648, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H6    21    URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 645, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 21    URA   H6    21    URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 646, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H6    20    ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 636, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 21    URA   H6    20    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 634, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21    URA   H6    20    ADE   H4'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 615, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 21    URA   H6    20    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 618, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H6    20    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 654, 621, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21    URA   H5    20    ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 618, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 21    URA   H5    20    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 636, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 21    URA   H5    20    ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 634, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 21    URA   H5    20    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 621, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 21    URA   H5    22    CYT   H5    6    
 &rst
  ixpk= 0, nxpk= 0, iat= 656, 686, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 22    CYT   H1'   21    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 681, 666, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 22    CYT   H5    22    CYT  1H2'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 697, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 22    CYT   H5    22    CYT   H3'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 695, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 22    CYT   H5    21    URA   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 651, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 22    CYT   H5    21    URA  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 666, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 22    CYT   H5    21    URA   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 664, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 22    CYT   H5    21    URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 686, 654, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 22    CYT   H6    22    CYT   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 681, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 22    CYT   H6    22    CYT  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 697, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 22    CYT   H6    22    CYT   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 695, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 22    CYT   H6    22    CYT   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 678, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 22    CYT   H6    22    CYT  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 675, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 22    CYT   H6    22    CYT  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 676, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 22    CYT   H6    21    URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 666, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 22    CYT   H6    21    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 664, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 22    CYT   H6    21    URA   H4'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 684, 648, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 23    ADE   H8    22    CYT   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 681, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23    ADE   H8    23    ADE   H1'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 712, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 23    ADE   H8    23    ADE  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 730, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23    ADE   H8    23    ADE   H3'   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 728, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 23    ADE   H8    23    ADE   H4'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 709, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23    ADE   H8    23    ADE  1H5'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 706, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 23    ADE   H8    23    ADE  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 707, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23    ADE   H1'   22    CYT  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 697, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23    ADE   H1'   24    GUA  1H5'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 712, 739, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 23    ADE   H8    22    CYT   H6    5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 684, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 23    ADE   H8    22    CYT  1H2'   2.5
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 697, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 23    ADE   H8    22    CYT   H3'   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 715, 695, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 23    ADE   H2    9     GUA   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 267, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 23    ADE   H2    9     GUA   H8    6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 270, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 23    ADE   H2    24    GUA   H8    5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 748, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 23    ADE   H2    24    GUA   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 745, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24    GUA   H8    23    ADE   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 712, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24    GUA   H8    24    GUA   H1'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 745, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 24    GUA   H8    24    GUA  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 764, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24    GUA   H8    24    GUA   H3'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 762, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 24    GUA   H8    24    GUA  1H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 739, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24    GUA   H8    24    GUA  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 740, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 24    GUA   H8    23    ADE   H8    5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 748, 715, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 25    URA   H1'   26    ADE   H1'   6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 779, 809, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 25    URA   H5    25    URA   H3'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 784, 792, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 25    URA   H6    25    URA   H1'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 779, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 25    URA   H6    25    URA  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 794, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25    URA   H6    25    URA   H3'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 792, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25    URA   H6    25    URA   H4'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 776, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25    URA   H6    25    URA  1H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 773, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25    URA   H6    25    URA  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 774, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 25    URA   H6    24    GUA   H1'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 782, 745, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 26    ADE   H1'   27    URA   H6    4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 809, 845, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H1'   27    URA   H1'   6
 &rst
  ixpk= 0, nxpk= 0, iat= 809, 842, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26    ADE   H2    26    ADE   H1'   6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 809, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26    ADE   H2    26    ADE  1H2'   6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 827, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26    ADE   H2    27    URA   H1'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 842, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 26    ADE   H2    7     ADE   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 204, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H2    7     ADE  1H2'   6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 222, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26    ADE   H2    7     ADE   H8    6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 207, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26    ADE   H2    7     ADE   H2    5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 821, 216, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 26    ADE   H8    26    ADE   H1'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 809, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 26    ADE   H8    26    ADE  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 827, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H8    26    ADE   H3'   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 825, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26    ADE   H8    26    ADE   H4'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 806, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H8    26    ADE  1H5'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 803, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 26    ADE   H8    26    ADE  2H5'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 804, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H8    25    URA   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 779, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H8    25    URA  1H2'   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 794, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26    ADE   H8    25    URA   H3'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 792, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H8    27    URA   H6    5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 812, 845, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 27    URA   H1'   28    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 842, 875, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27    URA   H1'   28    ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 842, 872, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 27    URA   H1'   26    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 842, 827, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27    URA   H5    26    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 812, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27    URA   H5    27    URA   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 842, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 27    URA   H5    27    URA  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 857, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 27    URA   H5    27    URA   H3'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 855, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 27    URA   H5    26    ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 809, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 27    URA   H5    26    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 827, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 27    URA   H5    26    ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 825, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 27    URA   H6    27    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 842, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 27    URA   H6    27    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 857, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27    URA   H6    27    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 855, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27    URA   H6    27    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 839, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27    URA   H6    27    URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 836, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 27    URA   H6    27    URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 837, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 27    URA   H6    26    ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 827, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 27    URA   H6    26    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 825, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27    URA   H6    26    ADE   H4'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 806, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 27    URA   H6    26    ADE   H8    6    
 &rst
  ixpk= 0, nxpk= 0, iat= 845, 812, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H8    27    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 842, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H8    28    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 872, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 28    ADE   H8    28    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 890, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H8    28    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 888, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 28    ADE   H8    28    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 869, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H8    28    ADE  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 866, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 28    ADE   H8    28    ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 867, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H1'   29    URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 872, 905, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H1'   27    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 872, 857, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H8    27    URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 857, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 28    ADE   H8    27    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 855, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 28    ADE   H8    27    URA   H4'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 839, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H8    29    URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 908, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 28    ADE   H8    29    URA   H5    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 875, 910, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H2    28    ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 872, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H2    28    ADE  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 890, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H2    29    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 905, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 28    ADE   H2    29    URA  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 920, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H2    5     ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 141, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 28    ADE   H2    5     ADE   H2    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 153, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 28    ADE   H2    5     ADE   H8    6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 884, 144, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 28    ADE   H1'   29    URA   H6    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 872, 908, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29    URA   H1'   28    ADE  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 905, 890, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29    URA   H5    29    URA   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 905, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 29    URA   H5    29    URA  1H2'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 920, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 29    URA   H5    29    URA   H3'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 918, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 29    URA   H5    28    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 875, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29    URA   H5    28    ADE   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 872, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 29    URA   H5    30    CYT   H5    6    
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 940, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 29    URA   H5    28    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 890, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 29    URA   H5    28    ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 910, 888, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 29    URA   H6    29    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 905, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 29    URA   H6    29    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 920, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29    URA   H6    29    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 918, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29    URA   H6    29    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 902, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29    URA   H6    29    URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 899, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 29    URA   H6    29    URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 900, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 29    URA   H6    28    ADE  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 890, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 29    URA   H6    28    ADE   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 888, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29    URA   H6    28    ADE   H4'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 869, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 29    URA   H6    30    CYT   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 908, 938, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 30    CYT   H1'   31    CYT   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 966, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 30    CYT   H1'   29    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 935, 920, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 30    CYT   H6    30    CYT   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 935, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 30    CYT   H6    30    CYT  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 951, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 30    CYT   H6    30    CYT   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 949, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30    CYT   H6    30    CYT   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 932, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 30    CYT   H6    30    CYT  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 929, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 30    CYT   H6    30    CYT  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 930, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 30    CYT   H6    31    CYT   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 969, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 30    CYT   H6    29    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 905, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 30    CYT   H6    29    URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 920, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 30    CYT   H6    29    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 918, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 30    CYT   H6    29    URA   H4'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 938, 902, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 30    CYT   H5    29    URA   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 940, 905, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 30    CYT   H5    29    URA  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 940, 920, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 30    CYT   H5    29    URA   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 940, 918, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 31    CYT   H1'   30    CYT   H1'   6    
 &rst
  ixpk= 0, nxpk= 0, iat= 966, 935, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 31    CYT   H1'   30    CYT  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 966, 951, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31    CYT   H5    31    CYT   H3'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 980, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31    CYT   H5    30    CYT   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 935, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 31    CYT   H5    30    CYT  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 951, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 31    CYT   H5    30    CYT   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 949, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 31    CYT   H6    30    CYT   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 935, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31    CYT   H6    30    CYT  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 951, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 31    CYT   H6    30    CYT   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 949, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 31    CYT   H6    31    CYT   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 966, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 31    CYT   H6    31    CYT  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 982, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31    CYT   H6    31    CYT   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 980, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 31    CYT   H6    31    CYT   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 963, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 31    CYT   H6    31    CYT  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 960, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 31    CYT   H6    31    CYT  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 969, 961, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 1     GUA   H1    31    CYT   H41   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  19, 974, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 1     GUA   H1    31    CYT   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  19, 966, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 1     GUA   H21   31    CYT   O2    3.0
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 978, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 2     GUA   H1    30    CYT   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 935, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 2     GUA   H1    30    CYT   H41   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 943, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 2     GUA   H21   30    CYT   O2    3.0
 &rst
  ixpk= 0, nxpk= 0, iat=  56, 947, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 2     GUA   H1    29    URA   H3    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat=  53, 914, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 29    URA   H3    3     ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 914,  90, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29    URA   H3    3     ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 914,  86, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29    URA   O4    3     ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 912,  86, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 29    URA   H3    4     URA   H3    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 120, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 29    URA   H3    3     ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 914,  86, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4     URA   H3    28    ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 884, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4     URA   H3    28    ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 880, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4     URA   O4    28    ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 118, 880, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 4     URA   H3    27    URA   H3    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 851, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 27    URA   H3    5     ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 851, 153, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27    URA   H3    5     ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 851, 149, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27    URA   O4    5     ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 849, 149, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27    URA   H3    6     URA   H3    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 851, 183, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 6     URA   H3    26    ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 821, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 6     URA   H3    26    ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 817, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 6     URA   O4    26    ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 817, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8     URA   H3    23    ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 724, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8     URA   H3    23    ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 720, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8     URA   O4    23    ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 244, 720, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8     URA   H3    9     GUA   H1    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 246, 276, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 9     GUA   H21   22    CYT   O2    3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 279, 693, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 9     GUA   H1    22    CYT   H41   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 689, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 9     GUA   H1    21    URA   H3    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 660, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 9     GUA   H1    22    CYT   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 681, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 21    URA   H3    10    ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 660, 313, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21    URA   O4    10    ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 309, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21    URA   H3    10    ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 660, 309, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21    URA   H3    11    URA   H3    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 660, 343, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 11    URA   H3    20    ADE   H2    3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 630, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11    URA   O4    20    ADE   H61   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 626, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11    URA   H3    20    ADE   H61   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 626, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
# 986 atoms read from pdb file ../apobec.pdb.
# 1 GUA DELTA:  (1 RG5 C5')-(1 RG5 C4')-(1 RG5 C3')-(1 RG5 O3')  65.0 180.0
 &rst     iat =     3,     6,    26,    32,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
   rk2 =   1000.0, rk3 =   1000.0,    &end

# 2 GUA DELTA:  (2 RG C5')-(2 RG C4')-(2 RG C3')-(2 RG O3')  65.0 105.0
 &rst     iat =    37,    40,    60,    66,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 3 ADE DELTA:  (3 RA C5')-(3 RA C4')-(3 RA C3')-(3 RA O3')  65.0 105.0
 &rst     iat =    71,    74,    93,    99,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 4 URA DELTA:  (4 RU C5')-(4 RU C4')-(4 RU C3')-(4 RU O3')  65.0 105.0
 &rst     iat =   104,   107,   123,   129,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 5 ADE DELTA:  (5 RA C5')-(5 RA C4')-(5 RA C3')-(5 RA O3')  65.0 105.0
 &rst     iat =   134,   137,   156,   162,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 6 URA DELTA:  (6 RU C5')-(6 RU C4')-(6 RU C3')-(6 RU O3')  65.0 105.0
 &rst     iat =   167,   170,   186,   192,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 7 ADE DELTA:  (7 RA C5')-(7 RA C4')-(7 RA C3')-(7 RA O3')  65.0 105.0
 &rst     iat =   197,   200,   219,   225,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 8 URA DELTA:  (8 RU C5')-(8 RU C4')-(8 RU C3')-(8 RU O3')  65.0 105.0
 &rst     iat =   230,   233,   249,   255,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 9 GUA DELTA:  (9 RG C5')-(9 RG C4')-(9 RG C3')-(9 RG O3')  65.0 105.0
 &rst     iat =   260,   263,   283,   289,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 10 ADE DELTA:  (10 RA C5')-(10 RA C4')-(10 RA C3')-(10 RA O3')  65.0 105.0
 &rst     iat =   294,   297,   316,   322,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 11 URA DELTA:  (11 RU C5')-(11 RU C4')-(11 RU C3')-(11 RU O3')  65.0 180.0
 &rst     iat =   327,   330,   346,   352,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 12 ADE DELTA:  (12 RA C5')-(12 RA C4')-(12 RA C3')-(12 RA O3')  65.0 180.0
 &rst     iat =   357,   360,   379,   385,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 13 CYT DELTA:  (13 RC C5')-(13 RC C4')-(13 RC C3')-(13 RC O3')  65.0 180.0
 &rst     iat =   390,   393,   410,   416,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 14 ADE DELTA:  (14 RA C5')-(14 RA C4')-(14 RA C3')-(14 RA O3')  65.0 180.0
 &rst     iat =   421,   424,   443,   449,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 15 ADE DELTA:  (15 RA C5')-(15 RA C4')-(15 RA C3')-(15 RA O3')  65.0 180.0
 &rst     iat =   454,   457,   476,   482,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 16 URA DELTA:  (16 RU C5')-(16 RU C4')-(16 RU C3')-(16 RU O3')  65.0 180.0
 &rst     iat =   487,   490,   506,   512,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 17 URA DELTA:  (17 RU C5')-(17 RU C4')-(17 RU C3')-(17 RU O3')  65.0 180.0
 &rst     iat =   517,   520,   536,   542,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 18 URA DELTA:  (18 RU C5')-(18 RU C4')-(18 RU C3')-(18 RU O3')  65.0 180.0
 &rst     iat =   547,   550,   566,   572,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 19 GUA DELTA:  (19 RG C5')-(19 RG C4')-(19 RG C3')-(19 RG O3')  65.0 180.0
 &rst     iat =   577,   580,   600,   606,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 20 ADE DELTA:  (20 RA C5')-(20 RA C4')-(20 RA C3')-(20 RA O3')  65.0 105.0
 &rst     iat =   611,   614,   633,   639,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 21 URA DELTA:  (21 RU C5')-(21 RU C4')-(21 RU C3')-(21 RU O3')  65.0 105.0
 &rst     iat =   644,   647,   663,   669,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 22 CYT DELTA:  (22 RC C5')-(22 RC C4')-(22 RC C3')-(22 RC O3')  65.0 105.0
 &rst     iat =   674,   677,   694,   700,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 23 ADE DELTA:  (23 RA C5')-(23 RA C4')-(23 RA C3')-(23 RA O3')  65.0 105.0
 &rst     iat =   705,   708,   727,   733,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 24 GUA DELTA:  (24 RG C5')-(24 RG C4')-(24 RG C3')-(24 RG O3')  65.0 180.0
 &rst     iat =   738,   741,   761,   767,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 25 URA DELTA:  (25 RU C5')-(25 RU C4')-(25 RU C3')-(25 RU O3')  65.0 180.0
 &rst     iat =   772,   775,   791,   797,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 26 ADE DELTA:  (26 RA C5')-(26 RA C4')-(26 RA C3')-(26 RA O3')  65.0 105.0
 &rst     iat =   802,   805,   824,   830,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 27 URA DELTA:  (27 RU C5')-(27 RU C4')-(27 RU C3')-(27 RU O3')  65.0 105.0
 &rst     iat =   835,   838,   854,   860,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 28 ADE DELTA:  (28 RA C5')-(28 RA C4')-(28 RA C3')-(28 RA O3')  65.0 105.0
 &rst     iat =   865,   868,   887,   893,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 29 URA DELTA:  (29 RU C5')-(29 RU C4')-(29 RU C3')-(29 RU O3')  65.0 105.0
 &rst     iat =   898,   901,   917,   923,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 30 CYT DELTA:  (30 RC C5')-(30 RC C4')-(30 RC C3')-(30 RC O3')  65.0 105.0
 &rst     iat =   928,   931,   948,   954,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 31 CYT DELTA:  (31 RC3 C5')-(31 RC3 C4')-(31 RC3 C3')-(31 RC3 O3')  65.0 180.0
 &rst     iat =   959,   962,   979,   985,
   r1 =  64.0, r2 =  65.0, r3 = 180.0, r4 = 181.0,
 &end

# 2 GUA ALPHA:  (1 RG5 O3')-(2 RG P)-(2 RG O5')-(2 RG C5') 290.0 310.0
 &rst     iat =    32,    33,    36,    37,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
          rk2 =   500.0, rk3 =   500.0, &end

# 3 ADE ALPHA:  (2 RG O3')-(3 RA P)-(3 RA O5')-(3 RA C5') 290.0 310.0
 &rst     iat =    66,    67,    70,    71,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 4 URA ALPHA:  (3 RA O3')-(4 RU P)-(4 RU O5')-(4 RU C5') 290.0 310.0
 &rst     iat =    99,   100,   103,   104,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 5 ADE ALPHA:  (4 RU O3')-(5 RA P)-(5 RA O5')-(5 RA C5') 290.0 310.0
 &rst     iat =   129,   130,   133,   134,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 27 URA ALPHA:  (26 RA O3')-(27 RU P)-(27 RU O5')-(27 RU C5') 290.0 310.0
 &rst     iat =   830,   831,   834,   835,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 28 ADE ALPHA:  (27 RU O3')-(28 RA P)-(28 RA O5')-(28 RA C5') 290.0 310.0
 &rst     iat =   860,   861,   864,   865,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 29 URA ALPHA:  (28 RA O3')-(29 RU P)-(29 RU O5')-(29 RU C5') 290.0 310.0
 &rst     iat =   893,   894,   897,   898,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 30 CYT ALPHA:  (29 RU O3')-(30 RC P)-(30 RC O5')-(30 RC C5') 290.0 310.0
 &rst     iat =   923,   924,   927,   928,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 31 CYT ALPHA:  (30 RC O3')-(31 RC3 P)-(31 RC3 O5')-(31 RC3 C5') 290.0 310.0
 &rst     iat =   954,   955,   958,   959,
   r1 = 289.0, r2 = 290.0, r3 = 310.0, r4 = 311.0,
 &end

# 2 GUA BETA:  (2 RG P)-(2 RG O5')-(2 RG C5')-(2 RG C4') 170.0 190.0
 &rst     iat =    33,    36,    37,    40,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 3 ADE BETA:  (3 RA P)-(3 RA O5')-(3 RA C5')-(3 RA C4') 170.0 190.0
 &rst     iat =    67,    70,    71,    74,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 4 URA BETA:  (4 RU P)-(4 RU O5')-(4 RU C5')-(4 RU C4') 170.0 190.0
 &rst     iat =   100,   103,   104,   107,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 5 ADE BETA:  (5 RA P)-(5 RA O5')-(5 RA C5')-(5 RA C4') 170.0 190.0
 &rst     iat =   130,   133,   134,   137,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 27 URA BETA:  (27 RU P)-(27 RU O5')-(27 RU C5')-(27 RU C4') 170.0 190.0
 &rst     iat =   831,   834,   835,   838,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 28 ADE BETA:  (28 RA P)-(28 RA O5')-(28 RA C5')-(28 RA C4') 170.0 190.0
 &rst     iat =   861,   864,   865,   868,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 29 URA BETA:  (29 RU P)-(29 RU O5')-(29 RU C5')-(29 RU C4') 170.0 190.0
 &rst     iat =   894,   897,   898,   901,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 30 CYT BETA:  (30 RC P)-(30 RC O5')-(30 RC C5')-(30 RC C4') 170.0 190.0
 &rst     iat =   924,   927,   928,   931,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 31 CYT BETA:  (31 RC3 P)-(31 RC3 O5')-(31 RC3 C5')-(31 RC3 C4') 170.0 190.0
 &rst     iat =   955,   958,   959,   962,
   r1 = 169.0, r2 = 170.0, r3 = 190.0, r4 = 191.0,
 &end

# 2 GUA GAMMA:  (2 RG O5')-(2 RG C5')-(2 RG C4')-(2 RG C3')  40.0  60.0
 &rst     iat =    36,    37,    40,    60,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 3 ADE GAMMA:  (3 RA O5')-(3 RA C5')-(3 RA C4')-(3 RA C3')  40.0  60.0
 &rst     iat =    70,    71,    74,    93,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 4 URA GAMMA:  (4 RU O5')-(4 RU C5')-(4 RU C4')-(4 RU C3')  40.0  60.0
 &rst     iat =   103,   104,   107,   123,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 5 ADE GAMMA:  (5 RA O5')-(5 RA C5')-(5 RA C4')-(5 RA C3')  40.0  60.0
 &rst     iat =   133,   134,   137,   156,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 27 URA GAMMA:  (27 RU O5')-(27 RU C5')-(27 RU C4')-(27 RU C3')  40.0  60.0
 &rst     iat =   834,   835,   838,   854,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 28 ADE GAMMA:  (28 RA O5')-(28 RA C5')-(28 RA C4')-(28 RA C3')  40.0  60.0
 &rst     iat =   864,   865,   868,   887,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 29 URA GAMMA:  (29 RU O5')-(29 RU C5')-(29 RU C4')-(29 RU C3')  40.0  60.0
 &rst     iat =   897,   898,   901,   917,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 30 CYT GAMMA:  (30 RC O5')-(30 RC C5')-(30 RC C4')-(30 RC C3')  40.0  60.0
 &rst     iat =   927,   928,   931,   948,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 31 CYT GAMMA:  (31 RC3 O5')-(31 RC3 C5')-(31 RC3 C4')-(31 RC3 C3')  40.0  60.0
 &rst     iat =   958,   959,   962,   979,
   r1 =  39.0, r2 =  40.0, r3 =  60.0, r4 =  61.0,
 &end

# 1 GUA EPSLN:  (1 RG5 C4')-(1 RG5 C3')-(1 RG5 O3')-(2 RG P) 200.0 220.0
 &rst     iat =     6,    26,    32,    33,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 2 GUA EPSLN:  (2 RG C4')-(2 RG C3')-(2 RG O3')-(3 RA P) 200.0 220.0
 &rst     iat =    40,    60,    66,    67,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 3 ADE EPSLN:  (3 RA C4')-(3 RA C3')-(3 RA O3')-(4 RU P) 200.0 220.0
 &rst     iat =    74,    93,    99,   100,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 4 URA EPSLN:  (4 RU C4')-(4 RU C3')-(4 RU O3')-(5 RA P) 200.0 220.0
 &rst     iat =   107,   123,   129,   130,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 5 ADE EPSLN:  (5 RA C4')-(5 RA C3')-(5 RA O3')-(6 RU P) 200.0 220.0
 &rst     iat =   137,   156,   162,   163,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 27 URA EPSLN:  (27 RU C4')-(27 RU C3')-(27 RU O3')-(28 RA P) 200.0 220.0
 &rst     iat =   838,   854,   860,   861,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 28 ADE EPSLN:  (28 RA C4')-(28 RA C3')-(28 RA O3')-(29 RU P) 200.0 220.0
 &rst     iat =   868,   887,   893,   894,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 29 URA EPSLN:  (29 RU C4')-(29 RU C3')-(29 RU O3')-(30 RC P) 200.0 220.0
 &rst     iat =   901,   917,   923,   924,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 30 CYT EPSLN:  (30 RC C4')-(30 RC C3')-(30 RC O3')-(31 RC3 P) 200.0 220.0
 &rst     iat =   931,   948,   954,   955,
   r1 = 199.0, r2 = 200.0, r3 = 220.0, r4 = 221.0,
 &end

# 2 GUA ZETA:  (2 RG C3')-(2 RG O3')-(3 RA P)-(3 RA O5') 280.0 300.0
 &rst     iat =    60,    66,    67,    70,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 3 ADE ZETA:  (3 RA C3')-(3 RA O3')-(4 RU P)-(4 RU O5') 280.0 300.0
 &rst     iat =    93,    99,   100,   103,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 4 URA ZETA:  (4 RU C3')-(4 RU O3')-(5 RA P)-(5 RA O5') 280.0 300.0
 &rst     iat =   123,   129,   130,   133,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 5 ADE ZETA:  (5 RA C3')-(5 RA O3')-(6 RU P)-(6 RU O5') 280.0 300.0
 &rst     iat =   156,   162,   163,   166,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 27 URA ZETA:  (27 RU C3')-(27 RU O3')-(28 RA P)-(28 RA O5') 280.0 300.0
 &rst     iat =   854,   860,   861,   864,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 28 ADE ZETA:  (28 RA C3')-(28 RA O3')-(29 RU P)-(29 RU O5') 280.0 300.0
 &rst     iat =   887,   893,   894,   897,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 29 URA ZETA:  (29 RU C3')-(29 RU O3')-(30 RC P)-(30 RC O5') 280.0 300.0
 &rst     iat =   917,   923,   924,   927,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 30 CYT ZETA:  (30 RC C3')-(30 RC O3')-(31 RC3 P)-(31 RC3 O5') 280.0 300.0
 &rst     iat =   948,   954,   955,   958,
   r1 = 279.0, r2 = 280.0, r3 = 300.0, r4 = 301.0,
 &end

# 1 GUA CHI:  (1 RG5 O4')-(1 RG5 C1')-(1 RG5 N9)-(1 RG5 C4) 180.0 220.0
 &rst     iat =     8,     9,    11,    25,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 2 GUA CHI:  (2 RG O4')-(2 RG C1')-(2 RG N9)-(2 RG C4) 180.0 220.0
 &rst     iat =    42,    43,    45,    59,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 3 ADE CHI:  (3 RA O4')-(3 RA C1')-(3 RA N9)-(3 RA C4) 180.0 220.0
 &rst     iat =    76,    77,    79,    92,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 4 URA CHI:  (4 RU O4')-(4 RU C1')-(4 RU N1)-(4 RU C2) 180.0 220.0
 &rst     iat =   109,   110,   112,   121,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 5 ADE CHI:  (5 RA O4')-(5 RA C1')-(5 RA N9)-(5 RA C4) 180.0 220.0
 &rst     iat =   139,   140,   142,   155,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 27 URA CHI:  (27 RU O4')-(27 RU C1')-(27 RU N1)-(27 RU C2) 180.0 220.0
 &rst     iat =   840,   841,   843,   852,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 28 ADE CHI:  (28 RA O4')-(28 RA C1')-(28 RA N9)-(28 RA C4) 180.0 220.0
 &rst     iat =   870,   871,   873,   886,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 29 URA CHI:  (29 RU O4')-(29 RU C1')-(29 RU N1)-(29 RU C2) 180.0 220.0
 &rst     iat =   903,   904,   906,   915,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 30 CYT CHI:  (30 RC O4')-(30 RC C1')-(30 RC N1)-(30 RC C2) 180.0 220.0
 &rst     iat =   933,   934,   936,   946,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

# 31 CYT CHI:  (31 RC3 O4')-(31 RC3 C1')-(31 RC3 N1)-(31 RC3 C2) 180.0 220.0
 &rst     iat =   964,   965,   967,   977,
   r1 = 179.0, r2 = 180.0, r3 = 220.0, r4 = 221.0,
 &end

#
#  chirality for residue 1 atoms:  C2' O4' N9 H1'
 &rst iat=28,8,11,10, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
#
#  chirality for residue 1 atoms:  C3' C1' H2'1 O2'
 &rst iat=26,9,29,30, &end
#
#  chirality for residue 1 atoms:  O3' C2' C4' H3'
 &rst iat=32,28,6,27, &end
#
#  chirality for residue 1 atoms:  C3' C5' O4' H4'
 &rst iat=26,3,8,7, &end
#
#  chirality for residue 1 atoms:  C4' O5' H5'1 H5'2
 &rst iat=6,2,4,5, &end
#
#  chirality for residue 2 atoms:  C2' O4' N9 H1'
 &rst iat=62,42,45,44, &end
#
#  chirality for residue 2 atoms:  C3' C1' H2'1 O2'
 &rst iat=60,43,63,64, &end
#
#  chirality for residue 2 atoms:  O3' C2' C4' H3'
 &rst iat=66,62,40,61, &end
#
#  chirality for residue 2 atoms:  C3' C5' O4' H4'
 &rst iat=60,37,42,41, &end
#
#  chirality for residue 2 atoms:  C4' O5' H5'1 H5'2
 &rst iat=40,36,38,39, &end
#
#  chirality for residue 3 atoms:  C2' O4' N9 H1'
 &rst iat=95,76,79,78, &end
#
#  chirality for residue 3 atoms:  C3' C1' H2'1 O2'
 &rst iat=93,77,96,97, &end
#
#  chirality for residue 3 atoms:  O3' C2' C4' H3'
 &rst iat=99,95,74,94, &end
#
#  chirality for residue 3 atoms:  C3' C5' O4' H4'
 &rst iat=93,71,76,75, &end
#
#  chirality for residue 3 atoms:  C4' O5' H5'1 H5'2
 &rst iat=74,70,72,73, &end
#
#  chirality for residue 4 atoms:  C2' O4' N1 H1'
 &rst iat=125,109,112,111, &end
#
#  chirality for residue 4 atoms:  C3' C1' H2'1 O2'
 &rst iat=123,110,126,127, &end
#
#  chirality for residue 4 atoms:  O3' C2' C4' H3'
 &rst iat=129,125,107,124, &end
#
#  chirality for residue 4 atoms:  C3' C5' O4' H4'
 &rst iat=123,104,109,108, &end
#
#  chirality for residue 4 atoms:  C4' O5' H5'1 H5'2
 &rst iat=107,103,105,106, &end
#
#  chirality for residue 5 atoms:  C2' O4' N9 H1'
 &rst iat=158,139,142,141, &end
#
#  chirality for residue 5 atoms:  C3' C1' H2'1 O2'
 &rst iat=156,140,159,160, &end
#
#  chirality for residue 5 atoms:  O3' C2' C4' H3'
 &rst iat=162,158,137,157, &end
#
#  chirality for residue 5 atoms:  C3' C5' O4' H4'
 &rst iat=156,134,139,138, &end
#
#  chirality for residue 5 atoms:  C4' O5' H5'1 H5'2
 &rst iat=137,133,135,136, &end
#
#  chirality for residue 6 atoms:  C2' O4' N1 H1'
 &rst iat=188,172,175,174, &end
#
#  chirality for residue 6 atoms:  C3' C1' H2'1 O2'
 &rst iat=186,173,189,190, &end
#
#  chirality for residue 6 atoms:  O3' C2' C4' H3'
 &rst iat=192,188,170,187, &end
#
#  chirality for residue 6 atoms:  C3' C5' O4' H4'
 &rst iat=186,167,172,171, &end
#
#  chirality for residue 6 atoms:  C4' O5' H5'1 H5'2
 &rst iat=170,166,168,169, &end
#
#  chirality for residue 7 atoms:  C2' O4' N9 H1'
 &rst iat=221,202,205,204, &end
#
#  chirality for residue 7 atoms:  C3' C1' H2'1 O2'
 &rst iat=219,203,222,223, &end
#
#  chirality for residue 7 atoms:  O3' C2' C4' H3'
 &rst iat=225,221,200,220, &end
#
#  chirality for residue 7 atoms:  C3' C5' O4' H4'
 &rst iat=219,197,202,201, &end
#
#  chirality for residue 7 atoms:  C4' O5' H5'1 H5'2
 &rst iat=200,196,198,199, &end
#
#  chirality for residue 8 atoms:  C2' O4' N1 H1'
 &rst iat=251,235,238,237, &end
#
#  chirality for residue 8 atoms:  C3' C1' H2'1 O2'
 &rst iat=249,236,252,253, &end
#
#  chirality for residue 8 atoms:  O3' C2' C4' H3'
 &rst iat=255,251,233,250, &end
#
#  chirality for residue 8 atoms:  C3' C5' O4' H4'
 &rst iat=249,230,235,234, &end
#
#  chirality for residue 8 atoms:  C4' O5' H5'1 H5'2
 &rst iat=233,229,231,232, &end
#
#  chirality for residue 9 atoms:  C2' O4' N9 H1'
 &rst iat=285,265,268,267, &end
#
#  chirality for residue 9 atoms:  C3' C1' H2'1 O2'
 &rst iat=283,266,286,287, &end
#
#  chirality for residue 9 atoms:  O3' C2' C4' H3'
 &rst iat=289,285,263,284, &end
#
#  chirality for residue 9 atoms:  C3' C5' O4' H4'
 &rst iat=283,260,265,264, &end
#
#  chirality for residue 9 atoms:  C4' O5' H5'1 H5'2
 &rst iat=263,259,261,262, &end
#
#  chirality for residue 10 atoms:  C2' O4' N9 H1'
 &rst iat=318,299,302,301, &end
#
#  chirality for residue 10 atoms:  C3' C1' H2'1 O2'
 &rst iat=316,300,319,320, &end
#
#  chirality for residue 10 atoms:  O3' C2' C4' H3'
 &rst iat=322,318,297,317, &end
#
#  chirality for residue 10 atoms:  C3' C5' O4' H4'
 &rst iat=316,294,299,298, &end
#
#  chirality for residue 10 atoms:  C4' O5' H5'1 H5'2
 &rst iat=297,293,295,296, &end
#
#  chirality for residue 11 atoms:  C2' O4' N1 H1'
 &rst iat=348,332,335,334, &end
#
#  chirality for residue 11 atoms:  C3' C1' H2'1 O2'
 &rst iat=346,333,349,350, &end
#
#  chirality for residue 11 atoms:  O3' C2' C4' H3'
 &rst iat=352,348,330,347, &end
#
#  chirality for residue 11 atoms:  C3' C5' O4' H4'
 &rst iat=346,327,332,331, &end
#
#  chirality for residue 11 atoms:  C4' O5' H5'1 H5'2
 &rst iat=330,326,328,329, &end
#
#  chirality for residue 12 atoms:  C2' O4' N9 H1'
 &rst iat=381,362,365,364, &end
#
#  chirality for residue 12 atoms:  C3' C1' H2'1 O2'
 &rst iat=379,363,382,383, &end
#
#  chirality for residue 12 atoms:  O3' C2' C4' H3'
 &rst iat=385,381,360,380, &end
#
#  chirality for residue 12 atoms:  C3' C5' O4' H4'
 &rst iat=379,357,362,361, &end
#
#  chirality for residue 12 atoms:  C4' O5' H5'1 H5'2
 &rst iat=360,356,358,359, &end
#
#  chirality for residue 13 atoms:  C2' O4' N1 H1'
 &rst iat=412,395,398,397, &end
#
#  chirality for residue 13 atoms:  C3' C1' H2'1 O2'
 &rst iat=410,396,413,414, &end
#
#  chirality for residue 13 atoms:  O3' C2' C4' H3'
 &rst iat=416,412,393,411, &end
#
#  chirality for residue 13 atoms:  C3' C5' O4' H4'
 &rst iat=410,390,395,394, &end
#
#  chirality for residue 13 atoms:  C4' O5' H5'1 H5'2
 &rst iat=393,389,391,392, &end
#
#  chirality for residue 14 atoms:  C2' O4' N9 H1'
 &rst iat=445,426,429,428, &end
#
#  chirality for residue 14 atoms:  C3' C1' H2'1 O2'
 &rst iat=443,427,446,447, &end
#
#  chirality for residue 14 atoms:  O3' C2' C4' H3'
 &rst iat=449,445,424,444, &end
#
#  chirality for residue 14 atoms:  C3' C5' O4' H4'
 &rst iat=443,421,426,425, &end
#
#  chirality for residue 14 atoms:  C4' O5' H5'1 H5'2
 &rst iat=424,420,422,423, &end
#
#  chirality for residue 15 atoms:  C2' O4' N9 H1'
 &rst iat=478,459,462,461, &end
#
#  chirality for residue 15 atoms:  C3' C1' H2'1 O2'
 &rst iat=476,460,479,480, &end
#
#  chirality for residue 15 atoms:  O3' C2' C4' H3'
 &rst iat=482,478,457,477, &end
#
#  chirality for residue 15 atoms:  C3' C5' O4' H4'
 &rst iat=476,454,459,458, &end
#
#  chirality for residue 15 atoms:  C4' O5' H5'1 H5'2
 &rst iat=457,453,455,456, &end
#
#  chirality for residue 16 atoms:  C2' O4' N1 H1'
 &rst iat=508,492,495,494, &end
#
#  chirality for residue 16 atoms:  C3' C1' H2'1 O2'
 &rst iat=506,493,509,510, &end
#
#  chirality for residue 16 atoms:  O3' C2' C4' H3'
 &rst iat=512,508,490,507, &end
#
#  chirality for residue 16 atoms:  C3' C5' O4' H4'
 &rst iat=506,487,492,491, &end
#
#  chirality for residue 16 atoms:  C4' O5' H5'1 H5'2
 &rst iat=490,486,488,489, &end
#
#  chirality for residue 17 atoms:  C2' O4' N1 H1'
 &rst iat=538,522,525,524, &end
#
#  chirality for residue 17 atoms:  C3' C1' H2'1 O2'
 &rst iat=536,523,539,540, &end
#
#  chirality for residue 17 atoms:  O3' C2' C4' H3'
 &rst iat=542,538,520,537, &end
#
#  chirality for residue 17 atoms:  C3' C5' O4' H4'
 &rst iat=536,517,522,521, &end
#
#  chirality for residue 17 atoms:  C4' O5' H5'1 H5'2
 &rst iat=520,516,518,519, &end
#
#  chirality for residue 18 atoms:  C2' O4' N1 H1'
 &rst iat=568,552,555,554, &end
#
#  chirality for residue 18 atoms:  C3' C1' H2'1 O2'
 &rst iat=566,553,569,570, &end
#
#  chirality for residue 18 atoms:  O3' C2' C4' H3'
 &rst iat=572,568,550,567, &end
#
#  chirality for residue 18 atoms:  C3' C5' O4' H4'
 &rst iat=566,547,552,551, &end
#
#  chirality for residue 18 atoms:  C4' O5' H5'1 H5'2
 &rst iat=550,546,548,549, &end
#
#  chirality for residue 19 atoms:  C2' O4' N9 H1'
 &rst iat=602,582,585,584, &end
#
#  chirality for residue 19 atoms:  C3' C1' H2'1 O2'
 &rst iat=600,583,603,604, &end
#
#  chirality for residue 19 atoms:  O3' C2' C4' H3'
 &rst iat=606,602,580,601, &end
#
#  chirality for residue 19 atoms:  C3' C5' O4' H4'
 &rst iat=600,577,582,581, &end
#
#  chirality for residue 19 atoms:  C4' O5' H5'1 H5'2
 &rst iat=580,576,578,579, &end
#
#  chirality for residue 20 atoms:  C2' O4' N9 H1'
 &rst iat=635,616,619,618, &end
#
#  chirality for residue 20 atoms:  C3' C1' H2'1 O2'
 &rst iat=633,617,636,637, &end
#
#  chirality for residue 20 atoms:  O3' C2' C4' H3'
 &rst iat=639,635,614,634, &end
#
#  chirality for residue 20 atoms:  C3' C5' O4' H4'
 &rst iat=633,611,616,615, &end
#
#  chirality for residue 20 atoms:  C4' O5' H5'1 H5'2
 &rst iat=614,610,612,613, &end
#
#  chirality for residue 21 atoms:  C2' O4' N1 H1'
 &rst iat=665,649,652,651, &end
#
#  chirality for residue 21 atoms:  C3' C1' H2'1 O2'
 &rst iat=663,650,666,667, &end
#
#  chirality for residue 21 atoms:  O3' C2' C4' H3'
 &rst iat=669,665,647,664, &end
#
#  chirality for residue 21 atoms:  C3' C5' O4' H4'
 &rst iat=663,644,649,648, &end
#
#  chirality for residue 21 atoms:  C4' O5' H5'1 H5'2
 &rst iat=647,643,645,646, &end
#
#  chirality for residue 22 atoms:  C2' O4' N1 H1'
 &rst iat=696,679,682,681, &end
#
#  chirality for residue 22 atoms:  C3' C1' H2'1 O2'
 &rst iat=694,680,697,698, &end
#
#  chirality for residue 22 atoms:  O3' C2' C4' H3'
 &rst iat=700,696,677,695, &end
#
#  chirality for residue 22 atoms:  C3' C5' O4' H4'
 &rst iat=694,674,679,678, &end
#
#  chirality for residue 22 atoms:  C4' O5' H5'1 H5'2
 &rst iat=677,673,675,676, &end
#
#  chirality for residue 23 atoms:  C2' O4' N9 H1'
 &rst iat=729,710,713,712, &end
#
#  chirality for residue 23 atoms:  C3' C1' H2'1 O2'
 &rst iat=727,711,730,731, &end
#
#  chirality for residue 23 atoms:  O3' C2' C4' H3'
 &rst iat=733,729,708,728, &end
#
#  chirality for residue 23 atoms:  C3' C5' O4' H4'
 &rst iat=727,705,710,709, &end
#
#  chirality for residue 23 atoms:  C4' O5' H5'1 H5'2
 &rst iat=708,704,706,707, &end
#
#  chirality for residue 24 atoms:  C2' O4' N9 H1'
 &rst iat=763,743,746,745, &end
#
#  chirality for residue 24 atoms:  C3' C1' H2'1 O2'
 &rst iat=761,744,764,765, &end
#
#  chirality for residue 24 atoms:  O3' C2' C4' H3'
 &rst iat=767,763,741,762, &end
#
#  chirality for residue 24 atoms:  C3' C5' O4' H4'
 &rst iat=761,738,743,742, &end
#
#  chirality for residue 24 atoms:  C4' O5' H5'1 H5'2
 &rst iat=741,737,739,740, &end
#
#  chirality for residue 25 atoms:  C2' O4' N1 H1'
 &rst iat=793,777,780,779, &end
#
#  chirality for residue 25 atoms:  C3' C1' H2'1 O2'
 &rst iat=791,778,794,795, &end
#
#  chirality for residue 25 atoms:  O3' C2' C4' H3'
 &rst iat=797,793,775,792, &end
#
#  chirality for residue 25 atoms:  C3' C5' O4' H4'
 &rst iat=791,772,777,776, &end
#
#  chirality for residue 25 atoms:  C4' O5' H5'1 H5'2
 &rst iat=775,771,773,774, &end
#
#  chirality for residue 26 atoms:  C2' O4' N9 H1'
 &rst iat=826,807,810,809, &end
#
#  chirality for residue 26 atoms:  C3' C1' H2'1 O2'
 &rst iat=824,808,827,828, &end
#
#  chirality for residue 26 atoms:  O3' C2' C4' H3'
 &rst iat=830,826,805,825, &end
#
#  chirality for residue 26 atoms:  C3' C5' O4' H4'
 &rst iat=824,802,807,806, &end
#
#  chirality for residue 26 atoms:  C4' O5' H5'1 H5'2
 &rst iat=805,801,803,804, &end
#
#  chirality for residue 27 atoms:  C2' O4' N1 H1'
 &rst iat=856,840,843,842, &end
#
#  chirality for residue 27 atoms:  C3' C1' H2'1 O2'
 &rst iat=854,841,857,858, &end
#
#  chirality for residue 27 atoms:  O3' C2' C4' H3'
 &rst iat=860,856,838,855, &end
#
#  chirality for residue 27 atoms:  C3' C5' O4' H4'
 &rst iat=854,835,840,839, &end
#
#  chirality for residue 27 atoms:  C4' O5' H5'1 H5'2
 &rst iat=838,834,836,837, &end
#
#  chirality for residue 28 atoms:  C2' O4' N9 H1'
 &rst iat=889,870,873,872, &end
#
#  chirality for residue 28 atoms:  C3' C1' H2'1 O2'
 &rst iat=887,871,890,891, &end
#
#  chirality for residue 28 atoms:  O3' C2' C4' H3'
 &rst iat=893,889,868,888, &end
#
#  chirality for residue 28 atoms:  C3' C5' O4' H4'
 &rst iat=887,865,870,869, &end
#
#  chirality for residue 28 atoms:  C4' O5' H5'1 H5'2
 &rst iat=868,864,866,867, &end
#
#  chirality for residue 29 atoms:  C2' O4' N1 H1'
 &rst iat=919,903,906,905, &end
#
#  chirality for residue 29 atoms:  C3' C1' H2'1 O2'
 &rst iat=917,904,920,921, &end
#
#  chirality for residue 29 atoms:  O3' C2' C4' H3'
 &rst iat=923,919,901,918, &end
#
#  chirality for residue 29 atoms:  C3' C5' O4' H4'
 &rst iat=917,898,903,902, &end
#
#  chirality for residue 29 atoms:  C4' O5' H5'1 H5'2
 &rst iat=901,897,899,900, &end
#
#  chirality for residue 30 atoms:  C2' O4' N1 H1'
 &rst iat=950,933,936,935, &end
#
#  chirality for residue 30 atoms:  C3' C1' H2'1 O2'
 &rst iat=948,934,951,952, &end
#
#  chirality for residue 30 atoms:  O3' C2' C4' H3'
 &rst iat=954,950,931,949, &end
#
#  chirality for residue 30 atoms:  C3' C5' O4' H4'
 &rst iat=948,928,933,932, &end
#
#  chirality for residue 30 atoms:  C4' O5' H5'1 H5'2
 &rst iat=931,927,929,930, &end
#
#  chirality for residue 31 atoms:  C2' O4' N1 H1'
 &rst iat=981,964,967,966, &end
#
#  chirality for residue 31 atoms:  C3' C1' H2'1 O2'
 &rst iat=979,965,982,983, &end
#
#  chirality for residue 31 atoms:  O3' C2' C4' H3'
 &rst iat=985,981,962,980, &end
#
#  chirality for residue 31 atoms:  C3' C5' O4' H4'
 &rst iat=979,959,964,963, &end
#
#  chirality for residue 31 atoms:  C4' O5' H5'1 H5'2
 &rst iat=962,958,960,961, &end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  -7.599 -25.030   3.865
    2   2H5*    G   1          2H5*        G   1  -7.643 -23.409   4.584
    3    H4*    G   1           H4*        G   1  -6.255 -24.806   5.965
    4    H3*    G   1           H3*        G   1  -4.664 -22.828   4.318
    5    H2*    G   1           H2*        G   1  -2.740 -23.549   5.564
    6   2HO*    G   1          2HO*        G   1  -3.916 -23.807   7.555
    7    H1*    G   1           H1*        G   1  -3.186 -26.143   5.199
    8    H8     G   1           H8         G   1  -4.646 -24.825   2.050
    9    H1     G   1           H1         G   1   1.765 -24.343   2.228
   10   1H2     G   1          1H2         G   1   2.447 -24.661   4.299
   11   2H2     G   1          2H2         G   1   1.292 -25.037   5.582
   12    H5T    G   1           H5T        G   1  -6.124 -22.726   3.045
   13   1H5*    G   2          1H5*        G   2  -3.402 -22.281   8.255
   14   2H5*    G   2          2H5*        G   2  -3.365 -20.560   8.665
   15    H4*    G   2           H4*        G   2  -1.226 -21.633   9.155
   16    H3*    G   2           H3*        G   2  -1.154 -19.596   6.920
   17    H2*    G   2           H2*        G   2   1.255 -19.952   6.921
   18   2HO*    G   2          2HO*        G   2   1.275 -20.209   9.259
   19    H1*    G   2           H1*        G   2   1.138 -22.605   6.889
   20    H8     G   2           H8         G   2  -1.917 -21.779   4.941
   21    H1     G   2           H1         G   2   3.519 -20.549   1.721
   22   1H2     G   2          1H2         G   2   5.206 -20.515   3.128
   23   2H2     G   2          2H2         G   2   4.966 -20.921   4.836
   24   1H5*    A   3          1H5*        A   3   2.093 -18.810   9.527
   25   2H5*    A   3          2H5*        A   3   2.232 -17.092   9.905
   26    H4*    A   3           H4*        A   3   4.339 -17.996   9.044
   27    H3*    A   3           H3*        A   3   3.000 -15.941   7.255
   28    H2*    A   3           H2*        A   3   4.949 -16.136   5.856
   29   2HO*    A   3          2HO*        A   3   6.352 -16.382   7.744
   30    H1*    A   3           H1*        A   3   5.008 -18.790   5.781
   31    H8     A   3           H8         A   3   1.340 -18.152   6.036
   32   1H6     A   3          1H6         A   3   1.527 -17.092  -0.073
   33   2H6     A   3          2H6         A   3   0.504 -17.362   1.350
   34    H2     A   3           H2         A   3   5.691 -17.096   1.425
   35   1H5*    U   4          1H5*        U   4   7.055 -14.912   7.578
   36   2H5*    U   4          2H5*        U   4   7.283 -13.174   7.771
   37    H4*    U   4           H4*        U   4   8.486 -14.032   5.808
   38    H3*    U   4           H3*        U   4   6.191 -12.151   5.138
   39    H2*    U   4           H2*        U   4   7.021 -12.306   2.872
   40   2HO*    U   4          2HO*        U   4   9.235 -12.340   3.554
   41    H1*    U   4           H1*        U   4   7.253 -14.973   2.856
   42    H3     U   4           H3         U   4   3.585 -13.786   0.421
   43    H5     U   4           H5         U   4   2.186 -14.126   4.352
   44    H6     U   4           H6         U   4   4.454 -14.348   5.108
   45   1H5*    A   5          1H5*        A   5   9.683 -10.715   3.148
   46   2H5*    A   5          2H5*        A   5   9.771  -8.950   3.237
   47    H4*    A   5           H4*        A   5   9.904  -9.688   0.924
   48    H3*    A   5           H3*        A   5   7.313  -8.231   1.558
   49    H2*    A   5           H2*        A   5   6.855  -8.418  -0.793
   50   2HO*    A   5          2HO*        A   5   9.054  -8.063  -1.432
   51    H1*    A   5           H1*        A   5   7.422 -11.025  -0.973
   52    H8     A   5           H8         A   5   6.086 -10.618   2.517
   53   1H6     A   5          1H6         A   5   0.482 -10.809  -0.117
   54   2H6     A   5          2H6         A   5   1.385 -10.886   1.408
   55    H2     A   5           H2         A   5   3.439 -10.249  -3.325
   56   1H5*    U   6          1H5*        U   6   8.864  -6.405  -2.015
   57   2H5*    U   6          2H5*        U   6   8.553  -4.661  -1.925
   58    H4*    U   6           H4*        U   6   7.526  -5.748  -3.912
   59    H3*    U   6           H3*        U   6   5.551  -4.686  -1.890
   60    H2*    U   6           H2*        U   6   3.917  -5.009  -3.670
   61   2HO*    U   6          2HO*        U   6   5.364  -4.620  -5.486
   62    H1*    U   6           H1*        U   6   4.670  -7.499  -4.015
   63    H3     U   6           H3         U   6   0.850  -7.280  -1.516
   64    H5     U   6           H5         U   6   3.982  -7.205   1.270
   65    H6     U   6           H6         U   6   5.529  -6.938  -0.543
   66   1H5*    A   7          1H5*        A   7   4.672  -1.014  -5.637
   67   2H5*    A   7          2H5*        A   7   4.171  -1.940  -4.229
   68    H4*    A   7           H4*        A   7   3.313  -2.491  -7.106
   69    H3*    A   7           H3*        A   7   2.008  -1.054  -4.796
   70    H2*    A   7           H2*        A   7  -0.114  -2.046  -5.386
   71   2HO*    A   7          2HO*        A   7   0.508  -1.861  -7.719
   72    H1*    A   7           H1*        A   7   0.758  -4.547  -5.617
   73    H8     A   7           H8         A   7   3.183  -3.288  -3.095
   74   1H6     A   7          1H6         A   7  -1.301  -3.821   1.142
   75   2H6     A   7          2H6         A   7   0.401  -3.592   0.825
   76    H2     A   7           H2         A   7  -3.136  -4.332  -2.917
   77   1H5*    U   8          1H5*        U   8  -0.916  -0.812  -7.728
   78   2H5*    U   8          2H5*        U   8  -1.346   0.883  -7.976
   79    H4*    U   8           H4*        U   8  -3.311  -0.549  -7.484
   80    H3*    U   8           H3*        U   8  -2.587   1.638  -5.545
   81    H2*    U   8           H2*        U   8  -4.682   1.102  -4.411
   82   2HO*    U   8          2HO*        U   8  -5.781   0.665  -6.418
   83    H1*    U   8           H1*        U   8  -4.274  -1.532  -4.335
   84    H3     U   8           H3         U   8  -3.285   0.528  -0.244
   85    H5     U   8           H5         U   8   0.340  -0.048  -2.265
   86    H6     U   8           H6         U   8  -0.898  -0.547  -4.260
   87   1H5*    G   9          1H5*        G   9  -6.880   2.185  -6.524
   88   2H5*    G   9          2H5*        G   9  -7.114   3.930  -6.792
   89    H4*    G   9           H4*        G   9  -8.628   3.080  -5.040
   90    H3*    G   9           H3*        G   9  -6.440   4.879  -4.025
   91    H2*    G   9           H2*        G   9  -7.750   4.886  -1.933
   92   2HO*    G   9          2HO*        G   9  -9.846   4.290  -3.294
   93    H1*    G   9           H1*        G   9  -7.661   2.282  -1.811
   94    H8     G   9           H8         G   9  -4.531   2.943  -3.780
   95    H1     G   9           H1         G   9  -3.973   4.782   2.323
   96   1H2     G   9          1H2         G   9  -5.975   5.000   3.215
   97   2H2     G   9          2H2         G   9  -7.423   4.468   2.331
   98   1H5*    A  10          1H5*        A  10 -10.978   5.572  -2.205
   99   2H5*    A  10          2H5*        A  10 -11.506   7.242  -2.471
  100    H4*    A  10           H4*        A  10 -11.084   6.702  -0.113
  101    H3*    A  10           H3*        A  10  -9.198   8.832  -1.222
  102    H2*    A  10           H2*        A  10  -8.421   8.996   1.014
  103   2HO*    A  10          2HO*        A  10 -10.524   8.688   1.948
  104    H1*    A  10           H1*        A  10  -8.080   6.417   1.441
  105    H8     A  10           H8         A  10  -7.462   6.790  -2.244
  106   1H6     A  10          1H6         A  10  -1.706   8.380  -0.625
  107   2H6     A  10          2H6         A  10  -2.783   7.977  -1.969
  108    H2     A  10           H2         A  10  -4.152   8.391   3.018
  109   1H5*    U  11          1H5*        U  11 -11.017  10.086   2.378
  110   2H5*    U  11          2H5*        U  11 -11.350  11.822   2.377
  111    H4*    U  11           H4*        U  11  -9.844  11.095   4.239
  112    H3*    U  11           H3*        U  11  -8.721  12.996   2.174
  113    H2*    U  11           H2*        U  11  -6.789  13.119   3.632
  114   2HO*    U  11          2HO*        U  11  -7.980  13.115   5.556
  115    H1*    U  11           H1*        U  11  -6.598  10.491   4.106
  116    H3     U  11           H3         U  11  -3.080  11.619   1.481
  117    H5     U  11           H5         U  11  -6.244  11.020  -1.214
  118    H6     U  11           H6         U  11  -7.778  10.859   0.663
  119   1H5*    A  12          1H5*        A  12  -8.151  14.418   6.411
  120   2H5*    A  12          2H5*        A  12  -8.372  16.171   6.369
  121    H4*    A  12           H4*        A  12  -6.221  15.533   7.420
  122    H3*    A  12           H3*        A  12  -6.134  17.072   4.822
  123    H2*    A  12           H2*        A  12  -3.735  17.192   5.156
  124   2HO*    A  12          2HO*        A  12  -3.966  17.433   7.472
  125    H1*    A  12           H1*        A  12  -3.397  14.668   5.832
  126    H8     A  12           H8         A  12  -6.101  14.918   3.202
  127   1H6     A  12          1H6         A  12  -1.449  14.085  -0.785
  128   2H6     A  12          2H6         A  12  -3.191  14.107  -0.586
  129    H2     A  12           H2         A  12   0.304  15.026   3.163
  130   1H5*    C  13          1H5*        C  13  -3.508  18.794   7.823
  131   2H5*    C  13          2H5*        C  13  -3.767  20.560   7.851
  132    H4*    C  13           H4*        C  13  -1.362  20.138   7.647
  133    H3*    C  13           H3*        C  13  -2.559  21.202   5.177
  134    H2*    C  13           H2*        C  13  -0.260  21.199   4.400
  135   2HO*    C  13          2HO*        C  13   0.603  22.026   6.317
  136    H1*    C  13           H1*        C  13   0.474  18.791   5.411
  137   1H4     C  13          1H4         C  13  -1.255  17.466  -0.499
  138   2H4     C  13          2H4         C  13  -2.973  17.504  -0.080
  139    H5     C  13           H5         C  13  -3.736  18.115   2.148
  140    H6     C  13           H6         C  13  -3.054  18.844   4.303
  141   1H5*    A  14          1H5*        A  14   0.004  25.590   4.571
  142   2H5*    A  14          2H5*        A  14  -0.667  24.254   3.641
  143    H4*    A  14           H4*        A  14   2.286  24.551   4.418
  144    H3*    A  14           H3*        A  14   0.611  24.841   1.996
  145    H2*    A  14           H2*        A  14   2.315  23.917   0.703
  146   2HO*    A  14          2HO*        A  14   4.048  24.948   1.937
  147    H1*    A  14           H1*        A  14   2.776  21.764   2.262
  148    H8     A  14           H8         A  14  -0.855  22.204   2.913
  149   1H6     A  14          1H6         A  14  -1.625  20.041  -2.922
  150   2H6     A  14          2H6         A  14  -2.434  20.317  -1.365
  151    H2     A  14           H2         A  14   2.567  21.370  -2.415
  152   1H5*    A  15          1H5*        A  15   3.971  27.772  -0.927
  153   2H5*    A  15          2H5*        A  15   2.256  27.691  -1.342
  154    H4*    A  15           H4*        A  15   3.449  26.836  -3.179
  155    H3*    A  15           H3*        A  15   2.146  24.489  -1.687
  156    H2*    A  15           H2*        A  15   2.838  23.209  -3.329
  157   2HO*    A  15          2HO*        A  15   2.216  24.581  -5.109
  158    H1*    A  15           H1*        A  15   5.244  24.326  -3.872
  159    H8     A  15           H8         A  15   3.857  23.656  -0.371
  160   1H6     A  15          1H6         A  15   7.171  18.452  -0.757
  161   2H6     A  15          2H6         A  15   6.315  19.537   0.362
  162    H2     A  15           H2         A  15   7.090  20.370  -4.691
  163   1H5*    U  16          1H5*        U  16  -0.774  22.645  -5.371
  164   2H5*    U  16          2H5*        U  16   0.604  22.202  -4.375
  165    H4*    U  16           H4*        U  16   0.786  22.881  -7.344
  166    H3*    U  16           H3*        U  16   0.342  20.363  -5.767
  167    H2*    U  16           H2*        U  16   1.870  19.181  -6.912
  168   2HO*    U  16          2HO*        U  16   0.981  19.771  -9.018
  169    H1*    U  16           H1*        U  16   3.707  21.170  -7.598
  170    H3     U  16           H3         U  16   5.787  17.839  -5.256
  171    H5     U  16           H5         U  16   3.049  19.448  -2.534
  172    H6     U  16           H6         U  16   2.243  20.913  -4.321
  173   1H5*    U  17          1H5*        U  17  -0.751  17.779  -9.814
  174   2H5*    U  17          2H5*        U  17  -2.060  17.298  -8.816
  175    H4*    U  17           H4*        U  17   0.761  16.188  -8.508
  176    H3*    U  17           H3*        U  17  -1.314  15.480 -10.402
  177    H2*    U  17           H2*        U  17  -2.323  13.564  -9.458
  178   2HO*    U  17          2HO*        U  17   0.027  12.817  -9.243
  179    H1*    U  17           H1*        U  17  -1.984  13.910  -6.796
  180    H3     U  17           H3         U  17  -5.079  17.308  -5.859
  181    H5     U  17           H5         U  17  -5.216  16.738 -10.000
  182    H6     U  17           H6         U  17  -3.394  15.248  -9.846
  183   1H5*    U  18          1H5*        U  18   3.603  14.048  -9.745
  184   2H5*    U  18          2H5*        U  18   2.344  14.419  -8.603
  185    H4*    U  18           H4*        U  18   4.724  16.276  -8.984
  186    H3*    U  18           H3*        U  18   4.715  13.632  -7.766
  187    H2*    U  18           H2*        U  18   4.857  14.200  -5.492
  188   2HO*    U  18          2HO*        U  18   6.737  15.477  -5.838
  189    H1*    U  18           H1*        U  18   3.595  16.540  -5.329
  190    H3     U  18           H3         U  18  -0.432  14.993  -4.126
  191    H5     U  18           H5         U  18   1.093  11.933  -6.539
  192    H6     U  18           H6         U  18   3.002  13.236  -6.940
  193   1H5*    G  19          1H5*        G  19   7.957  12.104  -5.088
  194   2H5*    G  19          2H5*        G  19   6.303  12.696  -5.155
  195    H4*    G  19           H4*        G  19   8.523  13.934  -3.469
  196    H3*    G  19           H3*        G  19   6.317  11.965  -2.776
  197    H2*    G  19           H2*        G  19   6.141  13.013  -0.633
  198   2HO*    G  19          2HO*        G  19   8.417  13.355  -0.390
  199    H1*    G  19           H1*        G  19   6.019  15.533  -1.613
  200    H8     G  19           H8         G  19   4.670  12.811  -3.887
  201    H1     G  19           H1         G  19   0.379  15.375   0.134
  202   1H2     G  19          1H2         G  19   3.145  17.052   1.333
  203   2H2     G  19          2H2         G  19   1.409  16.856   1.447
  204   1H5*    A  20          1H5*        A  20   7.098   9.340   1.191
  205   2H5*    A  20          2H5*        A  20   5.775  10.038   0.272
  206    H4*    A  20           H4*        A  20   7.055  11.253   2.768
  207    H3*    A  20           H3*        A  20   4.498   9.814   2.108
  208    H2*    A  20           H2*        A  20   3.348  11.053   3.837
  209   2HO*    A  20          2HO*        A  20   5.697  11.505   4.941
  210    H1*    A  20           H1*        A  20   4.030  13.347   2.718
  211    H8     A  20           H8         A  20   4.493  11.478  -0.395
  212   1H6     A  20          1H6         A  20  -1.678  10.923  -0.803
  213   2H6     A  20          2H6         A  20  -0.135  10.864  -1.674
  214    H2     A  20           H2         A  20  -0.739  12.037   3.332
  215   1H5*    U  21          1H5*        U  21   4.376   7.651   6.708
  216   2H5*    U  21          2H5*        U  21   3.812   7.982   5.079
  217    H4*    U  21           H4*        U  21   2.793   9.304   7.636
  218    H3*    U  21           H3*        U  21   1.672   7.282   5.683
  219    H2*    U  21           H2*        U  21  -0.545   8.116   6.270
  220   2HO*    U  21          2HO*        U  21   0.537   9.042   8.481
  221    H1*    U  21           H1*        U  21   0.088  10.516   5.617
  222    H3     U  21           H3         U  21  -1.686   8.243   1.953
  223    H5     U  21           H5         U  21   2.464   8.322   1.435
  224    H6     U  21           H6         U  21   2.716   9.125   3.694
  225   1H5*    C  22          1H5*        C  22  -1.077   8.451   9.632
  226   2H5*    C  22          2H5*        C  22  -1.285   7.082  10.733
  227    H4*    C  22           H4*        C  22  -3.389   7.651   9.639
  228    H3*    C  22           H3*        C  22  -2.279   4.960   8.692
  229    H2*    C  22           H2*        C  22  -4.256   4.735   7.486
  230   2HO*    C  22          2HO*        C  22  -5.626   5.537   9.112
  231    H1*    C  22           H1*        C  22  -4.383   7.250   6.509
  232   1H4     C  22          1H4         C  22  -1.246   4.176   2.035
  233   2H4     C  22          2H4         C  22   0.277   4.256   2.934
  234    H5     C  22           H5         C  22   0.392   5.175   5.149
  235    H6     C  22           H6         C  22  -0.884   6.220   6.892
  236   1H5*    A  23          1H5*        A  23  -5.917   1.634   9.870
  237   2H5*    A  23          2H5*        A  23  -4.708   1.961   8.643
  238    H4*    A  23           H4*        A  23  -7.610   2.874   8.542
  239    H3*    A  23           H3*        A  23  -5.997   0.638   7.358
  240    H2*    A  23           H2*        A  23  -7.188   0.855   5.264
  241   2HO*    A  23          2HO*        A  23  -9.202   1.378   6.325
  242    H1*    A  23           H1*        A  23  -6.833   3.461   5.025
  243    H8     A  23           H8         A  23  -3.806   2.788   7.059
  244   1H6     A  23          1H6         A  23  -1.243   0.555   1.852
  245   2H6     A  23          2H6         A  23  -0.953   1.020   3.545
  246    H2     A  23           H2         A  23  -5.552   0.938   1.137
  247   1H5*    G  24          1H5*        G  24  -9.990   0.003   6.068
  248   2H5*    G  24          2H5*        G  24 -10.448  -1.694   6.244
  249    H4*    G  24           H4*        G  24 -10.641  -0.850   3.894
  250    H3*    G  24           H3*        G  24  -8.736  -3.102   4.502
  251    H2*    G  24           H2*        G  24  -8.300  -3.231   2.131
  252   2HO*    G  24          2HO*        G  24 -10.480  -2.880   1.514
  253    H1*    G  24           H1*        G  24  -8.019  -0.568   1.741
  254    H8     G  24           H8         G  24  -6.451  -1.037   5.108
  255    H1     G  24           H1         G  24  -2.936  -3.389   0.263
  256   1H2     G  24          1H2         G  24  -4.096  -3.341  -1.562
  257   2H2     G  24          2H2         G  24  -5.695  -2.574  -1.597
  258   1H5*    U  25          1H5*        U  25 -10.700  -6.852   1.310
  259   2H5*    U  25          2H5*        U  25  -9.082  -6.528   1.925
  260    H4*    U  25           H4*        U  25 -10.238  -5.519  -0.717
  261    H3*    U  25           H3*        U  25  -8.320  -7.704   0.079
  262    H2*    U  25           H2*        U  25  -7.001  -7.262  -1.848
  263   2HO*    U  25          2HO*        U  25  -8.704  -6.880  -3.300
  264    H1*    U  25           H1*        U  25  -6.901  -4.627  -1.583
  265    H3     U  25           H3         U  25  -3.030  -6.646  -0.094
  266    H5     U  25           H5         U  25  -5.465  -6.284   3.287
  267    H6     U  25           H6         U  25  -7.270  -5.515   1.866
  268   1H5*    A  26          1H5*        A  26  -8.576 -10.504  -4.648
  269   2H5*    A  26          2H5*        A  26  -7.264 -10.254  -3.513
  270    H4*    A  26           H4*        A  26  -7.837  -8.686  -6.053
  271    H3*    A  26           H3*        A  26  -5.737 -10.555  -5.011
  272    H2*    A  26           H2*        A  26  -3.950  -9.277  -5.909
  273   2HO*    A  26          2HO*        A  26  -5.273  -8.823  -7.871
  274    H1*    A  26           H1*        A  26  -4.755  -6.888  -5.119
  275    H8     A  26           H8         A  26  -6.167  -9.036  -2.416
  276   1H6     A  26          1H6         A  26  -0.514  -8.762   0.122
  277   2H6     A  26          2H6         A  26  -2.186  -9.291   0.354
  278    H2     A  26           H2         A  26  -0.244  -7.142  -3.961
  279   1H5*    U  27          1H5*        U  27  -4.219  -9.926  -8.718
  280   2H5*    U  27          2H5*        U  27  -3.762 -11.441  -9.500
  281    H4*    U  27           H4*        U  27  -1.836  -9.990  -9.305
  282    H3*    U  27           H3*        U  27  -1.645 -12.386  -7.441
  283    H2*    U  27           H2*        U  27   0.599 -11.608  -7.052
  284   2HO*    U  27          2HO*        U  27   0.941 -10.976  -9.238
  285    H1*    U  27           H1*        U  27  -0.076  -9.045  -6.645
  286    H3     U  27           H3         U  27   0.779 -10.894  -2.560
  287    H5     U  27           H5         U  27  -3.210 -11.923  -3.376
  288    H6     U  27           H6         U  27  -2.936 -11.027  -5.595
  289   1H5*    A  28          1H5*        A  28   1.829 -12.347  -9.887
  290   2H5*    A  28          2H5*        A  28   2.288 -13.993 -10.339
  291    H4*    A  28           H4*        A  28   4.151 -12.830  -9.285
  292    H3*    A  28           H3*        A  28   3.063 -15.114  -7.594
  293    H2*    A  28           H2*        A  28   4.907 -14.627  -6.131
  294   2HO*    A  28          2HO*        A  28   6.333 -14.157  -7.937
  295    H1*    A  28           H1*        A  28   4.515 -11.992  -6.044
  296    H8     A  28           H8         A  28   1.053 -13.407  -6.445
  297   1H6     A  28          1H6         A  28   1.181 -14.081  -0.285
  298   2H6     A  28          2H6         A  28   0.156 -14.052  -1.719
  299    H2     A  28           H2         A  28   5.315 -13.375  -1.631
  300   1H5*    U  29          1H5*        U  29   7.219 -15.516  -7.873
  301   2H5*    U  29          2H5*        U  29   7.716 -17.202  -8.032
  302    H4*    U  29           H4*        U  29   8.750 -16.123  -6.080
  303    H3*    U  29           H3*        U  29   6.774 -18.331  -5.355
  304    H2*    U  29           H2*        U  29   7.608 -17.964  -3.106
  305   2HO*    U  29          2HO*        U  29   9.776 -17.586  -3.766
  306    H1*    U  29           H1*        U  29   7.350 -15.310  -3.163
  307    H3     U  29           H3         U  29   3.927 -17.049  -0.704
  308    H5     U  29           H5         U  29   2.506 -17.049  -4.641
  309    H6     U  29           H6         U  29   4.711 -16.465  -5.408
  310   1H5*    C  30          1H5*        C  30  10.435 -19.043  -3.413
  311   2H5*    C  30          2H5*        C  30  10.842 -20.763  -3.358
  312    H4*    C  30           H4*        C  30  10.762 -19.771  -1.109
  313    H3*    C  30           H3*        C  30   8.566 -21.829  -1.616
  314    H2*    C  30           H2*        C  30   8.109 -21.551   0.745
  315   2HO*    C  30          2HO*        C  30  10.451 -21.212   1.158
  316    H1*    C  30           H1*        C  30   8.058 -18.873   0.667
  317   1H4     C  30          1H4         C  30   2.167 -20.586  -0.637
  318   2H4     C  30          2H4         C  30   2.464 -20.450  -2.382
  319    H5     C  30           H5         C  30   4.705 -20.158  -3.282
  320    H6     C  30           H6         C  30   6.999 -19.794  -2.699
  321   1H5*    C  31          1H5*        C  31  10.356 -22.738   2.005
  322   2H5*    C  31          2H5*        C  31  10.806 -24.447   2.064
  323    H4*    C  31           H4*        C  31   9.448 -23.896   4.015
  324    H3*    C  31           H3*        C  31   8.004 -25.582   1.936
  325    H2*    C  31           H2*        C  31   6.259 -25.812   3.562
  326   2HO*    C  31          2HO*        C  31   7.812 -25.939   5.354
  327    H1*    C  31           H1*        C  31   6.211 -23.162   4.199
  328   1H4     C  31          1H4         C  31   1.949 -23.956  -0.325
  329   2H4     C  31          2H4         C  31   3.147 -23.602  -1.582
  330    H5     C  31           H5         C  31   5.507 -23.337  -1.098
  331    H6     C  31           H6         C  31   7.141 -23.292   0.653
  332    H3T    C  31           H3T        C  31   9.826 -26.548   2.900
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  -5.841 -25.527   3.889
    2   2H5*    G   1          2H5*        G   1  -5.620 -24.003   4.773
    3    H4*    G   1           H4*        G   1  -3.811 -25.476   5.368
    4    H3*    G   1           H3*        G   1  -2.964 -23.260   3.483
    5    H2*    G   1           H2*        G   1  -0.702 -24.026   3.820
    6   2HO*    G   1          2HO*        G   1  -1.012 -24.547   6.068
    7    H1*    G   1           H1*        G   1  -1.266 -26.598   3.353
    8    H8     G   1           H8         G   1  -3.817 -25.000   1.182
    9    H1     G   1           H1         G   1   2.142 -24.231  -1.072
   10   1H2     G   1          1H2         G   1   3.131 -25.332   2.011
   11   2H2     G   1          2H2         G   1   3.570 -24.781   0.452
   12    H5T    G   1           H5T        G   1  -4.755 -23.085   2.888
   13   1H5*    G   2          1H5*        G   2  -0.385 -23.022   6.780
   14   2H5*    G   2          2H5*        G   2  -0.189 -21.343   7.311
   15    H4*    G   2           H4*        G   2   1.984 -22.409   6.901
   16    H3*    G   2           H3*        G   2   1.251 -20.186   4.979
   17    H2*    G   2           H2*        G   2   3.509 -20.465   4.094
   18   2HO*    G   2          2HO*        G   2   4.405 -20.896   6.218
   19    H1*    G   2           H1*        G   2   3.367 -23.132   3.896
   20    H8     G   2           H8         G   2  -0.162 -22.190   3.179
   21    H1     G   2           H1         G   2   3.868 -20.563  -1.555
   22   1H2     G   2          1H2         G   2   5.958 -20.700  -0.830
   23   2H2     G   2          2H2         G   2   6.319 -21.272   0.797
   24   1H5*    A   3          1H5*        A   3   5.214 -19.517   6.369
   25   2H5*    A   3          2H5*        A   3   5.474 -17.830   6.831
   26    H4*    A   3           H4*        A   3   7.172 -18.596   5.227
   27    H3*    A   3           H3*        A   3   5.281 -16.449   4.212
   28    H2*    A   3           H2*        A   3   6.628 -16.443   2.197
   29   2HO*    A   3          2HO*        A   3   8.615 -16.812   3.456
   30    H1*    A   3           H1*        A   3   6.668 -19.098   1.876
   31    H8     A   3           H8         A   3   3.321 -18.617   3.448
   32   1H6     A   3          1H6         A   3   1.316 -16.943  -2.160
   33   2H6     A   3          2H6         A   3   0.856 -17.401  -0.518
   34    H2     A   3           H2         A   3   5.758 -16.909  -2.229
   35   1H5*    U   4          1H5*        U   4   9.159 -15.313   3.152
   36   2H5*    U   4          2H5*        U   4   9.475 -13.603   3.455
   37    H4*    U   4           H4*        U   4   9.892 -14.208   1.100
   38    H3*    U   4           H3*        U   4   7.551 -12.317   1.536
   39    H2*    U   4           H2*        U   4   7.505 -12.176  -0.892
   40   2HO*    U   4          2HO*        U   4   9.825 -12.259  -1.078
   41    H1*    U   4           H1*        U   4   7.660 -14.837  -1.296
   42    H3     U   4           H3         U   4   3.377 -13.339  -2.044
   43    H5     U   4           H5         U   4   3.507 -14.417   2.007
   44    H6     U   4           H6         U   4   5.893 -14.642   1.838
   45   1H5*    A   5          1H5*        A   5  10.117 -10.678  -1.405
   46   2H5*    A   5          2H5*        A   5  10.277  -8.924  -1.250
   47    H4*    A   5           H4*        A   5   9.535  -9.555  -3.495
   48    H3*    A   5           H3*        A   5   7.419  -8.068  -1.886
   49    H2*    A   5           H2*        A   5   6.164  -8.063  -3.957
   50   2HO*    A   5          2HO*        A   5   8.061  -7.774  -5.286
   51    H1*    A   5           H1*        A   5   6.502 -10.682  -4.434
   52    H8     A   5           H8         A   5   6.489 -10.526  -0.686
   53   1H6     A   5          1H6         A   5   0.317 -10.446  -1.153
   54   2H6     A   5          2H6         A   5   1.691 -10.667  -0.067
   55    H2     A   5           H2         A   5   1.987  -9.470  -5.139
   56   1H5*    U   6          1H5*        U   6   7.765  -6.170  -5.639
   57   2H5*    U   6          2H5*        U   6   7.682  -4.413  -5.448
   58    H4*    U   6           H4*        U   6   5.966  -5.314  -7.008
   59    H3*    U   6           H3*        U   6   4.904  -3.931  -4.501
   60    H2*    U   6           H2*        U   6   2.756  -4.205  -5.472
   61   2HO*    U   6          2HO*        U   6   3.370  -3.706  -7.606
   62    H1*    U   6           H1*        U   6   3.090  -6.783  -6.224
   63    H3     U   6           H3         U   6   0.352  -6.575  -2.572
   64    H5     U   6           H5         U   6   4.226  -6.910  -1.016
   65    H6     U   6           H6         U   6   5.100  -6.562  -3.225
   66   1H5*    A   7          1H5*        A   7   2.228  -0.014  -6.546
   67   2H5*    A   7          2H5*        A   7   2.026  -1.084  -5.160
   68    H4*    A   7           H4*        A   7   0.782  -1.464  -7.917
   69    H3*    A   7           H3*        A   7  -0.028  -0.192  -5.357
   70    H2*    A   7           H2*        A   7  -2.033  -1.391  -5.066
   71   2HO*    A   7          2HO*        A   7  -2.453  -1.095  -7.436
   72    H1*    A   7           H1*        A   7  -1.257  -3.828  -5.846
   73    H8     A   7           H8         A   7   1.957  -2.896  -4.222
   74   1H6     A   7          1H6         A   7  -0.906  -3.684   1.229
   75   2H6     A   7          2H6         A   7   0.613  -3.455   0.397
   76    H2     A   7           H2         A   7  -4.023  -3.667  -1.980
   77   1H5*    U   8          1H5*        U   8  -3.698   0.266  -6.903
   78   2H5*    U   8          2H5*        U   8  -4.097   1.994  -6.871
   79    H4*    U   8           H4*        U   8  -5.711   0.745  -5.547
   80    H3*    U   8           H3*        U   8  -3.774   2.229  -3.752
   81    H2*    U   8           H2*        U   8  -5.511   1.831  -2.072
   82   2HO*    U   8          2HO*        U   8  -7.351   1.845  -3.535
   83    H1*    U   8           H1*        U   8  -5.431  -0.800  -2.673
   84    H3     U   8           H3         U   8  -2.955   0.441   1.122
   85    H5     U   8           H5         U   8  -0.273   0.062  -2.093
   86    H6     U   8           H6         U   8  -2.147  -0.005  -3.600
   87   1H5*    G   9          1H5*        G   9  -7.594   5.575  -3.056
   88   2H5*    G   9          2H5*        G   9  -6.202   4.660  -2.498
   89    H4*    G   9           H4*        G   9  -9.070   4.253  -1.520
   90    H3*    G   9           H3*        G   9  -6.647   5.636  -0.380
   91    H2*    G   9           H2*        G   9  -7.533   5.093   1.845
   92   2HO*    G   9          2HO*        G   9  -9.877   4.937   0.930
   93    H1*    G   9           H1*        G   9  -7.526   2.523   1.221
   94    H8     G   9           H8         G   9  -5.003   3.494  -1.307
   95    H1     G   9           H1         G   9  -2.667   4.040   4.648
   96   1H2     G   9          1H2         G   9  -4.333   4.171   6.106
   97   2H2     G   9          2H2         G   9  -6.009   3.976   5.581
   98   1H5*    A  10          1H5*        A  10 -10.141   5.869   2.818
   99   2H5*    A  10          2H5*        A  10 -10.687   7.546   2.997
  100    H4*    A  10           H4*        A  10  -9.588   6.746   5.033
  101    H3*    A  10           H3*        A  10  -8.067   8.913   3.533
  102    H2*    A  10           H2*        A  10  -6.589   8.919   5.448
  103   2HO*    A  10          2HO*        A  10  -8.360   8.557   6.956
  104    H1*    A  10           H1*        A  10  -6.287   6.255   5.547
  105    H8     A  10           H8         A  10  -6.764   6.931   1.896
  106   1H6     A  10          1H6         A  10  -0.712   8.295   1.773
  107   2H6     A  10          2H6         A  10  -2.143   7.976   0.792
  108    H2     A  10           H2         A  10  -2.001   8.203   5.989
  109   1H5*    U  11          1H5*        U  11  -8.301  10.069   7.615
  110   2H5*    U  11          2H5*        U  11  -8.617  11.808   7.707
  111    H4*    U  11           H4*        U  11  -6.524  11.184   8.882
  112    H3*    U  11           H3*        U  11  -6.103  12.745   6.327
  113    H2*    U  11           H2*        U  11  -3.841  13.074   7.158
  114   2HO*    U  11          2HO*        U  11  -4.413  13.040   9.477
  115    H1*    U  11           H1*        U  11  -3.565  10.455   7.593
  116    H3     U  11           H3         U  11  -1.343  11.566   3.786
  117    H5     U  11           H5         U  11  -5.294  10.847   2.546
  118    H6     U  11           H6         U  11  -5.951  10.691   4.858
  119   1H5*    A  12          1H5*        A  12  -5.260  16.780   9.287
  120   2H5*    A  12          2H5*        A  12  -4.897  15.816   7.851
  121    H4*    A  12           H4*        A  12  -2.932  16.585  10.056
  122    H3*    A  12           H3*        A  12  -3.470  17.501   7.225
  123    H2*    A  12           H2*        A  12  -1.092  17.820   6.907
  124   2HO*    A  12          2HO*        A  12  -0.845  18.565   9.162
  125    H1*    A  12           H1*        A  12  -0.356  15.498   7.922
  126    H8     A  12           H8         A  12  -3.723  14.860   6.390
  127   1H6     A  12          1H6         A  12  -0.510  13.641   1.237
  128   2H6     A  12          2H6         A  12  -2.085  13.509   1.995
  129    H2     A  12           H2         A  12   2.225  15.572   4.116
  130   1H5*    C  13          1H5*        C  13  -0.424  20.008   8.618
  131   2H5*    C  13          2H5*        C  13  -0.865  21.707   8.307
  132    H4*    C  13           H4*        C  13   1.354  21.294   7.405
  133    H3*    C  13           H3*        C  13  -0.684  21.542   5.238
  134    H2*    C  13           H2*        C  13   1.260  21.458   3.786
  135   2HO*    C  13          2HO*        C  13   2.557  22.814   5.065
  136    H1*    C  13           H1*        C  13   2.549  19.453   5.119
  137   1H4     C  13          1H4         C  13  -0.701  16.763   0.373
  138   2H4     C  13          2H4         C  13  -2.139  16.665   1.358
  139    H5     C  13           H5         C  13  -2.248  17.612   3.669
  140    H6     C  13           H6         C  13  -1.044  18.940   5.280
  141   1H5*    A  14          1H5*        A  14   0.602  25.188   2.244
  142   2H5*    A  14          2H5*        A  14  -0.108  23.575   2.288
  143    H4*    A  14           H4*        A  14   2.817  24.211   1.695
  144    H3*    A  14           H3*        A  14   0.437  23.528   0.043
  145    H2*    A  14           H2*        A  14   1.903  22.247  -1.435
  146   2HO*    A  14          2HO*        A  14   3.735  23.523  -1.347
  147    H1*    A  14           H1*        A  14   2.793  20.724   0.510
  148    H8     A  14           H8         A  14  -0.121  21.577   2.451
  149   1H6     A  14          1H6         A  14  -3.735  18.585  -1.623
  150   2H6     A  14          2H6         A  14  -3.665  19.279   0.011
  151    H2     A  14           H2         A  14   0.133  19.228  -3.546
  152   1H5*    A  15          1H5*        A  15   0.078  26.378  -3.960
  153   2H5*    A  15          2H5*        A  15  -0.614  26.816  -2.388
  154    H4*    A  15           H4*        A  15  -2.383  26.282  -3.831
  155    H3*    A  15           H3*        A  15  -2.098  25.031  -1.489
  156    H2*    A  15           H2*        A  15  -1.078  23.076  -2.042
  157   2HO*    A  15          2HO*        A  15  -3.823  22.639  -2.530
  158    H1*    A  15           H1*        A  15  -2.528  22.665  -4.583
  159    H8     A  15           H8         A  15   0.858  22.910  -2.837
  160   1H6     A  15          1H6         A  15   2.727  18.937  -7.192
  161   2H6     A  15          2H6         A  15   3.188  19.723  -5.690
  162    H2     A  15           H2         A  15  -1.292  20.401  -8.271
  163   1H5*    U  16          1H5*        U  16  -6.676  23.274  -4.827
  164   2H5*    U  16          2H5*        U  16  -5.689  21.988  -4.110
  165    H4*    U  16           H4*        U  16  -6.496  21.493  -6.413
  166    H3*    U  16           H3*        U  16  -3.570  21.582  -5.862
  167    H2*    U  16           H2*        U  16  -3.041  21.393  -8.164
  168   2HO*    U  16          2HO*        U  16  -4.452  19.638  -8.531
  169    H1*    U  16           H1*        U  16  -5.112  22.747  -9.232
  170    H3     U  16           H3         U  16  -2.731  26.384 -10.212
  171    H5     U  16           H5         U  16  -1.041  25.130  -6.586
  172    H6     U  16           H6         U  16  -2.680  23.382  -6.480
  173   1H5*    U  17          1H5*        U  17  -3.974  16.037  -7.234
  174   2H5*    U  17          2H5*        U  17  -4.708  15.414  -5.768
  175    H4*    U  17           H4*        U  17  -1.917  16.611  -5.696
  176    H3*    U  17           H3*        U  17  -2.681  14.285  -7.195
  177    H2*    U  17           H2*        U  17  -2.118  12.497  -5.787
  178   2HO*    U  17          2HO*        U  17   0.044  13.189  -5.709
  179    H1*    U  17           H1*        U  17  -2.297  13.540  -3.285
  180    H3     U  17           H3         U  17  -6.835  13.272  -2.545
  181    H5     U  17           H5         U  17  -6.306  12.204  -6.563
  182    H6     U  17           H6         U  17  -4.007  12.829  -6.391
  183   1H5*    U  18          1H5*        U  18   2.088  12.811  -6.675
  184   2H5*    U  18          2H5*        U  18   1.707  14.337  -5.872
  185    H4*    U  18           H4*        U  18   4.022  14.150  -7.806
  186    H3*    U  18           H3*        U  18   3.791  12.665  -5.352
  187    H2*    U  18           H2*        U  18   5.051  13.908  -3.832
  188   2HO*    U  18          2HO*        U  18   6.917  13.717  -5.208
  189    H1*    U  18           H1*        U  18   5.009  16.431  -4.861
  190    H3     U  18           H3         U  18   1.680  18.085  -2.353
  191    H5     U  18           H5         U  18   0.836  13.974  -2.474
  192    H6     U  18           H6         U  18   2.658  13.683  -3.987
  193   1H5*    G  19          1H5*        G  19   7.694  10.347  -3.647
  194   2H5*    G  19          2H5*        G  19   6.135  11.032  -3.186
  195    H4*    G  19           H4*        G  19   8.838  12.386  -2.802
  196    H3*    G  19           H3*        G  19   7.115  10.636  -1.106
  197    H2*    G  19           H2*        G  19   7.059  12.099   0.752
  198   2HO*    G  19          2HO*        G  19   9.328  12.563   0.624
  199    H1*    G  19           H1*        G  19   6.736  14.408  -0.546
  200    H8     G  19           H8         G  19   5.190  11.022  -1.501
  201    H1     G  19           H1         G  19   1.197  15.442   0.810
  202   1H2     G  19          1H2         G  19   2.308  17.337   1.137
  203   2H2     G  19          2H2         G  19   4.009  17.448   0.815
  204   1H5*    A  20          1H5*        A  20   8.872   9.116   3.074
  205   2H5*    A  20          2H5*        A  20   7.349   9.471   2.269
  206    H4*    A  20           H4*        A  20   8.802  11.290   4.242
  207    H3*    A  20           H3*        A  20   6.477   9.380   4.341
  208    H2*    A  20           H2*        A  20   5.260  10.862   5.798
  209   2HO*    A  20          2HO*        A  20   7.293  11.498   6.913
  210    H1*    A  20           H1*        A  20   5.634  13.071   4.329
  211    H8     A  20           H8         A  20   5.826  10.550   1.617
  212   1H6     A  20          1H6         A  20  -0.338  10.253   1.803
  213   2H6     A  20          2H6         A  20   1.122   9.826   0.902
  214    H2     A  20           H2         A  20   0.993  12.248   5.501
  215   1H5*    U  21          1H5*        U  21   6.451  10.278   8.300
  216   2H5*    U  21          2H5*        U  21   6.476   8.771   9.243
  217    H4*    U  21           H4*        U  21   4.453  10.042   9.764
  218    H3*    U  21           H3*        U  21   3.863   7.623   8.021
  219    H2*    U  21           H2*        U  21   1.549   8.025   8.637
  220   2HO*    U  21          2HO*        U  21   2.137   9.109  10.769
  221    H1*    U  21           H1*        U  21   1.734  10.526   7.768
  222    H3     U  21           H3         U  21  -0.013   7.867   4.471
  223    H5     U  21           H5         U  21   4.132   7.906   3.804
  224    H6     U  21           H6         U  21   4.392   9.039   5.902
  225   1H5*    C  22          1H5*        C  22   2.090   5.251  11.966
  226   2H5*    C  22          2H5*        C  22   2.171   5.609  10.242
  227    H4*    C  22           H4*        C  22  -0.246   6.135  12.021
  228    H3*    C  22           H3*        C  22   0.487   3.780  10.223
  229    H2*    C  22           H2*        C  22  -1.762   3.597   9.586
  230   2HO*    C  22          2HO*        C  22  -2.642   3.977  11.672
  231    H1*    C  22           H1*        C  22  -2.225   6.214   9.164
  232   1H4     C  22          1H4         C  22  -0.097   4.146   3.584
  233   2H4     C  22          2H4         C  22   1.524   4.691   3.994
  234    H5     C  22           H5         C  22   2.123   5.496   6.209
  235    H6     C  22           H6         C  22   1.272   6.023   8.405
  236   1H5*    A  23          1H5*        A  23  -2.553  -0.011  11.817
  237   2H5*    A  23          2H5*        A  23  -1.785   0.586  10.344
  238    H4*    A  23           H4*        A  23  -4.585   1.308  11.306
  239    H3*    A  23           H3*        A  23  -3.382  -0.580   9.300
  240    H2*    A  23           H2*        A  23  -5.192  -0.119   7.751
  241   2HO*    A  23          2HO*        A  23  -6.776   0.105   9.486
  242    H1*    A  23           H1*        A  23  -4.928   2.525   7.878
  243    H8     A  23           H8         A  23  -1.429   1.768   8.768
  244   1H6     A  23          1H6         A  23  -0.483   0.359   2.796
  245   2H6     A  23          2H6         A  23   0.287   0.670   4.356
  246    H2     A  23           H2         A  23  -4.845   0.568   3.458
  247   1H5*    G  24          1H5*        G  24  -7.537  -1.288   9.285
  248   2H5*    G  24          2H5*        G  24  -7.910  -3.018   9.312
  249    H4*    G  24           H4*        G  24  -8.903  -1.820   7.342
  250    H3*    G  24           H3*        G  24  -6.888  -4.025   6.907
  251    H2*    G  24           H2*        G  24  -7.240  -3.763   4.535
  252   2HO*    G  24          2HO*        G  24  -9.505  -3.483   4.673
  253    H1*    G  24           H1*        G  24  -7.164  -1.048   4.529
  254    H8     G  24           H8         G  24  -4.517  -1.892   7.041
  255    H1     G  24           H1         G  24  -2.882  -3.307   0.993
  256   1H2     G  24          1H2         G  24  -6.164  -2.485   0.299
  257   2H2     G  24          2H2         G  24  -4.636  -3.095  -0.313
  258   1H5*    U  25          1H5*        U  25  -9.783  -7.376   3.959
  259   2H5*    U  25          2H5*        U  25  -8.039  -7.117   4.108
  260    H4*    U  25           H4*        U  25  -9.918  -5.758   2.125
  261    H3*    U  25           H3*        U  25  -7.792  -7.896   1.976
  262    H2*    U  25           H2*        U  25  -7.089  -7.030  -0.157
  263   2HO*    U  25          2HO*        U  25  -9.220  -6.510  -0.887
  264    H1*    U  25           H1*        U  25  -6.952  -4.488   0.592
  265    H3     U  25           H3         U  25  -2.845  -6.629   0.610
  266    H5     U  25           H5         U  25  -4.285  -6.883   4.531
  267    H6     U  25           H6         U  25  -6.385  -5.946   3.777
  268   1H5*    A  26          1H5*        A  26 -10.058  -7.595  -1.894
  269   2H5*    A  26          2H5*        A  26 -10.114  -9.202  -2.645
  270    H4*    A  26           H4*        A  26  -9.244  -7.440  -4.163
  271    H3*    A  26           H3*        A  26  -7.268  -9.631  -3.432
  272    H2*    A  26           H2*        A  26  -5.802  -8.570  -5.021
  273   2HO*    A  26          2HO*        A  26  -7.568  -8.009  -6.479
  274    H1*    A  26           H1*        A  26  -6.138  -6.090  -4.065
  275    H8     A  26           H8         A  26  -6.495  -8.601  -1.266
  276   1H6     A  26          1H6         A  26  -0.324  -8.146  -0.757
  277   2H6     A  26          2H6         A  26  -1.789  -8.836  -0.052
  278    H2     A  26           H2         A  26  -1.574  -6.018  -4.434
  279   1H5*    U  27          1H5*        U  27  -7.154  -9.118  -7.564
  280   2H5*    U  27          2H5*        U  27  -6.967 -10.645  -8.429
  281    H4*    U  27           H4*        U  27  -5.143  -9.070  -8.954
  282    H3*    U  27           H3*        U  27  -4.268 -11.543  -7.408
  283    H2*    U  27           H2*        U  27  -2.021 -10.714  -7.807
  284   2HO*    U  27          2HO*        U  27  -2.515  -9.970  -9.950
  285    H1*    U  27           H1*        U  27  -2.559  -8.173  -7.087
  286    H3     U  27           H3         U  27  -0.168 -10.154  -3.725
  287    H5     U  27           H5         U  27  -4.159 -11.234  -2.989
  288    H6     U  27           H6         U  27  -4.776 -10.276  -5.093
  289   1H5*    A  28          1H5*        A  28  -1.871 -11.147 -10.916
  290   2H5*    A  28          2H5*        A  28  -1.548 -12.718 -11.662
  291    H4*    A  28           H4*        A  28   0.536 -11.516 -11.218
  292    H3*    A  28           H3*        A  28   0.152 -13.991  -9.486
  293    H2*    A  28           H2*        A  28   2.405 -13.547  -8.721
  294   2HO*    A  28          2HO*        A  28   3.085 -12.814 -10.864
  295    H1*    A  28           H1*        A  28   1.991 -10.940  -8.239
  296    H8     A  28           H8         A  28  -1.362 -12.495  -7.543
  297   1H6     A  28          1H6         A  28   0.906 -13.816  -1.937
  298   2H6     A  28          2H6         A  28  -0.548 -13.671  -2.919
  299    H2     A  28           H2         A  28   4.313 -12.724  -4.556
  300   1H5*    U  29          1H5*        U  29   3.966 -14.209 -11.190
  301   2H5*    U  29          2H5*        U  29   4.375 -15.847 -11.717
  302    H4*    U  29           H4*        U  29   6.037 -14.956 -10.130
  303    H3*    U  29           H3*        U  29   4.411 -17.295  -9.033
  304    H2*    U  29           H2*        U  29   5.962 -17.177  -7.177
  305   2HO*    U  29          2HO*        U  29   7.790 -16.664  -8.500
  306    H1*    U  29           H1*        U  29   5.764 -14.515  -6.855
  307    H3     U  29           H3         U  29   3.389 -16.631  -3.573
  308    H5     U  29           H5         U  29   0.682 -16.148  -6.733
  309    H6     U  29           H6         U  29   2.503 -15.432  -8.142
  310   1H5*    C  30          1H5*        C  30   8.501 -18.101  -8.538
  311   2H5*    C  30          2H5*        C  30   8.905 -19.792  -8.860
  312    H4*    C  30           H4*        C  30   9.622 -19.087  -6.606
  313    H3*    C  30           H3*        C  30   7.395 -21.182  -6.612
  314    H2*    C  30           H2*        C  30   7.781 -21.242  -4.220
  315   2HO*    C  30          2HO*        C  30  10.130 -20.828  -4.595
  316    H1*    C  30           H1*        C  30   7.712 -18.564  -3.914
  317   1H4     C  30          1H4         C  30   1.714 -20.403  -3.326
  318   2H4     C  30          2H4         C  30   1.394 -20.002  -5.013
  319    H5     C  30           H5         C  30   3.195 -19.430  -6.576
  320    H6     C  30           H6         C  30   5.551 -19.027  -6.770
  321   1H5*    C  31          1H5*        C  31  10.247 -22.412  -3.924
  322   2H5*    C  31          2H5*        C  31  10.726 -24.085  -4.232
  323    H4*    C  31           H4*        C  31  10.061 -23.877  -1.901
  324    H3*    C  31           H3*        C  31   8.014 -25.320  -3.634
  325    H2*    C  31           H2*        C  31   6.912 -25.870  -1.563
  326   2HO*    C  31          2HO*        C  31   8.964 -26.169  -0.417
  327    H1*    C  31           H1*        C  31   7.089 -23.344  -0.558
  328   1H4     C  31          1H4         C  31   1.495 -23.629  -3.359
  329   2H4     C  31          2H4         C  31   2.183 -23.105  -4.891
  330    H5     C  31           H5         C  31   4.596 -22.843  -5.241
  331    H6     C  31           H6         C  31   6.752 -22.967  -4.181
  332    H3T    C  31           H3T        C  31  10.055 -26.324  -3.474
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  -3.104 -26.118   5.818
    2   2H5*    G   1          2H5*        G   1  -2.919 -27.637   6.721
    3    H4*    G   1           H4*        G   1  -0.524 -27.738   5.981
    4    H3*    G   1           H3*        G   1  -1.322 -25.213   4.517
    5    H2*    G   1           H2*        G   1   0.174 -25.903   2.734
    6   2HO*    G   1          2HO*        G   1   1.754 -26.802   4.181
    7    H1*    G   1           H1*        G   1  -0.771 -28.378   2.563
    8    H8     G   1           H8         G   1  -3.844 -26.618   3.679
    9    H1     G   1           H1         G   1  -2.238 -25.219  -2.388
   10   1H2     G   1          1H2         G   1  -0.178 -25.916  -2.771
   11   2H2     G   1          2H2         G   1   0.735 -26.753  -1.518
   12    H5T    G   1           H5T        G   1  -1.340 -25.294   7.126
   13   1H5*    G   2          1H5*        G   2   2.822 -25.525   4.129
   14   2H5*    G   2          2H5*        G   2   3.625 -23.981   4.425
   15    H4*    G   2           H4*        G   2   4.261 -24.927   2.255
   16    H3*    G   2           H3*        G   2   2.657 -22.355   2.104
   17    H2*    G   2           H2*        G   2   3.050 -22.477  -0.291
   18   2HO*    G   2          2HO*        G   2   5.203 -23.335   0.010
   19    H1*    G   2           H1*        G   2   2.325 -25.024  -0.556
   20    H8     G   2           H8         G   2   0.090 -23.937   2.213
   21    H1     G   2           H1         G   2  -1.544 -21.404  -3.471
   22   1H2     G   2          1H2         G   2   0.109 -21.664  -4.887
   23   2H2     G   2          2H2         G   2   1.561 -22.549  -4.421
   24   1H5*    A   3          1H5*        A   3   6.052 -22.027  -0.423
   25   2H5*    A   3          2H5*        A   3   6.833 -20.452  -0.273
   26    H4*    A   3           H4*        A   3   6.271 -20.966  -2.606
   27    H3*    A   3           H3*        A   3   4.728 -18.642  -1.407
   28    H2*    A   3           H2*        A   3   3.850 -18.346  -3.665
   29   2HO*    A   3          2HO*        A   3   5.872 -19.003  -4.664
   30    H1*    A   3           H1*        A   3   3.141 -20.877  -3.990
   31    H8     A   3           H8         A   3   2.702 -20.527  -0.304
   32   1H6     A   3          1H6         A   3  -2.652 -17.699  -1.580
   33   2H6     A   3          2H6         A   3  -1.657 -18.474  -0.359
   34    H2     A   3           H2         A   3  -0.268 -17.815  -5.317
   35   1H5*    U   4          1H5*        U   4   6.260 -17.517  -5.109
   36   2H5*    U   4          2H5*        U   4   6.968 -15.901  -5.128
   37    H4*    U   4           H4*        U   4   5.220 -16.164  -6.854
   38    H3*    U   4           H3*        U   4   4.583 -14.151  -4.652
   39    H2*    U   4           H2*        U   4   2.599 -13.663  -5.949
   40   2HO*    U   4          2HO*        U   4   3.696 -13.963  -7.972
   41    H1*    U   4           H1*        U   4   1.846 -16.199  -6.273
   42    H3     U   4           H3         U   4  -0.616 -14.146  -2.948
   43    H5     U   4           H5         U   4   2.550 -16.078  -1.005
   44    H6     U   4           H6         U   4   3.555 -16.463  -3.133
   45   1H5*    A   5          1H5*        A   5   3.832 -12.479  -8.410
   46   2H5*    A   5          2H5*        A   5   4.454 -10.842  -8.541
   47    H4*    A   5           H4*        A   5   2.098 -10.956  -9.162
   48    H3*    A   5           H3*        A   5   2.655  -9.305  -6.657
   49    H2*    A   5           H2*        A   5   0.380  -8.792  -6.586
   50   2HO*    A   5          2HO*        A   5   0.202  -8.495  -8.876
   51    H1*    A   5           H1*        A   5  -0.556 -11.270  -7.053
   52    H8     A   5           H8         A   5   2.561 -11.908  -5.069
   53   1H6     A   5          1H6         A   5  -0.962 -10.939  -0.070
   54   2H6     A   5          2H6         A   5   0.571 -11.535  -0.686
   55    H2     A   5           H2         A   5  -3.226  -9.508  -3.596
   56   1H5*    U   6          1H5*        U   6   1.468  -4.599  -7.650
   57   2H5*    U   6          2H5*        U   6   1.518  -5.754  -6.325
   58    H4*    U   6           H4*        U   6  -0.940  -5.074  -8.006
   59    H3*    U   6           H3*        U   6   0.130  -4.303  -5.311
   60    H2*    U   6           H2*        U   6  -2.084  -4.323  -4.380
   61   2HO*    U   6          2HO*        U   6  -3.128  -3.426  -6.179
   62    H1*    U   6           H1*        U   6  -2.770  -6.710  -5.360
   63    H3     U   6           H3         U   6  -1.412  -6.944  -0.939
   64    H5     U   6           H5         U   6   1.913  -8.029  -3.272
   65    H6     U   6           H6         U   6   0.731  -7.307  -5.242
   66   1H5*    A   7          1H5*        A   7  -2.379   0.109  -4.087
   67   2H5*    A   7          2H5*        A   7  -1.593  -1.162  -3.170
   68    H4*    A   7           H4*        A   7  -4.543  -1.051  -3.926
   69    H3*    A   7           H3*        A   7  -2.926  -0.333  -1.532
   70    H2*    A   7           H2*        A   7  -4.143  -1.640  -0.001
   71   2HO*    A   7          2HO*        A   7  -6.182  -0.988  -1.067
   72    H1*    A   7           H1*        A   7  -4.427  -3.887  -1.412
   73    H8     A   7           H8         A   7  -1.204  -3.234  -2.926
   74   1H6     A   7          1H6         A   7   1.426  -4.187   2.630
   75   2H6     A   7          2H6         A   7   1.723  -4.053   0.892
   76    H2     A   7           H2         A   7  -2.904  -3.746   3.228
   77   1H5*    U   8          1H5*        U   8  -6.221  -0.071   0.532
   78   2H5*    U   8          2H5*        U   8  -6.432   1.572   1.164
   79    H4*    U   8           H4*        U   8  -6.325  -0.062   2.995
   80    H3*    U   8           H3*        U   8  -3.911   1.726   2.712
   81    H2*    U   8           H2*        U   8  -3.213   0.917   4.886
   82   2HO*    U   8          2HO*        U   8  -5.453   0.490   5.681
   83    H1*    U   8           H1*        U   8  -3.425  -1.612   4.089
   84    H3     U   8           H3         U   8   0.880   0.264   3.740
   85    H5     U   8           H5         U   8  -0.835   0.150  -0.114
   86    H6     U   8           H6         U   8  -2.916  -0.359   0.891
   87   1H5*    G   9          1H5*        G   9  -5.687   4.324   6.746
   88   2H5*    G   9          2H5*        G   9  -4.447   3.863   5.599
   89    H4*    G   9           H4*        G   9  -4.526   3.087   8.549
   90    H3*    G   9           H3*        G   9  -3.132   5.151   6.867
   91    H2*    G   9           H2*        G   9  -1.092   4.881   8.127
   92   2HO*    G   9          2HO*        G   9  -2.346   4.558  10.134
   93    H1*    G   9           H1*        G   9  -1.032   2.235   8.006
   94    H8     G   9           H8         G   9  -2.862   2.850   4.831
   95    H1     G   9           H1         G   9   3.303   4.597   4.425
   96   1H2     G   9          1H2         G   9   4.163   4.816   6.430
   97   2H2     G   9          2H2         G   9   3.220   4.417   7.865
   98   1H5*    A  10          1H5*        A  10  -1.761   6.166  10.698
   99   2H5*    A  10          2H5*        A  10  -1.973   7.904  10.990
  100    H4*    A  10           H4*        A  10   0.382   7.198  11.211
  101    H3*    A  10           H3*        A  10  -0.235   9.120   8.933
  102    H2*    A  10           H2*        A  10   2.132   9.151   8.541
  103   2HO*    A  10          2HO*        A  10   2.634   9.059  10.829
  104    H1*    A  10           H1*        A  10   2.522   6.542   8.620
  105    H8     A  10           H8         A  10  -0.927   6.716   7.231
  106   1H6     A  10          1H6         A  10   1.744   7.852   1.748
  107   2H6     A  10          2H6         A  10   0.229   7.512   2.590
  108    H2     A  10           H2         A  10   4.848   8.203   4.874
  109   1H5*    U  11          1H5*        U  11   3.229  10.481  11.016
  110   2H5*    U  11          2H5*        U  11   3.166  12.233  11.200
  111    H4*    U  11           H4*        U  11   5.184  11.457   9.948
  112    H3*    U  11           H3*        U  11   3.163  13.192   8.518
  113    H2*    U  11           H2*        U  11   4.724  13.226   6.697
  114   2HO*    U  11          2HO*        U  11   6.571  13.486   7.961
  115    H1*    U  11           H1*        U  11   5.403  10.631   6.771
  116    H3     U  11           H3         U  11   3.048  11.302   2.933
  117    H5     U  11           H5         U  11   0.118  10.838   5.897
  118    H6     U  11           H6         U  11   1.858  10.897   7.576
  119   1H5*    A  12          1H5*        A  12   7.420  14.839   8.380
  120   2H5*    A  12          2H5*        A  12   7.252  16.601   8.484
  121    H4*    A  12           H4*        A  12   8.614  15.920   6.526
  122    H3*    A  12           H3*        A  12   5.972  17.297   6.027
  123    H2*    A  12           H2*        A  12   6.536  17.227   3.686
  124   2HO*    A  12          2HO*        A  12   8.774  17.687   4.088
  125    H1*    A  12           H1*        A  12   7.412  14.765   3.604
  126    H8     A  12           H8         A  12   4.453  14.990   5.963
  127   1H6     A  12          1H6         A  12   1.084  13.798   0.941
  128   2H6     A  12          2H6         A  12   1.068  13.828   2.712
  129    H2     A  12           H2         A  12   5.211  14.550  -0.369
  130   1H5*    C  13          1H5*        C  13   9.145  19.016   3.587
  131   2H5*    C  13          2H5*        C  13   9.016  20.802   3.617
  132    H4*    C  13           H4*        C  13   9.181  20.032   1.319
  133    H3*    C  13           H3*        C  13   6.414  20.967   2.075
  134    H2*    C  13           H2*        C  13   5.814  20.512  -0.174
  135   2HO*    C  13          2HO*        C  13   7.642  21.413  -1.135
  136    H1*    C  13           H1*        C  13   7.152  18.216  -0.502
  137   1H4     C  13          1H4         C  13   1.233  16.619   0.831
  138   2H4     C  13          2H4         C  13   1.393  17.085   2.532
  139    H5     C  13           H5         C  13   3.497  17.944   3.437
  140    H6     C  13           H6         C  13   5.675  18.765   2.835
  141   1H5*    A  14          1H5*        A  14   4.625  24.425  -0.938
  142   2H5*    A  14          2H5*        A  14   4.166  23.282   0.313
  143    H4*    A  14           H4*        A  14   4.320  22.723  -2.673
  144    H3*    A  14           H3*        A  14   2.217  22.892  -0.535
  145    H2*    A  14           H2*        A  14   0.880  21.184  -1.621
  146   2HO*    A  14          2HO*        A  14   1.692  21.543  -3.854
  147    H1*    A  14           H1*        A  14   2.760  19.509  -1.490
  148    H8     A  14           H8         A  14   4.369  21.404   1.129
  149   1H6     A  14          1H6         A  14  -0.221  19.756   4.968
  150   2H6     A  14          2H6         A  14   1.410  20.437   4.859
  151    H2     A  14           H2         A  14  -1.542  18.927   0.859
  152   1H5*    A  15          1H5*        A  15  -0.693  23.373  -5.395
  153   2H5*    A  15          2H5*        A  15  -0.750  23.300  -3.636
  154    H4*    A  15           H4*        A  15  -0.252  20.813  -5.333
  155    H3*    A  15           H3*        A  15  -2.557  22.117  -5.672
  156    H2*    A  15           H2*        A  15  -2.933  22.606  -3.396
  157   2HO*    A  15          2HO*        A  15  -4.299  20.208  -4.049
  158    H1*    A  15           H1*        A  15  -2.438  19.780  -2.532
  159    H8     A  15           H8         A  15  -0.433  22.846  -1.743
  160   1H6     A  15          1H6         A  15  -3.644  23.054   3.586
  161   2H6     A  15          2H6         A  15  -2.220  23.695   2.747
  162    H2     A  15           H2         A  15  -5.538  20.147   0.914
  163   1H5*    U  16          1H5*        U  16  -6.007  21.497  -7.074
  164   2H5*    U  16          2H5*        U  16  -5.092  21.938  -5.643
  165    H4*    U  16           H4*        U  16  -7.755  20.425  -5.612
  166    H3*    U  16           H3*        U  16  -6.805  23.211  -4.987
  167    H2*    U  16           H2*        U  16  -8.428  23.526  -3.454
  168   2HO*    U  16          2HO*        U  16 -10.199  22.354  -4.821
  169    H1*    U  16           H1*        U  16  -8.373  20.864  -2.539
  170    H3     U  16           H3         U  16  -7.261  23.129   1.178
  171    H5     U  16           H5         U  16  -4.376  24.375  -1.570
  172    H6     U  16           H6         U  16  -5.395  23.010  -3.232
  173   1H5*    U  17          1H5*        U  17  -7.814  20.328  -7.961
  174   2H5*    U  17          2H5*        U  17  -9.201  20.510  -9.027
  175    H4*    U  17           H4*        U  17 -10.208  18.582  -7.463
  176    H3*    U  17           H3*        U  17  -7.469  18.583  -6.638
  177    H2*    U  17           H2*        U  17  -6.457  16.936  -7.921
  178   2HO*    U  17          2HO*        U  17  -8.075  15.381  -7.018
  179    H1*    U  17           H1*        U  17  -8.082  16.549 -10.041
  180    H3     U  17           H3         U  17  -6.489  19.489 -13.110
  181    H5     U  17           H5         U  17  -4.710  20.683  -9.544
  182    H6     U  17           H6         U  17  -6.009  19.055  -8.353
  183   1H5*    U  18          1H5*        U  18  -5.748  14.830  -4.845
  184   2H5*    U  18          2H5*        U  18  -6.121  15.181  -6.496
  185    H4*    U  18           H4*        U  18  -7.085  12.617  -5.193
  186    H3*    U  18           H3*        U  18  -4.326  13.242  -5.820
  187    H2*    U  18           H2*        U  18  -3.921  12.012  -7.675
  188   2HO*    U  18          2HO*        U  18  -4.848   9.995  -6.642
  189    H1*    U  18           H1*        U  18  -6.419  11.832  -8.872
  190    H3     U  18           H3         U  18  -5.987  15.197 -11.799
  191    H5     U  18           H5         U  18  -3.605  16.424  -8.566
  192    H6     U  18           H6         U  18  -4.297  14.514  -7.385
  193   1H5*    G  19          1H5*        G  19  -1.204   9.650  -6.009
  194   2H5*    G  19          2H5*        G  19  -0.866  10.908  -4.833
  195    H4*    G  19           H4*        G  19  -0.590  11.023  -7.867
  196    H3*    G  19           H3*        G  19   1.043  11.310  -5.405
  197    H2*    G  19           H2*        G  19   2.513  12.958  -6.353
  198   2HO*    G  19          2HO*        G  19   2.358  12.164  -8.596
  199    H1*    G  19           H1*        G  19   0.525  14.564  -6.943
  200    H8     G  19           H8         G  19  -1.634  12.866  -4.727
  201    H1     G  19           H1         G  19   2.941  15.809  -1.316
  202   1H2     G  19          1H2         G  19   4.669  15.653  -4.326
  203   2H2     G  19          2H2         G  19   4.652  16.273  -2.669
  204   1H5*    A  20          1H5*        A  20   5.024  12.330  -7.413
  205   2H5*    A  20          2H5*        A  20   5.865  10.770  -7.366
  206    H4*    A  20           H4*        A  20   6.963  12.359  -5.897
  207    H3*    A  20           H3*        A  20   5.436  10.222  -4.419
  208    H2*    A  20           H2*        A  20   6.676  10.988  -2.460
  209   2HO*    A  20          2HO*        A  20   8.607  11.755  -3.654
  210    H1*    A  20           H1*        A  20   5.858  13.474  -2.854
  211    H8     A  20           H8         A  20   3.020  11.722  -4.428
  212   1H6     A  20          1H6         A  20   1.124  10.371   1.339
  213   2H6     A  20          2H6         A  20   0.640  10.428  -0.361
  214    H2     A  20           H2         A  20   5.340  11.550   1.548
  215   1H5*    U  21          1H5*        U  21   9.936   8.176  -3.163
  216   2H5*    U  21          2H5*        U  21   8.218   8.455  -2.958
  217    H4*    U  21           H4*        U  21  10.403   9.747  -1.273
  218    H3*    U  21           H3*        U  21   8.694   7.278  -0.803
  219    H2*    U  21           H2*        U  21   8.647   7.889   1.530
  220   2HO*    U  21          2HO*        U  21  10.862   8.712   1.420
  221    H1*    U  21           H1*        U  21   7.905  10.402   1.137
  222    H3     U  21           H3         U  21   4.212   7.802   2.119
  223    H5     U  21           H5         U  21   4.341   8.115  -2.060
  224    H6     U  21           H6         U  21   6.537   9.101  -1.892
  225   1H5*    C  22          1H5*        C  22  11.396   7.426   2.386
  226   2H5*    C  22          2H5*        C  22  12.120   5.837   2.663
  227    H4*    C  22           H4*        C  22  11.013   6.736   4.678
  228    H3*    C  22           H3*        C  22   9.805   4.162   3.551
  229    H2*    C  22           H2*        C  22   8.420   4.174   5.423
  230   2HO*    C  22          2HO*        C  22  10.006   4.786   6.924
  231    H1*    C  22           H1*        C  22   7.728   6.771   5.390
  232   1H4     C  22          1H4         C  22   3.250   4.055   1.890
  233   2H4     C  22          2H4         C  22   4.230   4.248   0.445
  234    H5     C  22           H5         C  22   6.470   5.110   0.480
  235    H6     C  22           H6         C  22   8.210   5.948   1.886
  236   1H5*    A  23          1H5*        A  23  10.492   0.899   7.542
  237   2H5*    A  23          2H5*        A  23   9.361   1.191   6.225
  238    H4*    A  23           H4*        A  23   9.184   2.366   9.027
  239    H3*    A  23           H3*        A  23   7.722   0.224   7.484
  240    H2*    A  23           H2*        A  23   5.716   0.898   8.639
  241   2HO*    A  23          2HO*        A  23   5.906   2.852  10.063
  242    H1*    A  23           H1*        A  23   5.887   3.455   7.871
  243    H8     A  23           H8         A  23   7.956   2.285   5.227
  244   1H6     A  23          1H6         A  23   2.926   0.291   2.238
  245   2H6     A  23          2H6         A  23   4.664   0.615   2.144
  246    H2     A  23           H2         A  23   1.854   0.850   6.530
  247   1H5*    G  24          1H5*        G  24   5.379   0.497  10.741
  248   2H5*    G  24          2H5*        G  24   6.013  -0.645  11.878
  249    H4*    G  24           H4*        G  24   4.063  -1.924  11.853
  250    H3*    G  24           H3*        G  24   3.884  -1.664   9.147
  251    H2*    G  24           H2*        G  24   3.399   0.387   8.846
  252   2HO*    G  24          2HO*        G  24   0.814  -0.509   9.536
  253    H1*    G  24           H1*        G  24   1.567   0.911  11.090
  254    H8     G  24           H8         G  24   4.165   2.135   8.787
  255    H1     G  24           H1         G  24   3.654   5.924  13.946
  256   1H2     G  24          1H2         G  24   2.502   4.834  15.544
  257   2H2     G  24          2H2         G  24   1.912   3.201  15.239
  258   1H5*    U  25          1H5*        U  25  -1.342  -2.602  12.151
  259   2H5*    U  25          2H5*        U  25  -1.223  -4.357  12.361
  260    H4*    U  25           H4*        U  25  -3.116  -3.607  10.911
  261    H3*    U  25           H3*        U  25  -1.031  -5.397   9.640
  262    H2*    U  25           H2*        U  25  -2.582  -5.493   7.772
  263   2HO*    U  25          2HO*        U  25  -4.510  -5.523   8.939
  264    H1*    U  25           H1*        U  25  -3.017  -2.849   7.685
  265    H3     U  25           H3         U  25  -0.313  -3.851   4.209
  266    H5     U  25           H5         U  25   2.312  -3.592   7.451
  267    H6     U  25           H6         U  25   0.384  -3.371   8.902
  268   1H5*    A  26          1H5*        A  26  -5.221  -8.993   8.407
  269   2H5*    A  26          2H5*        A  26  -3.858  -8.414   7.460
  270    H4*    A  26           H4*        A  26  -6.584  -7.059   7.647
  271    H3*    A  26           H3*        A  26  -5.274  -8.882   5.649
  272    H2*    A  26           H2*        A  26  -6.232  -7.586   3.835
  273   2HO*    A  26          2HO*        A  26  -8.207  -7.203   5.160
  274    H1*    A  26           H1*        A  26  -5.425  -5.207   4.713
  275    H8     A  26           H8         A  26  -2.821  -7.187   6.324
  276   1H6     A  26          1H6         A  26  -0.053  -7.831   0.797
  277   2H6     A  26          2H6         A  26   0.098  -7.996   2.552
  278    H2     A  26           H2         A  26  -4.151  -6.297   0.114
  279   1H5*    U  27          1H5*        U  27  -9.012  -8.215   4.062
  280   2H5*    U  27          2H5*        U  27  -9.847  -9.695   3.593
  281    H4*    U  27           H4*        U  27  -9.615  -8.126   1.699
  282    H3*    U  27           H3*        U  27  -8.094 -10.738   1.469
  283    H2*    U  27           H2*        U  27  -7.502  -9.991  -0.773
  284   2HO*    U  27          2HO*        U  27  -9.589  -9.022  -1.097
  285    H1*    U  27           H1*        U  27  -6.757  -7.529  -0.062
  286    H3     U  27           H3         U  27  -3.101 -10.264  -0.864
  287    H5     U  27           H5         U  27  -3.813 -10.385   3.280
  288    H6     U  27           H6         U  27  -5.890  -9.293   2.923
  289   1H5*    A  28          1H5*        A  28 -10.202 -10.055  -2.155
  290   2H5*    A  28          2H5*        A  28 -10.932 -11.534  -2.772
  291    H4*    A  28           H4*        A  28  -9.476 -10.473  -4.444
  292    H3*    A  28           H3*        A  28  -8.503 -13.171  -3.432
  293    H2*    A  28           H2*        A  28  -6.772 -12.937  -5.133
  294   2HO*    A  28          2HO*        A  28  -8.205 -11.907  -6.650
  295    H1*    A  28           H1*        A  28  -6.050 -10.471  -4.423
  296    H8     A  28           H8         A  28  -7.182 -11.886  -1.157
  297   1H6     A  28          1H6         A  28  -1.739 -14.824  -0.934
  298   2H6     A  28          2H6         A  28  -3.206 -14.416  -0.052
  299    H2     A  28           H2         A  28  -2.270 -13.284  -5.045
  300   1H5*    U  29          1H5*        U  29  -8.428 -13.232  -7.636
  301   2H5*    U  29          2H5*        U  29  -9.026 -14.759  -8.298
  302    H4*    U  29           H4*        U  29  -6.762 -14.238  -9.104
  303    H3*    U  29           H3*        U  29  -6.902 -16.698  -7.306
  304    H2*    U  29           H2*        U  29  -4.563 -16.963  -7.902
  305   2HO*    U  29          2HO*        U  29  -4.927 -16.160 -10.072
  306    H1*    U  29           H1*        U  29  -3.868 -14.457  -7.323
  307    H3     U  29           H3         U  29  -2.688 -17.282  -3.896
  308    H5     U  29           H5         U  29  -6.518 -15.907  -2.915
  309    H6     U  29           H6         U  29  -6.664 -14.905  -5.088
  310   1H5*    C  30          1H5*        C  30  -4.733 -17.689 -10.735
  311   2H5*    C  30          2H5*        C  30  -5.161 -19.284 -11.362
  312    H4*    C  30           H4*        C  30  -2.750 -19.086 -10.925
  313    H3*    C  30           H3*        C  30  -4.169 -21.086  -9.100
  314    H2*    C  30           H2*        C  30  -1.928 -21.609  -8.346
  315   2HO*    C  30          2HO*        C  30  -1.089 -21.207 -10.550
  316    H1*    C  30           H1*        C  30  -1.204 -19.076  -7.904
  317   1H4     C  30          1H4         C  30  -3.987 -20.861  -2.559
  318   2H4     C  30          2H4         C  30  -5.505 -20.112  -3.072
  319    H5     C  30           H5         C  30  -5.840 -19.266  -5.307
  320    H6     C  30           H6         C  30  -4.782 -18.872  -7.409
  321   1H5*    C  31          1H5*        C  31  -0.743 -22.891 -10.659
  322   2H5*    C  31          2H5*        C  31  -1.126 -24.481 -11.329
  323    H4*    C  31           H4*        C  31   0.698 -24.698  -9.730
  324    H3*    C  31           H3*        C  31  -1.956 -25.798  -8.731
  325    H2*    C  31           H2*        C  31  -0.711 -26.683  -6.874
  326   2HO*    C  31          2HO*        C  31   1.164 -27.179  -8.266
  327    H1*    C  31           H1*        C  31   0.639 -24.368  -6.394
  328   1H4     C  31          1H4         C  31  -4.554 -24.118  -2.872
  329   2H4     C  31          2H4         C  31  -5.434 -23.278  -4.159
  330    H5     C  31           H5         C  31  -4.535 -22.993  -6.380
  331    H6     C  31           H6         C  31  -2.616 -23.349  -7.756
  332    H3T    C  31           H3T        C  31  -1.088 -26.837 -10.548
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -6.295 -22.427   7.637
    2   2H5*    G   1          2H5*        G   1  -5.627 -23.357   6.296
    3    H4*    G   1           H4*        G   1  -4.704 -23.622   9.195
    4    H3*    G   1           H3*        G   1  -3.766 -21.869   6.930
    5    H2*    G   1           H2*        G   1  -1.479 -22.238   7.655
    6   2HO*    G   1          2HO*        G   1  -2.028 -22.231   9.927
    7    H1*    G   1           H1*        G   1  -1.688 -24.890   7.812
    8    H8     G   1           H8         G   1  -4.190 -24.232   5.144
    9    H1     G   1           H1         G   1   1.839 -23.286   3.163
   10   1H2     G   1          1H2         G   1   3.192 -23.236   4.921
   11   2H2     G   1          2H2         G   1   2.582 -23.470   6.546
   12    H5T    G   1           H5T        G   1  -6.865 -24.414   8.630
   13   1H5*    G   2          1H5*        G   2  -1.528 -20.672  10.208
   14   2H5*    G   2          2H5*        G   2  -1.485 -18.911  10.363
   15    H4*    G   2           H4*        G   2   0.777 -19.863  10.296
   16    H3*    G   2           H3*        G   2   0.032 -18.157   7.899
   17    H2*    G   2           H2*        G   2   2.353 -18.442   7.218
   18   2HO*    G   2          2HO*        G   2   3.108 -18.357   9.447
   19    H1*    G   2           H1*        G   2   2.383 -21.105   7.579
   20    H8     G   2           H8         G   2  -1.149 -20.566   6.532
   21    H1     G   2           H1         G   2   3.016 -19.743   1.720
   22   1H2     G   2          1H2         G   2   5.070 -19.553   2.541
   23   2H2     G   2          2H2         G   2   5.379 -19.732   4.263
   24   1H5*    A   3          1H5*        A   3   3.819 -16.911   9.296
   25   2H5*    A   3          2H5*        A   3   3.927 -15.150   9.386
   26    H4*    A   3           H4*        A   3   5.779 -16.095   8.072
   27    H3*    A   3           H3*        A   3   3.794 -14.415   6.514
   28    H2*    A   3           H2*        A   3   5.325 -14.691   4.636
   29   2HO*    A   3          2HO*        A   3   7.227 -14.581   6.005
   30    H1*    A   3           H1*        A   3   5.598 -17.338   4.928
   31    H8     A   3           H8         A   3   2.075 -16.861   6.059
   32   1H6     A   3          1H6         A   3   0.571 -16.675   0.051
   33   2H6     A   3          2H6         A   3  -0.016 -16.857   1.682
   34    H2     A   3           H2         A   3   4.970 -16.077   0.382
   35   1H5*    U   4          1H5*        U   4   7.654 -13.098   5.519
   36   2H5*    U   4          2H5*        U   4   7.778 -11.337   5.445
   37    H4*    U   4           H4*        U   4   8.491 -12.407   3.328
   38    H3*    U   4           H3*        U   4   5.976 -10.718   3.158
   39    H2*    U   4           H2*        U   4   6.107 -11.131   0.751
   40   2HO*    U   4          2HO*        U   4   8.456 -11.058   0.766
   41    H1*    U   4           H1*        U   4   6.481 -13.788   0.998
   42    H3     U   4           H3         U   4   2.182 -12.796  -0.277
   43    H5     U   4           H5         U   4   2.103 -12.992   3.911
   44    H6     U   4           H6         U   4   4.504 -13.069   3.899
   45   1H5*    A   5          1H5*        A   5   8.483  -9.664  -0.032
   46   2H5*    A   5          2H5*        A   5   8.543  -7.920  -0.290
   47    H4*    A   5           H4*        A   5   7.907  -9.111  -2.343
   48    H3*    A   5           H3*        A   5   5.705  -7.382  -1.152
   49    H2*    A   5           H2*        A   5   4.487  -7.904  -3.188
   50   2HO*    A   5          2HO*        A   5   6.409  -7.876  -4.523
   51    H1*    A   5           H1*        A   5   4.904 -10.548  -3.017
   52    H8     A   5           H8         A   5   4.883  -9.586   0.584
   53   1H6     A   5          1H6         A   5  -1.291  -9.427   0.195
   54   2H6     A   5          2H6         A   5   0.088  -9.479   1.292
   55    H2     A   5           H2         A   5   0.325  -9.393  -3.924
   56   1H5*    U   6          1H5*        U   6   6.094  -6.419  -5.256
   57   2H5*    U   6          2H5*        U   6   6.008  -4.664  -5.485
   58    H4*    U   6           H4*        U   6   4.322  -5.896  -6.843
   59    H3*    U   6           H3*        U   6   3.287  -4.003  -4.702
   60    H2*    U   6           H2*        U   6   1.095  -4.472  -5.551
   61   2HO*    U   6          2HO*        U   6   1.658  -4.448  -7.755
   62    H1*    U   6           H1*        U   6   1.431  -7.160  -5.768
   63    H3     U   6           H3         U   6  -1.328  -6.192  -2.251
   64    H5     U   6           H5         U   6   2.556  -6.136  -0.656
   65    H6     U   6           H6         U   6   3.424  -6.290  -2.882
   66   1H5*    A   7          1H5*        A   7   0.434  -0.623  -7.269
   67   2H5*    A   7          2H5*        A   7   0.404  -1.440  -5.709
   68    H4*    A   7           H4*        A   7  -1.035  -2.377  -8.232
   69    H3*    A   7           H3*        A   7  -1.778  -0.685  -5.898
   70    H2*    A   7           H2*        A   7  -3.683  -1.933  -5.283
   71   2HO*    A   7          2HO*        A   7  -4.303  -2.128  -7.586
   72    H1*    A   7           H1*        A   7  -2.737  -4.425  -5.638
   73    H8     A   7           H8         A   7   0.420  -2.987  -4.379
   74   1H6     A   7          1H6         A   7  -2.333  -2.648   1.189
   75   2H6     A   7          2H6         A   7  -0.794  -2.520   0.328
   76    H2     A   7           H2         A   7  -5.459  -3.456  -1.813
   77   1H5*    U   8          1H5*        U   8  -5.656  -1.022  -7.000
   78   2H5*    U   8          2H5*        U   8  -6.270   0.627  -7.200
   79    H4*    U   8           H4*        U   8  -7.539  -0.519  -5.468
   80    H3*    U   8           H3*        U   8  -5.608   1.502  -4.309
   81    H2*    U   8           H2*        U   8  -6.953   1.257  -2.284
   82   2HO*    U   8          2HO*        U   8  -9.013   0.802  -3.319
   83    H1*    U   8           H1*        U   8  -6.684  -1.389  -2.388
   84    H3     U   8           H3         U   8  -3.739   0.436   0.634
   85    H5     U   8           H5         U   8  -1.698   0.337  -3.041
   86    H6     U   8           H6         U   8  -3.761  -0.268  -4.115
   87   1H5*    G   9          1H5*        G   9  -9.784   4.462  -3.614
   88   2H5*    G   9          2H5*        G   9  -8.182   3.884  -3.158
   89    H4*    G   9           H4*        G   9 -10.749   3.423  -1.576
   90    H3*    G   9           H3*        G   9  -8.444   5.359  -1.321
   91    H2*    G   9           H2*        G   9  -8.530   5.111   1.091
   92   2HO*    G   9          2HO*        G   9 -10.893   4.981   1.066
   93    H1*    G   9           H1*        G   9  -8.607   2.430   1.092
   94    H8     G   9           H8         G   9  -6.668   3.154  -2.037
   95    H1     G   9           H1         G   9  -3.240   4.157   3.281
   96   1H2     G   9          1H2         G   9  -4.578   4.172   5.048
   97   2H2     G   9          2H2         G   9  -6.292   3.820   4.898
   98   1H5*    A  10          1H5*        A  10 -10.953   6.425   1.911
   99   2H5*    A  10          2H5*        A  10 -11.180   8.179   1.879
  100    H4*    A  10           H4*        A  10 -10.292   7.425   4.057
  101    H3*    A  10           H3*        A  10  -8.330   8.989   2.359
  102    H2*    A  10           H2*        A  10  -7.005   9.157   4.389
  103   2HO*    A  10          2HO*        A  10  -8.836   9.084   5.919
  104    H1*    A  10           H1*        A  10  -7.071   6.538   4.701
  105    H8     A  10           H8         A  10  -7.381   6.783   0.993
  106   1H6     A  10          1H6         A  10  -1.259   7.851   0.927
  107   2H6     A  10          2H6         A  10  -2.670   7.513  -0.070
  108    H2     A  10           H2         A  10  -2.666   8.162   5.110
  109   1H5*    U  11          1H5*        U  11  -8.982  12.828   5.478
  110   2H5*    U  11          2H5*        U  11  -8.101  11.836   4.323
  111    H4*    U  11           H4*        U  11  -7.386  12.106   7.277
  112    H3*    U  11           H3*        U  11  -6.466  13.510   4.763
  113    H2*    U  11           H2*        U  11  -4.226  13.567   5.676
  114   2HO*    U  11          2HO*        U  11  -4.970  14.005   7.839
  115    H1*    U  11           H1*        U  11  -4.204  11.019   6.523
  116    H3     U  11           H3         U  11  -1.630  11.300   2.749
  117    H5     U  11           H5         U  11  -5.541  10.629   1.369
  118    H6     U  11           H6         U  11  -6.346  10.895   3.644
  119   1H5*    A  12          1H5*        A  12  -4.645  15.559   8.181
  120   2H5*    A  12          2H5*        A  12  -4.855  17.295   7.877
  121    H4*    A  12           H4*        A  12  -2.488  16.806   8.294
  122    H3*    A  12           H3*        A  12  -3.231  17.564   5.455
  123    H2*    A  12           H2*        A  12  -0.853  17.604   5.016
  124   2HO*    A  12          2HO*        A  12  -0.345  18.534   7.097
  125    H1*    A  12           H1*        A  12  -0.304  15.327   6.288
  126    H8     A  12           H8         A  12  -3.642  15.115   4.530
  127   1H6     A  12          1H6         A  12  -0.331  13.047  -0.278
  128   2H6     A  12          2H6         A  12  -1.959  13.173   0.373
  129    H2     A  12           H2         A  12   2.477  14.482   2.804
  130   1H5*    C  13          1H5*        C  13   0.082  19.847   7.078
  131   2H5*    C  13          2H5*        C  13  -0.093  21.565   6.634
  132    H4*    C  13           H4*        C  13   2.164  20.841   6.018
  133    H3*    C  13           H3*        C  13   0.425  21.196   3.642
  134    H2*    C  13           H2*        C  13   2.526  20.841   2.465
  135   2HO*    C  13          2HO*        C  13   3.811  22.068   3.879
  136    H1*    C  13           H1*        C  13   3.340  18.725   3.961
  137   1H4     C  13          1H4         C  13   0.126  15.951  -0.767
  138   2H4     C  13          2H4         C  13  -1.397  16.399  -0.031
  139    H5     C  13           H5         C  13  -1.555  17.742   2.007
  140    H6     C  13           H6         C  13  -0.334  18.918   3.669
  141   1H5*    A  14          1H5*        A  14   3.173  24.709   1.104
  142   2H5*    A  14          2H5*        A  14   2.348  23.168   0.848
  143    H4*    A  14           H4*        A  14   5.332  23.499   1.368
  144    H3*    A  14           H3*        A  14   3.576  23.276  -1.026
  145    H2*    A  14           H2*        A  14   5.071  21.720  -2.117
  146   2HO*    A  14          2HO*        A  14   6.959  22.908  -1.202
  147    H1*    A  14           H1*        A  14   5.431  20.136  -0.013
  148    H8     A  14           H8         A  14   1.961  21.217   0.769
  149   1H6     A  14          1H6         A  14   0.169  17.100  -3.544
  150   2H6     A  14          2H6         A  14  -0.353  18.099  -2.185
  151    H2     A  14           H2         A  14   4.524  17.769  -4.015
  152   1H5*    A  15          1H5*        A  15   7.346  23.445  -2.788
  153   2H5*    A  15          2H5*        A  15   7.510  24.882  -3.805
  154    H4*    A  15           H4*        A  15   8.090  22.754  -4.985
  155    H3*    A  15           H3*        A  15   6.823  24.857  -6.103
  156    H2*    A  15           H2*        A  15   4.628  24.131  -5.445
  157   2HO*    A  15          2HO*        A  15   4.967  24.357  -7.907
  158    H1*    A  15           H1*        A  15   5.372  21.449  -6.533
  159    H8     A  15           H8         A  15   3.807  22.798  -3.405
  160   1H6     A  15          1H6         A  15  -1.133  19.384  -5.066
  161   2H6     A  15          2H6         A  15  -0.538  20.533  -3.840
  162    H2     A  15           H2         A  15   2.132  18.698  -7.929
  163   1H5*    U  16          1H5*        U  16   6.253  23.182 -11.345
  164   2H5*    U  16          2H5*        U  16   4.834  23.768 -10.459
  165    H4*    U  16           H4*        U  16   4.210  22.077 -12.087
  166    H3*    U  16           H3*        U  16   3.689  21.707  -9.234
  167    H2*    U  16           H2*        U  16   3.633  19.348  -9.180
  168   2HO*    U  16          2HO*        U  16   2.074  19.326 -10.899
  169    H1*    U  16           H1*        U  16   5.280  18.638 -11.186
  170    H3     U  16           H3         U  16   9.279  18.380  -9.111
  171    H5     U  16           H5         U  16   6.690  19.996  -6.270
  172    H6     U  16           H6         U  16   5.064  20.405  -7.971
  173   1H5*    U  17          1H5*        U  17   0.122  18.958 -11.278
  174   2H5*    U  17          2H5*        U  17  -1.031  19.288 -10.003
  175    H4*    U  17           H4*        U  17   1.322  17.399  -9.625
  176    H3*    U  17           H3*        U  17  -0.884  16.824 -11.321
  177    H2*    U  17           H2*        U  17  -2.447  15.747  -9.931
  178   2HO*    U  17          2HO*        U  17  -0.949  14.023  -9.639
  179    H1*    U  17           H1*        U  17  -1.701  16.373  -7.367
  180    H3     U  17           H3         U  17  -4.049  20.296  -6.810
  181    H5     U  17           H5         U  17  -4.406  19.398 -10.887
  182    H6     U  17           H6         U  17  -2.852  17.619 -10.598
  183   1H5*    U  18          1H5*        U  18   1.418  11.878  -9.966
  184   2H5*    U  18          2H5*        U  18   1.398  13.516  -9.335
  185    H4*    U  18           H4*        U  18   3.880  12.478 -10.707
  186    H3*    U  18           H3*        U  18   2.794  11.460  -8.230
  187    H2*    U  18           H2*        U  18   4.164  12.503  -6.616
  188   2HO*    U  18          2HO*        U  18   6.104  11.777  -7.608
  189    H1*    U  18           H1*        U  18   4.827  14.839  -7.807
  190    H3     U  18           H3         U  18   1.591  17.377  -6.029
  191    H5     U  18           H5         U  18  -0.044  13.516  -5.949
  192    H6     U  18           H6         U  18   1.806  12.753  -7.188
  193   1H5*    G  19          1H5*        G  19   6.145   8.711  -5.576
  194   2H5*    G  19          2H5*        G  19   4.784   9.804  -5.313
  195    H4*    G  19           H4*        G  19   7.734  10.554  -5.151
  196    H3*    G  19           H3*        G  19   5.553   9.984  -3.142
  197    H2*    G  19           H2*        G  19   6.412  11.739  -1.714
  198   2HO*    G  19          2HO*        G  19   8.650  11.164  -2.271
  199    H1*    G  19           H1*        G  19   6.651  13.580  -3.673
  200    H8     G  19           H8         G  19   3.771  11.341  -4.618
  201    H1     G  19           H1         G  19   2.270  15.870  -0.353
  202   1H2     G  19          1H2         G  19   4.125  16.854   0.388
  203   2H2     G  19          2H2         G  19   5.694  16.375  -0.223
  204   1H5*    A  20          1H5*        A  20   8.588  10.545  -0.397
  205   2H5*    A  20          2H5*        A  20   8.757   9.009   0.487
  206    H4*    A  20           H4*        A  20   8.416  10.810   2.097
  207    H3*    A  20           H3*        A  20   6.001   9.046   1.662
  208    H2*    A  20           H2*        A  20   5.054  10.103   3.637
  209   2HO*    A  20          2HO*        A  20   7.246  10.588   4.627
  210    H1*    A  20           H1*        A  20   5.426  12.511   2.572
  211    H8     A  20           H8         A  20   5.136  10.641  -0.600
  212   1H6     A  20          1H6         A  20  -0.955  10.312   0.380
  213   2H6     A  20          2H6         A  20   0.344  10.106  -0.795
  214    H2     A  20           H2         A  20   0.969  11.502   4.200
  215   1H5*    U  21          1H5*        U  21   6.723   6.978   6.163
  216   2H5*    U  21          2H5*        U  21   5.803   7.418   4.733
  217    H4*    U  21           H4*        U  21   5.451   8.697   7.480
  218    H3*    U  21           H3*        U  21   4.044   6.431   6.055
  219    H2*    U  21           H2*        U  21   1.952   7.208   6.982
  220   2HO*    U  21          2HO*        U  21   2.969   7.803   9.034
  221    H1*    U  21           H1*        U  21   2.328   9.805   6.377
  222    H3     U  21           H3         U  21  -0.601   7.803   3.440
  223    H5     U  21           H5         U  21   3.191   7.563   1.656
  224    H6     U  21           H6         U  21   4.176   8.299   3.739
  225   1H5*    C  22          1H5*        C  22   2.094   6.518   9.791
  226   2H5*    C  22          2H5*        C  22   1.969   4.860  10.402
  227    H4*    C  22           H4*        C  22  -0.253   5.936  10.176
  228    H3*    C  22           H3*        C  22   0.277   3.723   8.180
  229    H2*    C  22           H2*        C  22  -2.121   3.799   7.791
  230   2HO*    C  22          2HO*        C  22  -2.750   4.454   9.976
  231    H1*    C  22           H1*        C  22  -2.022   6.441   7.420
  232   1H4     C  22          1H4         C  22  -0.855   3.844   1.779
  233   2H4     C  22          2H4         C  22   0.882   3.983   2.036
  234    H5     C  22           H5         C  22   1.835   4.694   4.218
  235    H6     C  22           H6         C  22   1.269   5.404   6.444
  236   1H5*    A  23          1H5*        A  23  -2.954   0.955  11.197
  237   2H5*    A  23          2H5*        A  23  -2.236   1.341   9.638
  238    H4*    A  23           H4*        A  23  -5.134   1.893  10.425
  239    H3*    A  23           H3*        A  23  -3.750  -0.316   8.917
  240    H2*    A  23           H2*        A  23  -5.566  -0.371   7.312
  241   2HO*    A  23          2HO*        A  23  -7.126   0.096   9.106
  242    H1*    A  23           H1*        A  23  -5.664   2.281   6.903
  243    H8     A  23           H8         A  23  -2.054   1.876   7.698
  244   1H6     A  23          1H6         A  23  -1.339  -0.206   1.908
  245   2H6     A  23          2H6         A  23  -0.512   0.328   3.368
  246    H2     A  23           H2         A  23  -5.671  -0.226   2.841
  247   1H5*    G  24          1H5*        G  24  -7.238  -1.831   8.377
  248   2H5*    G  24          2H5*        G  24  -7.328  -3.520   8.908
  249    H4*    G  24           H4*        G  24  -7.772  -3.316   6.504
  250    H3*    G  24           H3*        G  24  -5.227  -4.763   7.264
  251    H2*    G  24           H2*        G  24  -4.952  -5.226   4.882
  252   2HO*    G  24          2HO*        G  24  -7.255  -5.446   4.462
  253    H1*    G  24           H1*        G  24  -5.339  -2.725   4.084
  254    H8     G  24           H8         G  24  -3.979  -1.765   7.337
  255    H1     G  24           H1         G  24   0.609  -4.405   3.750
  256   1H2     G  24          1H2         G  24  -0.297  -5.423   1.966
  257   2H2     G  24          2H2         G  24  -2.017  -5.347   1.697
  258   1H5*    U  25          1H5*        U  25  -9.533  -6.125   5.816
  259   2H5*    U  25          2H5*        U  25  -9.678  -7.864   5.496
  260    H4*    U  25           H4*        U  25 -11.040  -6.486   3.941
  261    H3*    U  25           H3*        U  25  -8.892  -8.266   2.888
  262    H2*    U  25           H2*        U  25  -9.063  -7.363   0.689
  263   2HO*    U  25          2HO*        U  25 -11.335  -7.472   0.617
  264    H1*    U  25           H1*        U  25  -9.550  -4.776   1.280
  265    H3     U  25           H3         U  25  -5.344  -3.590   0.411
  266    H5     U  25           H5         U  25  -4.850  -7.162   2.536
  267    H6     U  25           H6         U  25  -7.220  -7.254   2.816
  268   1H5*    A  26          1H5*        A  26 -10.479 -10.904  -0.983
  269   2H5*    A  26          2H5*        A  26  -9.038 -10.120  -0.349
  270    H4*    A  26           H4*        A  26 -10.897  -8.994  -2.491
  271    H3*    A  26           H3*        A  26  -8.259 -10.424  -2.446
  272    H2*    A  26           H2*        A  26  -7.293  -8.972  -4.070
  273   2HO*    A  26          2HO*        A  26  -9.328  -8.920  -5.305
  274    H1*    A  26           H1*        A  26  -8.183  -6.658  -3.052
  275    H8     A  26           H8         A  26  -7.716  -8.722   0.009
  276   1H6     A  26          1H6         A  26  -1.717  -7.281  -0.300
  277   2H6     A  26          2H6         A  26  -2.995  -7.977   0.682
  278    H2     A  26           H2         A  26  -3.574  -6.184  -4.173
  279   1H5*    U  27          1H5*        U  27  -8.442 -10.278  -6.392
  280   2H5*    U  27          2H5*        U  27  -8.176 -11.869  -7.126
  281    H4*    U  27           H4*        U  27  -6.432 -10.354  -7.853
  282    H3*    U  27           H3*        U  27  -5.390 -12.397  -5.848
  283    H2*    U  27           H2*        U  27  -3.215 -11.486  -6.397
  284   2HO*    U  27          2HO*        U  27  -3.741 -11.193  -8.652
  285    H1*    U  27           H1*        U  27  -3.972  -8.911  -6.140
  286    H3     U  27           H3         U  27  -1.592 -10.236  -2.438
  287    H5     U  27           H5         U  27  -5.590 -11.181  -1.591
  288    H6     U  27           H6         U  27  -6.151 -10.648  -3.872
  289   1H5*    A  28          1H5*        A  28  -2.962 -12.672  -9.360
  290   2H5*    A  28          2H5*        A  28  -2.621 -14.367  -9.748
  291    H4*    A  28           H4*        A  28  -0.547 -13.091  -9.629
  292    H3*    A  28           H3*        A  28  -0.875 -15.080  -7.349
  293    H2*    A  28           H2*        A  28   1.372 -14.425  -6.725
  294   2HO*    A  28          2HO*        A  28   2.071 -14.243  -8.962
  295    H1*    A  28           H1*        A  28   0.937 -11.791  -6.902
  296    H8     A  28           H8         A  28  -2.397 -13.117  -5.786
  297   1H6     A  28          1H6         A  28  -0.035 -13.032  -0.053
  298   2H6     A  28          2H6         A  28  -1.496 -13.099  -1.009
  299    H2     A  28           H2         A  28   3.341 -12.683  -2.933
  300   1H5*    U  29          1H5*        U  29   2.931 -15.595  -9.083
  301   2H5*    U  29          2H5*        U  29   3.425 -17.291  -9.173
  302    H4*    U  29           H4*        U  29   5.053 -15.917  -7.921
  303    H3*    U  29           H3*        U  29   3.590 -17.986  -6.221
  304    H2*    U  29           H2*        U  29   5.159 -17.298  -4.484
  305   2HO*    U  29          2HO*        U  29   6.901 -16.965  -6.031
  306    H1*    U  29           H1*        U  29   4.705 -14.672  -4.810
  307    H3     U  29           H3         U  29   2.470 -16.294  -1.145
  308    H5     U  29           H5         U  29  -0.191 -16.772  -4.353
  309    H6     U  29           H6         U  29   1.572 -16.143  -5.849
  310   1H5*    C  30          1H5*        C  30   7.688 -18.313  -5.488
  311   2H5*    C  30          2H5*        C  30   8.231 -19.995  -5.441
  312    H4*    C  30           H4*        C  30   8.862 -18.769  -3.390
  313    H3*    C  30           H3*        C  30   6.819 -21.002  -2.973
  314    H2*    C  30           H2*        C  30   7.114 -20.527  -0.613
  315   2HO*    C  30          2HO*        C  30   9.429 -20.012  -0.994
  316    H1*    C  30           H1*        C  30   6.816 -17.865  -0.866
  317   1H4     C  30          1H4         C  30   0.949 -20.085  -0.117
  318   2H4     C  30          2H4         C  30   0.687 -20.022  -1.858
  319    H5     C  30           H5         C  30   2.503 -19.581  -3.437
  320    H6     C  30           H6         C  30   4.823 -19.016  -3.620
  321   1H5*    C  31          1H5*        C  31   9.749 -21.402  -0.071
  322   2H5*    C  31          2H5*        C  31  10.381 -23.054  -0.034
  323    H4*    C  31           H4*        C  31   9.670 -22.441   2.211
  324    H3*    C  31           H3*        C  31   7.777 -24.381   0.818
  325    H2*    C  31           H2*        C  31   6.686 -24.579   2.962
  326   2HO*    C  31          2HO*        C  31   8.754 -24.459   4.136
  327    H1*    C  31           H1*        C  31   6.646 -21.888   3.413
  328   1H4     C  31          1H4         C  31   1.175 -23.273   0.617
  329   2H4     C  31          2H4         C  31   1.874 -23.023  -0.978
  330    H5     C  31           H5         C  31   4.263 -22.604  -1.318
  331    H6     C  31           H6         C  31   6.376 -22.311  -0.211
  332    H3T    C  31           H3T        C  31   9.886 -25.155   1.188
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -4.205 -21.694   9.573
    2   2H5*    G   1          2H5*        G   1  -3.716 -22.636   8.172
    3    H4*    G   1           H4*        G   1  -2.302 -22.704  10.876
    4    H3*    G   1           H3*        G   1  -1.806 -21.062   8.393
    5    H2*    G   1           H2*        G   1   0.566 -21.290   8.809
    6   2HO*    G   1          2HO*        G   1   0.311 -21.176  11.128
    7    H1*    G   1           H1*        G   1   0.512 -23.924   9.115
    8    H8     G   1           H8         G   1  -2.369 -23.400   6.808
    9    H1     G   1           H1         G   1   3.352 -22.611   3.963
   10   1H2     G   1          1H2         G   1   4.905 -22.476   5.526
   11   2H2     G   1          2H2         G   1   4.473 -22.615   7.233
   12    H5T    G   1           H5T        G   1  -3.950 -24.532   9.521
   13   1H5*    G   2          1H5*        G   2   0.810 -19.522  11.237
   14   2H5*    G   2          2H5*        G   2   0.747 -17.754  11.260
   15    H4*    G   2           H4*        G   2   3.037 -18.557  10.962
   16    H3*    G   2           H3*        G   2   1.886 -17.096   8.571
   17    H2*    G   2           H2*        G   2   4.105 -17.326   7.606
   18   2HO*    G   2          2HO*        G   2   5.127 -16.995   9.674
   19    H1*    G   2           H1*        G   2   4.382 -19.915   8.149
   20    H8     G   2           H8         G   2   0.714 -19.675   7.533
   21    H1     G   2           H1         G   2   4.227 -19.067   2.174
   22   1H2     G   2          1H2         G   2   6.334 -18.699   2.730
   23   2H2     G   2          2H2         G   2   6.834 -18.745   4.434
   24   1H5*    A   3          1H5*        A   3   5.743 -15.510   9.374
   25   2H5*    A   3          2H5*        A   3   5.737 -13.747   9.298
   26    H4*    A   3           H4*        A   3   7.465 -14.696   7.844
   27    H3*    A   3           H3*        A   3   5.219 -13.246   6.415
   28    H2*    A   3           H2*        A   3   6.446 -13.656   4.387
   29   2HO*    A   3          2HO*        A   3   8.518 -13.336   5.518
   30    H1*    A   3           H1*        A   3   6.920 -16.237   4.828
   31    H8     A   3           H8         A   3   3.588 -15.786   6.455
   32   1H6     A   3          1H6         A   3   1.228 -16.229   0.744
   33   2H6     A   3          2H6         A   3   0.893 -16.204   2.483
   34    H2     A   3           H2         A   3   5.578 -15.590   0.344
   35   1H5*    U   4          1H5*        U   4   8.799 -11.897   4.728
   36   2H5*    U   4          2H5*        U   4   8.807 -10.150   4.496
   37    H4*    U   4           H4*        U   4   9.223 -11.341   2.391
   38    H3*    U   4           H3*        U   4   6.602  -9.821   2.484
   39    H2*    U   4           H2*        U   4   6.419 -10.433   0.136
   40   2HO*    U   4          2HO*        U   4   8.690 -10.182  -0.230
   41    H1*    U   4           H1*        U   4   7.041 -13.016   0.486
   42    H3     U   4           H3         U   4   2.541 -12.514  -0.277
   43    H5     U   4           H5         U   4   3.001 -12.268   3.882
   44    H6     U   4           H6         U   4   5.378 -12.164   3.587
   45   1H5*    A   5          1H5*        A   5   8.646  -8.790  -1.078
   46   2H5*    A   5          2H5*        A   5   8.514  -7.065  -1.421
   47    H4*    A   5           H4*        A   5   7.760  -8.419  -3.325
   48    H3*    A   5           H3*        A   5   5.593  -6.752  -1.993
   49    H2*    A   5           H2*        A   5   4.131  -7.560  -3.706
   50   2HO*    A   5          2HO*        A   5   5.769  -7.440  -5.347
   51    H1*    A   5           H1*        A   5   4.824 -10.135  -3.533
   52    H8     A   5           H8         A   5   5.136  -8.942   0.007
   53   1H6     A   5          1H6         A   5  -1.030  -9.614   0.253
   54   2H6     A   5          2H6         A   5   0.438  -9.331   1.205
   55    H2     A   5           H2         A   5   0.176  -9.809  -3.965
   56   1H5*    U   6          1H5*        U   6   5.259  -6.051  -6.207
   57   2H5*    U   6          2H5*        U   6   4.914  -4.333  -6.461
   58    H4*    U   6           H4*        U   6   3.187  -5.845  -7.410
   59    H3*    U   6           H3*        U   6   2.222  -3.983  -5.213
   60    H2*    U   6           H2*        U   6   0.050  -4.816  -5.780
   61   2HO*    U   6          2HO*        U   6   0.327  -4.860  -8.007
   62    H1*    U   6           H1*        U   6   0.726  -7.411  -5.841
   63    H3     U   6           H3         U   6  -1.686  -6.538  -2.065
   64    H5     U   6           H5         U   6   2.293  -5.758  -0.999
   65    H6     U   6           H6         U   6   2.932  -6.021  -3.303
   66   1H5*    A   7          1H5*        A   7  -1.558  -1.442  -7.921
   67   2H5*    A   7          2H5*        A   7  -1.340  -1.887  -6.233
   68    H4*    A   7           H4*        A   7  -2.641  -3.618  -8.377
   69    H3*    A   7           H3*        A   7  -3.665  -1.661  -6.441
   70    H2*    A   7           H2*        A   7  -4.997  -3.026  -5.160
   71   2HO*    A   7          2HO*        A   7  -6.120  -3.939  -6.913
   72    H1*    A   7           H1*        A   7  -3.703  -5.354  -5.212
   73    H8     A   7           H8         A   7  -0.709  -3.256  -4.796
   74   1H6     A   7          1H6         A   7  -2.535  -2.522   1.066
   75   2H6     A   7          2H6         A   7  -1.156  -2.414  -0.052
   76    H2     A   7           H2         A   7  -5.961  -4.052  -1.130
   77   1H5*    U   8          1H5*        U   8  -5.932   1.354  -6.703
   78   2H5*    U   8          2H5*        U   8  -5.131  -0.083  -6.098
   79    H4*    U   8           H4*        U   8  -8.146  -0.136  -6.361
   80    H3*    U   8           H3*        U   8  -6.561   1.408  -4.321
   81    H2*    U   8           H2*        U   8  -8.362   0.958  -2.726
   82   2HO*    U   8          2HO*        U   8  -9.934   0.484  -4.760
   83    H1*    U   8           H1*        U   8  -8.004  -1.664  -3.094
   84    H3     U   8           H3         U   8  -5.217   0.252   0.245
   85    H5     U   8           H5         U   8  -2.887  -0.586  -3.152
   86    H6     U   8           H6         U   8  -4.889  -1.072  -4.349
   87   1H5*    G   9          1H5*        G   9 -10.111   4.800  -3.809
   88   2H5*    G   9          2H5*        G   9  -8.664   3.927  -3.332
   89    H4*    G   9           H4*        G   9 -11.371   3.723  -1.934
   90    H3*    G   9           H3*        G   9  -8.884   5.352  -1.496
   91    H2*    G   9           H2*        G   9  -9.117   5.087   0.900
   92   2HO*    G   9          2HO*        G   9 -11.469   5.199   0.738
   93    H1*    G   9           H1*        G   9  -9.410   2.443   0.835
   94    H8     G   9           H8         G   9  -7.395   2.773  -2.234
   95    H1     G   9           H1         G   9  -3.957   4.096   3.055
   96   1H2     G   9          1H2         G   9  -5.298   4.389   4.765
   97   2H2     G   9          2H2         G   9  -7.049   4.150   4.559
   98   1H5*    A  10          1H5*        A  10 -11.416   6.745   1.626
   99   2H5*    A  10          2H5*        A  10 -11.492   8.510   1.492
  100    H4*    A  10           H4*        A  10 -10.766   7.827   3.729
  101    H3*    A  10           H3*        A  10  -8.595   9.090   2.053
  102    H2*    A  10           H2*        A  10  -7.333   9.244   4.109
  103   2HO*    A  10          2HO*        A  10  -9.207   9.443   5.575
  104    H1*    A  10           H1*        A  10  -7.645   6.693   4.586
  105    H8     A  10           H8         A  10  -7.835   6.692   0.861
  106   1H6     A  10          1H6         A  10  -1.653   7.194   0.962
  107   2H6     A  10          2H6         A  10  -3.074   6.903  -0.027
  108    H2     A  10           H2         A  10  -3.139   8.009   5.034
  109   1H5*    U  11          1H5*        U  11  -8.977  13.157   5.046
  110   2H5*    U  11          2H5*        U  11  -8.171  12.080   3.920
  111    H4*    U  11           H4*        U  11  -7.573  12.219   6.909
  112    H3*    U  11           H3*        U  11  -6.382  13.590   4.497
  113    H2*    U  11           H2*        U  11  -4.192  13.333   5.474
  114   2HO*    U  11          2HO*        U  11  -5.010  13.782   7.609
  115    H1*    U  11           H1*        U  11  -4.451  10.794   6.218
  116    H3     U  11           H3         U  11  -1.804  10.927   2.485
  117    H5     U  11           H5         U  11  -5.725  10.562   1.036
  118    H6     U  11           H6         U  11  -6.543  10.923   3.304
  119   1H5*    A  12          1H5*        A  12  -4.381  15.248   8.019
  120   2H5*    A  12          2H5*        A  12  -4.443  17.003   7.796
  121    H4*    A  12           H4*        A  12  -2.142  16.268   8.177
  122    H3*    A  12           H3*        A  12  -2.789  17.316   5.417
  123    H2*    A  12           H2*        A  12  -0.411  17.143   4.978
  124   2HO*    A  12          2HO*        A  12   0.107  17.857   7.154
  125    H1*    A  12           H1*        A  12  -0.057  14.783   6.090
  126    H8     A  12           H8         A  12  -3.415  14.812   4.346
  127   1H6     A  12          1H6         A  12  -0.148  13.178  -0.678
  128   2H6     A  12          2H6         A  12  -1.791  13.237  -0.006
  129    H2     A  12           H2         A  12   2.683  14.105   2.490
  130   1H5*    C  13          1H5*        C  13   0.742  19.206   7.066
  131   2H5*    C  13          2H5*        C  13   0.605  20.972   6.817
  132    H4*    C  13           H4*        C  13   2.780  20.288   5.949
  133    H3*    C  13           H3*        C  13   0.922  20.844   3.723
  134    H2*    C  13           H2*        C  13   2.966  20.519   2.446
  135   2HO*    C  13          2HO*        C  13   4.352  21.604   3.817
  136    H1*    C  13           H1*        C  13   3.772  18.273   3.705
  137   1H4     C  13          1H4         C  13   0.266  15.977  -1.004
  138   2H4     C  13          2H4         C  13  -1.226  16.387  -0.143
  139    H5     C  13           H5         C  13  -1.254  17.499   1.991
  140    H6     C  13           H6         C  13   0.071  18.507   3.666
  141   1H5*    A  14          1H5*        A  14   3.474  24.541   1.266
  142   2H5*    A  14          2H5*        A  14   2.645  23.013   0.960
  143    H4*    A  14           H4*        A  14   5.653  23.357   1.252
  144    H3*    A  14           H3*        A  14   3.704  22.941  -1.000
  145    H2*    A  14           H2*        A  14   5.270  21.614  -2.238
  146   2HO*    A  14          2HO*        A  14   7.243  22.729  -1.415
  147    H1*    A  14           H1*        A  14   5.729  20.051  -0.243
  148    H8     A  14           H8         A  14   2.267  20.942   0.803
  149   1H6     A  14          1H6         A  14   0.439  17.087  -3.724
  150   2H6     A  14          2H6         A  14  -0.078  18.021  -2.312
  151    H2     A  14           H2         A  14   4.732  17.752  -4.234
  152   1H5*    A  15          1H5*        A  15   7.475  25.475  -3.900
  153   2H5*    A  15          2H5*        A  15   5.929  24.640  -3.730
  154    H4*    A  15           H4*        A  15   8.548  23.230  -4.445
  155    H3*    A  15           H3*        A  15   7.472  24.942  -6.187
  156    H2*    A  15           H2*        A  15   5.197  24.307  -5.595
  157   2HO*    A  15          2HO*        A  15   5.897  23.158  -8.069
  158    H1*    A  15           H1*        A  15   6.036  21.511  -6.219
  159    H8     A  15           H8         A  15   4.384  23.174  -3.372
  160   1H6     A  15          1H6         A  15  -0.604  19.727  -4.917
  161   2H6     A  15          2H6         A  15  -0.056  20.967  -3.742
  162    H2     A  15           H2         A  15   2.717  18.653  -7.453
  163   1H5*    U  16          1H5*        U  16   7.315  22.805 -11.039
  164   2H5*    U  16          2H5*        U  16   5.944  23.656 -10.302
  165    H4*    U  16           H4*        U  16   5.114  21.938 -11.771
  166    H3*    U  16           H3*        U  16   4.583  21.704  -8.907
  167    H2*    U  16           H2*        U  16   4.240  19.372  -8.818
  168   2HO*    U  16          2HO*        U  16   2.775  19.492 -10.572
  169    H1*    U  16           H1*        U  16   5.909  18.448 -10.677
  170    H3     U  16           H3         U  16   9.887  18.180  -8.501
  171    H5     U  16           H5         U  16   7.282  19.951  -5.780
  172    H6     U  16           H6         U  16   5.708  20.353  -7.583
  173   1H5*    U  17          1H5*        U  17   0.950  19.412 -10.994
  174   2H5*    U  17          2H5*        U  17  -0.271  19.743  -9.769
  175    H4*    U  17           H4*        U  17   1.950  17.682  -9.333
  176    H3*    U  17           H3*        U  17  -0.155  17.322 -11.213
  177    H2*    U  17           H2*        U  17  -1.826  16.187 -10.015
  178   2HO*    U  17          2HO*        U  17  -0.424  14.432  -9.711
  179    H1*    U  17           H1*        U  17  -1.272  16.677  -7.381
  180    H3     U  17           H3         U  17  -3.490  20.735  -6.863
  181    H5     U  17           H5         U  17  -3.558  20.000 -10.978
  182    H6     U  17           H6         U  17  -2.135  18.126 -10.649
  183   1H5*    U  18          1H5*        U  18   1.734  12.159 -10.188
  184   2H5*    U  18          2H5*        U  18   1.801  13.715  -9.397
  185    H4*    U  18           H4*        U  18   4.298  12.592 -10.683
  186    H3*    U  18           H3*        U  18   2.957  11.452  -8.398
  187    H2*    U  18           H2*        U  18   4.230  12.263  -6.588
  188   2HO*    U  18          2HO*        U  18   6.197  11.494  -7.480
  189    H1*    U  18           H1*        U  18   5.159  14.620  -7.496
  190    H3     U  18           H3         U  18   1.966  17.319  -5.861
  191    H5     U  18           H5         U  18   0.050  13.614  -6.190
  192    H6     U  18           H6         U  18   1.942  12.756  -7.299
  193   1H5*    G  19          1H5*        G  19   5.905   8.261  -5.740
  194   2H5*    G  19          2H5*        G  19   4.648   9.464  -5.479
  195    H4*    G  19           H4*        G  19   7.643   9.913  -5.120
  196    H3*    G  19           H3*        G  19   5.351   9.401  -3.230
  197    H2*    G  19           H2*        G  19   6.266  10.990  -1.660
  198   2HO*    G  19          2HO*        G  19   8.472  10.270  -2.172
  199    H1*    G  19           H1*        G  19   6.765  12.919  -3.458
  200    H8     G  19           H8         G  19   3.757  10.782  -4.349
  201    H1     G  19           H1         G  19   2.501  15.980  -0.828
  202   1H2     G  19          1H2         G  19   4.412  16.950  -0.212
  203   2H2     G  19          2H2         G  19   5.949  16.229  -0.711
  204   1H5*    A  20          1H5*        A  20   8.329   9.509  -0.390
  205   2H5*    A  20          2H5*        A  20   8.295   7.963   0.485
  206    H4*    A  20           H4*        A  20   8.061   9.823   2.057
  207    H3*    A  20           H3*        A  20   5.542   8.241   1.604
  208    H2*    A  20           H2*        A  20   4.598   9.431   3.490
  209   2HO*    A  20          2HO*        A  20   6.646   9.762   4.664
  210    H1*    A  20           H1*        A  20   5.190  11.762   2.432
  211    H8     A  20           H8         A  20   4.868   9.850  -0.730
  212   1H6     A  20          1H6         A  20  -1.253   9.970   0.102
  213   2H6     A  20          2H6         A  20   0.063   9.597  -1.027
  214    H2     A  20           H2         A  20   0.607  11.129   3.906
  215   1H5*    U  21          1H5*        U  21   6.099   6.288   6.262
  216   2H5*    U  21          2H5*        U  21   5.257   6.669   4.780
  217    H4*    U  21           H4*        U  21   4.856   8.088   7.463
  218    H3*    U  21           H3*        U  21   3.300   6.088   5.828
  219    H2*    U  21           H2*        U  21   1.278   6.928   6.792
  220   2HO*    U  21          2HO*        U  21   2.370   7.699   8.877
  221    H1*    U  21           H1*        U  21   1.886   9.424   6.116
  222    H3     U  21           H3         U  21  -1.031   7.532   3.131
  223    H5     U  21           H5         U  21   2.794   6.828   1.555
  224    H6     U  21           H6         U  21   3.757   7.617   3.643
  225   1H5*    C  22          1H5*        C  22   1.397   3.965   9.869
  226   2H5*    C  22          2H5*        C  22   1.498   4.369   8.169
  227    H4*    C  22           H4*        C  22  -0.550   5.543  10.105
  228    H3*    C  22           H3*        C  22  -0.629   3.187   8.219
  229    H2*    C  22           H2*        C  22  -2.950   3.721   7.776
  230   2HO*    C  22          2HO*        C  22  -3.352   4.359   9.970
  231    H1*    C  22           H1*        C  22  -2.545   6.325   7.329
  232   1H4     C  22          1H4         C  22  -1.640   3.588   1.741
  233   2H4     C  22          2H4         C  22   0.122   3.605   1.972
  234    H5     C  22           H5         C  22   1.137   4.283   4.126
  235    H6     C  22           H6         C  22   0.638   5.051   6.356
  236   1H5*    A  23          1H5*        A  23  -4.200   2.604  10.682
  237   2H5*    A  23          2H5*        A  23  -4.300   0.866  11.032
  238    H4*    A  23           H4*        A  23  -6.345   1.739   9.960
  239    H3*    A  23           H3*        A  23  -4.784  -0.178   8.242
  240    H2*    A  23           H2*        A  23  -6.784  -0.136   6.812
  241   2HO*    A  23          2HO*        A  23  -8.276   0.435   8.736
  242    H1*    A  23           H1*        A  23  -6.667   2.461   6.612
  243    H8     A  23           H8         A  23  -3.053   1.837   7.236
  244   1H6     A  23          1H6         A  23  -2.805   0.224   1.249
  245   2H6     A  23          2H6         A  23  -1.865   0.680   2.689
  246    H2     A  23           H2         A  23  -7.019   0.103   2.509
  247   1H5*    G  24          1H5*        G  24  -8.794  -0.919   7.001
  248   2H5*    G  24          2H5*        G  24  -9.741  -2.096   7.906
  249    H4*    G  24           H4*        G  24  -9.876  -2.675   5.617
  250    H3*    G  24           H3*        G  24  -8.874  -4.403   7.526
  251    H2*    G  24           H2*        G  24  -6.721  -4.509   6.947
  252   2HO*    G  24          2HO*        G  24  -7.881  -6.530   5.974
  253    H1*    G  24           H1*        G  24  -7.116  -4.071   4.015
  254    H8     G  24           H8         G  24  -5.893  -2.022   6.929
  255    H1     G  24           H1         G  24  -1.255  -3.918   2.899
  256   1H2     G  24          1H2         G  24  -2.153  -5.238   1.360
  257   2H2     G  24          2H2         G  24  -3.870  -5.539   1.313
  258   1H5*    U  25          1H5*        U  25 -12.195  -5.320   4.688
  259   2H5*    U  25          2H5*        U  25 -12.986  -6.876   4.377
  260    H4*    U  25           H4*        U  25 -12.628  -5.552   2.296
  261    H3*    U  25           H3*        U  25 -11.338  -8.213   2.636
  262    H2*    U  25           H2*        U  25 -10.095  -7.918   0.598
  263   2HO*    U  25          2HO*        U  25 -11.867  -7.160  -0.601
  264    H1*    U  25           H1*        U  25  -9.515  -5.297   0.805
  265    H3     U  25           H3         U  25  -5.447  -5.770   2.613
  266    H5     U  25           H5         U  25  -7.365  -9.286   3.765
  267    H6     U  25           H6         U  25  -9.429  -8.378   2.920
  268   1H5*    A  26          1H5*        A  26 -11.378 -10.905  -1.109
  269   2H5*    A  26          2H5*        A  26 -10.383  -9.852  -0.120
  270    H4*    A  26           H4*        A  26 -11.095  -9.228  -3.011
  271    H3*    A  26           H3*        A  26  -8.720 -10.737  -1.873
  272    H2*    A  26           H2*        A  26  -7.445  -9.798  -3.707
  273   2HO*    A  26          2HO*        A  26  -9.236  -9.917  -5.220
  274    H1*    A  26           H1*        A  26  -8.251  -7.287  -3.265
  275    H8     A  26           H8         A  26  -8.321  -9.123   0.018
  276   1H6     A  26          1H6         A  26  -2.277  -7.634   0.365
  277   2H6     A  26          2H6         A  26  -3.650  -8.310   1.268
  278    H2     A  26           H2         A  26  -3.664  -6.723  -3.682
  279   1H5*    U  27          1H5*        U  27  -8.632 -11.292  -5.983
  280   2H5*    U  27          2H5*        U  27  -8.206 -12.960  -6.397
  281    H4*    U  27           H4*        U  27  -6.645 -11.354  -7.418
  282    H3*    U  27           H3*        U  27  -5.399 -13.145  -5.288
  283    H2*    U  27           H2*        U  27  -3.328 -12.141  -5.964
  284   2HO*    U  27          2HO*        U  27  -3.879 -12.107  -8.201
  285    H1*    U  27           H1*        U  27  -4.196  -9.619  -5.917
  286    H3     U  27           H3         U  27  -1.605 -10.424  -2.229
  287    H5     U  27           H5         U  27  -5.471 -11.576  -1.093
  288    H6     U  27           H6         U  27  -6.172 -11.313  -3.376
  289   1H5*    A  28          1H5*        A  28  -3.224 -13.584  -8.981
  290   2H5*    A  28          2H5*        A  28  -2.767 -15.277  -9.232
  291    H4*    A  28           H4*        A  28  -0.822 -13.822  -9.391
  292    H3*    A  28           H3*        A  28  -0.760 -15.651  -6.966
  293    H2*    A  28           H2*        A  28   1.419 -14.740  -6.565
  294   2HO*    A  28          2HO*        A  28   1.877 -14.646  -8.897
  295    H1*    A  28           H1*        A  28   0.726 -12.181  -6.831
  296    H8     A  28           H8         A  28  -2.405 -13.742  -5.466
  297   1H6     A  28          1H6         A  28   0.249 -13.213   0.077
  298   2H6     A  28          2H6         A  28  -1.247 -13.490  -0.822
  299    H2     A  28           H2         A  28   3.404 -12.572  -2.962
  300   1H5*    U  29          1H5*        U  29   2.927 -15.906  -8.904
  301   2H5*    U  29          2H5*        U  29   3.552 -17.554  -8.939
  302    H4*    U  29           H4*        U  29   5.127 -16.001  -7.875
  303    H3*    U  29           H3*        U  29   3.986 -18.077  -5.952
  304    H2*    U  29           H2*        U  29   5.618 -17.149  -4.411
  305   2HO*    U  29          2HO*        U  29   7.179 -16.788  -6.115
  306    H1*    U  29           H1*        U  29   4.932 -14.601  -4.831
  307    H3     U  29           H3         U  29   3.133 -16.025  -0.867
  308    H5     U  29           H5         U  29   0.233 -16.908  -3.759
  309    H6     U  29           H6         U  29   1.813 -16.358  -5.477
  310   1H5*    C  30          1H5*        C  30   8.133 -18.062  -5.594
  311   2H5*    C  30          2H5*        C  30   8.795 -19.694  -5.460
  312    H4*    C  30           H4*        C  30   9.476 -18.283  -3.573
  313    H3*    C  30           H3*        C  30   7.631 -20.583  -2.788
  314    H2*    C  30           H2*        C  30   8.118 -19.881  -0.528
  315   2HO*    C  30          2HO*        C  30  10.340 -19.276  -1.198
  316    H1*    C  30           H1*        C  30   7.622 -17.285  -0.956
  317   1H4     C  30          1H4         C  30   2.033 -19.625   0.617
  318   2H4     C  30          2H4         C  30   1.558 -19.770  -1.091
  319    H5     C  30           H5         C  30   3.170 -19.483  -2.888
  320    H6     C  30           H6         C  30   5.430 -18.854  -3.390
  321   1H5*    C  31          1H5*        C  31  10.832 -20.584  -0.169
  322   2H5*    C  31          2H5*        C  31  11.546 -22.197  -0.079
  323    H4*    C  31           H4*        C  31  11.013 -21.454   2.166
  324    H3*    C  31           H3*        C  31   9.109 -23.583   1.119
  325    H2*    C  31           H2*        C  31   8.236 -23.674   3.345
  326   2HO*    C  31          2HO*        C  31  10.400 -23.374   4.301
  327    H1*    C  31           H1*        C  31   8.080 -20.974   3.629
  328   1H4     C  31          1H4         C  31   2.457 -22.726   1.558
  329   2H4     C  31          2H4         C  31   2.961 -22.543  -0.135
  330    H5     C  31           H5         C  31   5.264 -22.124  -0.775
  331    H6     C  31           H6         C  31   7.469 -21.682   0.063
  332    H3T    C  31           H3T        C  31  11.274 -24.236   1.315
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  -8.071 -24.580   6.569
    2   2H5*    G   1          2H5*        G   1  -7.803 -22.955   7.240
    3    H4*    G   1           H4*        G   1  -6.157 -24.441   8.190
    4    H3*    G   1           H3*        G   1  -5.017 -22.578   6.087
    5    H2*    G   1           H2*        G   1  -2.844 -23.414   6.734
    6   2HO*    G   1          2HO*        G   1  -3.379 -23.586   8.998
    7    H1*    G   1           H1*        G   1  -3.558 -25.989   6.586
    8    H8     G   1           H8         G   1  -5.788 -24.586   3.974
    9    H1     G   1           H1         G   1   0.390 -24.494   2.236
   10   1H2     G   1          1H2         G   1   1.657 -24.880   4.015
   11   2H2     G   1          2H2         G   1   0.950 -25.181   5.589
   12    H5T    G   1           H5T        G   1  -6.746 -22.380   5.325
   13   1H5*    G   2          1H5*        G   2  -2.634 -22.061   9.486
   14   2H5*    G   2          2H5*        G   2  -2.368 -20.341   9.816
   15    H4*    G   2           H4*        G   2  -0.246 -21.566   9.700
   16    H3*    G   2           H3*        G   2  -0.713 -19.572   7.472
   17    H2*    G   2           H2*        G   2   1.574 -20.080   6.788
   18   2HO*    G   2          2HO*        G   2   2.307 -20.281   9.004
   19    H1*    G   2           H1*        G   2   1.282 -22.741   6.912
   20    H8     G   2           H8         G   2  -2.133 -21.722   5.850
   21    H1     G   2           H1         G   2   2.247 -20.917   1.220
   22   1H2     G   2          1H2         G   2   4.280 -21.020   2.092
   23   2H2     G   2          2H2         G   2   4.521 -21.379   3.794
   24   1H5*    A   3          1H5*        A   3   3.185 -18.945   9.053
   25   2H5*    A   3          2H5*        A   3   3.527 -17.230   9.313
   26    H4*    A   3           H4*        A   3   5.271 -18.296   7.946
   27    H3*    A   3           H3*        A   3   3.588 -16.205   6.528
   28    H2*    A   3           H2*        A   3   5.063 -16.535   4.636
   29   2HO*    A   3          2HO*        A   3   6.944 -16.836   6.042
   30    H1*    A   3           H1*        A   3   4.958 -19.209   4.669
   31    H8     A   3           H8         A   3   1.543 -18.330   5.894
   32   1H6     A   3          1H6         A   3   0.055 -17.364  -0.028
   33   2H6     A   3          2H6         A   3  -0.548 -17.545   1.619
   34    H2     A   3           H2         A   3   4.485 -17.578   0.247
   35   1H5*    U   4          1H5*        U   4   7.601 -15.440   5.642
   36   2H5*    U   4          2H5*        U   4   8.003 -13.723   5.729
   37    H4*    U   4           H4*        U   4   8.546 -14.681   3.517
   38    H3*    U   4           H3*        U   4   6.305 -12.626   3.520
   39    H2*    U   4           H2*        U   4   6.425 -12.816   1.092
   40   2HO*    U   4          2HO*        U   4   8.768 -13.074   1.139
   41    H1*    U   4           H1*        U   4   6.450 -15.518   1.072
   42    H3     U   4           H3         U   4   2.344 -13.924  -0.225
   43    H5     U   4           H5         U   4   2.112 -14.370   3.940
   44    H6     U   4           H6         U   4   4.482 -14.763   3.996
   45   1H5*    A   5          1H5*        A   5   9.070 -11.601   0.542
   46   2H5*    A   5          2H5*        A   5   9.359  -9.863   0.456
   47    H4*    A   5           H4*        A   5   8.667 -10.771  -1.714
   48    H3*    A   5           H3*        A   5   6.629  -8.881  -0.459
   49    H2*    A   5           H2*        A   5   5.455  -9.085  -2.555
   50   2HO*    A   5          2HO*        A   5   7.416  -9.160  -3.826
   51    H1*    A   5           H1*        A   5   5.583 -11.767  -2.642
   52    H8     A   5           H8         A   5   5.427 -11.121   1.038
   53   1H6     A   5          1H6         A   5  -0.670 -10.370   0.250
   54   2H6     A   5          2H6         A   5   0.619 -10.589   1.431
   55    H2     A   5           H2         A   5   1.239 -10.229  -3.742
   56   1H5*    U   6          1H5*        U   6   7.322  -7.656  -4.433
   57   2H5*    U   6          2H5*        U   6   7.436  -5.892  -4.515
   58    H4*    U   6           H4*        U   6   5.687  -6.825  -6.026
   59    H3*    U   6           H3*        U   6   4.759  -5.007  -3.776
   60    H2*    U   6           H2*        U   6   2.586  -5.154  -4.783
   61   2HO*    U   6          2HO*        U   6   3.266  -5.014  -6.940
   62    H1*    U   6           H1*        U   6   2.652  -7.831  -5.223
   63    H3     U   6           H3         U   6  -0.284  -6.892  -1.863
   64    H5     U   6           H5         U   6   3.441  -7.323   0.027
   65    H6     U   6           H6         U   6   4.493  -7.405  -2.132
   66   1H5*    A   7          1H5*        A   7   2.346  -1.242  -6.402
   67   2H5*    A   7          2H5*        A   7   2.168  -2.097  -4.871
   68    H4*    A   7           H4*        A   7   0.874  -2.916  -7.507
   69    H3*    A   7           H3*        A   7   0.054  -1.194  -5.230
   70    H2*    A   7           H2*        A   7  -1.940  -2.351  -4.721
   71   2HO*    A   7          2HO*        A   7  -2.392  -2.526  -7.087
   72    H1*    A   7           H1*        A   7  -1.124  -4.891  -5.050
   73    H8     A   7           H8         A   7   2.028  -3.663  -3.582
   74   1H6     A   7          1H6         A   7  -0.974  -3.268   1.847
   75   2H6     A   7          2H6         A   7   0.596  -3.305   1.052
   76    H2     A   7           H2         A   7  -4.001  -3.811  -1.371
   77   1H5*    U   8          1H5*        U   8  -3.706  -1.464  -6.617
   78   2H5*    U   8          2H5*        U   8  -4.275   0.173  -6.958
   79    H4*    U   8           H4*        U   8  -5.711  -0.927  -5.299
   80    H3*    U   8           H3*        U   8  -3.955   1.266  -4.184
   81    H2*    U   8           H2*        U   8  -5.403   1.171  -2.237
   82   2HO*    U   8          2HO*        U   8  -7.383   0.556  -3.376
   83    H1*    U   8           H1*        U   8  -5.116  -1.494  -2.088
   84    H3     U   8           H3         U   8  -2.492   0.763   0.985
   85    H5     U   8           H5         U   8  -0.046  -0.145  -2.324
   86    H6     U   8           H6         U   8  -2.032  -0.694  -3.565
   87   1H5*    G   9          1H5*        G   9  -8.062   4.180  -4.156
   88   2H5*    G   9          2H5*        G   9  -6.539   3.637  -3.466
   89    H4*    G   9           H4*        G   9  -9.258   3.450  -2.097
   90    H3*    G   9           H3*        G   9  -6.978   5.425  -1.934
   91    H2*    G   9           H2*        G   9  -7.307   5.566   0.468
   92   2HO*    G   9          2HO*        G   9  -9.668   5.366   0.198
   93    H1*    G   9           H1*        G   9  -7.367   2.939   0.896
   94    H8     G   9           H8         G   9  -5.132   3.052  -2.108
   95    H1     G   9           H1         G   9  -2.282   5.248   3.205
   96   1H2     G   9          1H2         G   9  -3.804   5.652   4.770
   97   2H2     G   9          2H2         G   9  -5.487   5.266   4.502
   98   1H5*    A  10          1H5*        A  10  -9.948   6.964   0.721
   99   2H5*    A  10          2H5*        A  10 -10.109   8.711   0.477
  100    H4*    A  10           H4*        A  10  -9.592   8.080   2.830
  101    H3*    A  10           H3*        A  10  -7.547   9.799   1.379
  102    H2*    A  10           H2*        A  10  -6.414   9.912   3.505
  103   2HO*    A  10          2HO*        A  10  -8.406  10.004   4.736
  104    H1*    A  10           H1*        A  10  -6.513   7.283   4.017
  105    H8     A  10           H8         A  10  -6.277   7.304   0.297
  106   1H6     A  10          1H6         A  10  -0.215   8.333   0.972
  107   2H6     A  10          2H6         A  10  -1.499   7.934  -0.153
  108    H2     A  10           H2         A  10  -2.142   8.985   4.909
  109   1H5*    U  11          1H5*        U  11  -8.378  11.495   5.179
  110   2H5*    U  11          2H5*        U  11  -8.405  13.258   5.097
  111    H4*    U  11           H4*        U  11  -6.695  12.370   6.692
  112    H3*    U  11           H3*        U  11  -5.597  13.760   4.243
  113    H2*    U  11           H2*        U  11  -3.503  13.806   5.495
  114   2HO*    U  11          2HO*        U  11  -4.456  13.947   7.657
  115    H1*    U  11           H1*        U  11  -3.682  11.199   5.987
  116    H3     U  11           H3         U  11  -0.696  11.886   2.594
  117    H5     U  11           H5         U  11  -4.432  11.404   0.725
  118    H6     U  11           H6         U  11  -5.484  11.512   2.877
  119   1H5*    A  12          1H5*        A  12  -4.634  17.641   7.636
  120   2H5*    A  12          2H5*        A  12  -4.273  16.736   6.158
  121    H4*    A  12           H4*        A  12  -2.566  16.757   8.690
  122    H3*    A  12           H3*        A  12  -2.499  18.225   6.066
  123    H2*    A  12           H2*        A  12  -0.105  17.923   5.911
  124   2HO*    A  12          2HO*        A  12   0.051  18.301   8.282
  125    H1*    A  12           H1*        A  12  -0.012  15.411   6.683
  126    H8     A  12           H8         A  12  -3.217  15.585   4.758
  127   1H6     A  12          1H6         A  12   0.275  14.482  -0.259
  128   2H6     A  12          2H6         A  12  -1.368  14.502   0.374
  129    H2     A  12           H2         A  12   2.973  15.431   3.120
  130   1H5*    C  13          1H5*        C  13   0.877  19.760   7.846
  131   2H5*    C  13          2H5*        C  13   0.846  21.555   7.804
  132    H4*    C  13           H4*        C  13   2.845  20.784   6.661
  133    H3*    C  13           H3*        C  13   0.694  21.828   4.806
  134    H2*    C  13           H2*        C  13   2.195  21.370   2.993
  135   2HO*    C  13          2HO*        C  13   4.042  22.186   4.159
  136    H1*    C  13           H1*        C  13   3.129  18.989   3.867
  137   1H4     C  13          1H4         C  13  -1.589  17.516  -0.067
  138   2H4     C  13          2H4         C  13  -2.780  17.749   1.200
  139    H5     C  13           H5         C  13  -2.188  18.635   3.404
  140    H6     C  13           H6         C  13  -0.388  19.463   4.723
  141   1H5*    A  14          1H5*        A  14   4.106  23.673   3.029
  142   2H5*    A  14          2H5*        A  14   3.599  25.260   2.423
  143    H4*    A  14           H4*        A  14   4.265  23.637   0.622
  144    H3*    A  14           H3*        A  14   1.353  24.442   0.602
  145    H2*    A  14           H2*        A  14   1.289  23.312  -1.575
  146   2HO*    A  14          2HO*        A  14   3.581  23.643  -2.157
  147    H1*    A  14           H1*        A  14   2.188  21.109  -0.525
  148    H8     A  14           H8         A  14   0.619  22.501   2.557
  149   1H6     A  14          1H6         A  14  -4.863  21.013   0.150
  150   2H6     A  14          2H6         A  14  -4.001  21.549   1.595
  151    H2     A  14           H2         A  14  -1.830  20.652  -3.063
  152   1H5*    A  15          1H5*        A  15   4.147  26.257  -4.151
  153   2H5*    A  15          2H5*        A  15   2.534  25.870  -3.509
  154    H4*    A  15           H4*        A  15   4.400  23.732  -4.596
  155    H3*    A  15           H3*        A  15   3.448  25.647  -6.224
  156    H2*    A  15           H2*        A  15   1.231  25.597  -5.639
  157   2HO*    A  15          2HO*        A  15   1.618  23.768  -7.804
  158    H1*    A  15           H1*        A  15   1.259  22.640  -5.676
  159    H8     A  15           H8         A  15   0.772  24.886  -2.719
  160   1H6     A  15          1H6         A  15  -5.281  23.613  -3.104
  161   2H6     A  15          2H6         A  15  -4.055  24.469  -2.175
  162    H2     A  15           H2         A  15  -3.210  21.698  -6.509
  163   1H5*    U  16          1H5*        U  16   2.326  19.692  -7.122
  164   2H5*    U  16          2H5*        U  16   3.331  19.940  -8.516
  165    H4*    U  16           H4*        U  16   1.716  19.658  -9.931
  166    H3*    U  16           H3*        U  16   0.459  21.878  -8.806
  167    H2*    U  16           H2*        U  16  -1.242  21.077  -7.517
  168   2HO*    U  16          2HO*        U  16  -1.889  19.726  -9.873
  169    H1*    U  16           H1*        U  16  -1.281  18.302  -7.782
  170    H3     U  16           H3         U  16   0.744  17.176  -3.834
  171    H5     U  16           H5         U  16   1.328  21.327  -4.247
  172    H6     U  16           H6         U  16   0.330  21.238  -6.324
  173   1H5*    U  17          1H5*        U  17   2.228  19.309 -13.615
  174   2H5*    U  17          2H5*        U  17   0.568  19.190 -13.050
  175    H4*    U  17           H4*        U  17   2.846  18.306 -11.269
  176    H3*    U  17           H3*        U  17   2.456  17.075 -13.784
  177    H2*    U  17           H2*        U  17   0.849  15.410 -13.437
  178   2HO*    U  17          2HO*        U  17   2.334  14.289 -12.128
  179    H1*    U  17           H1*        U  17  -0.294  15.963 -11.019
  180    H3     U  17           H3         U  17  -3.693  18.825 -12.389
  181    H5     U  17           H5         U  17  -1.477  17.966 -15.837
  182    H6     U  17           H6         U  17   0.173  16.920 -14.481
  183   1H5*    U  18          1H5*        U  18   4.706  12.761 -10.964
  184   2H5*    U  18          2H5*        U  18   3.745  14.154 -10.482
  185    H4*    U  18           H4*        U  18   6.654  14.027  -9.696
  186    H3*    U  18           H3*        U  18   4.630  12.182  -8.753
  187    H2*    U  18           H2*        U  18   4.132  13.024  -6.607
  188   2HO*    U  18          2HO*        U  18   6.391  13.128  -5.999
  189    H1*    U  18           H1*        U  18   4.441  15.677  -6.948
  190    H3     U  18           H3         U  18   0.404  16.841  -8.542
  191    H5     U  18           H5         U  18   0.547  12.686  -9.094
  192    H6     U  18           H6         U  18   2.814  12.748  -8.498
  193   1H5*    G  19          1H5*        G  19   8.675  12.478  -6.307
  194   2H5*    G  19          2H5*        G  19   8.911  10.915  -5.499
  195    H4*    G  19           H4*        G  19   9.524  12.825  -4.058
  196    H3*    G  19           H3*        G  19   7.168  11.155  -3.092
  197    H2*    G  19           H2*        G  19   7.211  12.538  -1.125
  198   2HO*    G  19          2HO*        G  19   9.580  12.579  -1.138
  199    H1*    G  19           H1*        G  19   7.464  14.877  -2.435
  200    H8     G  19           H8         G  19   5.315  12.304  -4.254
  201    H1     G  19           H1         G  19   2.215  16.272  -0.282
  202   1H2     G  19          1H2         G  19   3.698  17.570   0.763
  203   2H2     G  19          2H2         G  19   5.417  17.324   0.536
  204   1H5*    A  20          1H5*        A  20   9.835  11.692   0.285
  205   2H5*    A  20          2H5*        A  20  10.074  10.084   0.988
  206    H4*    A  20           H4*        A  20   9.356  11.692   2.690
  207    H3*    A  20           H3*        A  20   7.363   9.466   2.069
  208    H2*    A  20           H2*        A  20   6.070  10.317   3.856
  209   2HO*    A  20          2HO*        A  20   7.854  10.732   5.249
  210    H1*    A  20           H1*        A  20   6.269  12.922   3.186
  211    H8     A  20           H8         A  20   6.252  11.158  -0.134
  212   1H6     A  20          1H6         A  20   0.079  11.194   0.316
  213   2H6     A  20          2H6         A  20   1.462  10.912  -0.739
  214    H2     A  20           H2         A  20   1.710  12.194   4.310
  215   1H5*    U  21          1H5*        U  21   7.043   7.154   6.752
  216   2H5*    U  21          2H5*        U  21   6.041   7.386   5.317
  217    H4*    U  21           H4*        U  21   6.145   9.227   7.743
  218    H3*    U  21           H3*        U  21   4.346   7.098   6.633
  219    H2*    U  21           H2*        U  21   2.376   8.321   7.259
  220   2HO*    U  21          2HO*        U  21   3.414   9.098   9.257
  221    H1*    U  21           H1*        U  21   3.175  10.661   6.249
  222    H3     U  21           H3         U  21   0.279   8.491   3.379
  223    H5     U  21           H5         U  21   4.167   7.744   1.978
  224    H6     U  21           H6         U  21   5.056   8.643   4.025
  225   1H5*    C  22          1H5*        C  22   2.372   7.744  10.176
  226   2H5*    C  22          2H5*        C  22   2.062   6.204  11.004
  227    H4*    C  22           H4*        C  22  -0.034   7.410  10.475
  228    H3*    C  22           H3*        C  22   0.395   4.769   9.022
  229    H2*    C  22           H2*        C  22  -1.815   5.085   8.127
  230   2HO*    C  22          2HO*        C  22  -2.614   5.944  10.157
  231    H1*    C  22           H1*        C  22  -1.532   7.693   7.513
  232   1H4     C  22          1H4         C  22   0.063   4.543   2.282
  233   2H4     C  22          2H4         C  22   1.756   4.555   2.754
  234    H5     C  22           H5         C  22   2.514   5.409   4.939
  235    H6     C  22           H6         C  22   1.769   6.386   7.006
  236   1H5*    A  23          1H5*        A  23  -3.589   4.775  10.778
  237   2H5*    A  23          2H5*        A  23  -3.875   3.180  11.497
  238    H4*    A  23           H4*        A  23  -5.653   3.804   9.890
  239    H3*    A  23           H3*        A  23  -3.896   1.452   9.168
  240    H2*    A  23           H2*        A  23  -5.382   1.137   7.270
  241   2HO*    A  23          2HO*        A  23  -7.305   1.643   8.407
  242    H1*    A  23           H1*        A  23  -5.428   3.730   6.537
  243    H8     A  23           H8         A  23  -1.964   3.155   7.853
  244   1H6     A  23          1H6         A  23  -0.608   0.972   2.213
  245   2H6     A  23          2H6         A  23   0.032   1.495   3.767
  246    H2     A  23           H2         A  23  -5.025   1.296   2.533
  247   1H5*    G  24          1H5*        G  24  -8.269   0.527   9.001
  248   2H5*    G  24          2H5*        G  24  -8.524  -1.171   9.436
  249    H4*    G  24           H4*        G  24  -9.495  -0.537   7.203
  250    H3*    G  24           H3*        G  24  -7.333  -2.654   7.286
  251    H2*    G  24           H2*        G  24  -7.758  -2.958   4.919
  252   2HO*    G  24          2HO*        G  24 -10.032  -2.733   5.038
  253    H1*    G  24           H1*        G  24  -7.779  -0.315   4.340
  254    H8     G  24           H8         G  24  -5.129  -0.742   6.994
  255    H1     G  24           H1         G  24  -3.379  -2.742   1.163
  256   1H2     G  24          1H2         G  24  -5.185  -2.778  -0.168
  257   2H2     G  24          2H2         G  24  -6.731  -2.217   0.389
  258   1H5*    U  25          1H5*        U  25 -10.254  -6.537   4.874
  259   2H5*    U  25          2H5*        U  25  -8.520  -6.190   4.850
  260    H4*    U  25           H4*        U  25 -10.586  -5.082   2.892
  261    H3*    U  25           H3*        U  25  -8.565  -7.317   2.792
  262    H2*    U  25           H2*        U  25  -8.052  -6.771   0.517
  263   2HO*    U  25          2HO*        U  25 -10.210  -6.340  -0.130
  264    H1*    U  25           H1*        U  25  -7.872  -4.112   0.866
  265    H3     U  25           H3         U  25  -3.676  -6.005   0.592
  266    H5     U  25           H5         U  25  -4.657  -6.036   4.661
  267    H6     U  25           H6         U  25  -6.872  -5.255   4.088
  268   1H5*    A  26          1H5*        A  26 -10.231 -10.066  -1.452
  269   2H5*    A  26          2H5*        A  26  -8.659  -9.641  -0.780
  270    H4*    A  26           H4*        A  26 -10.109  -8.232  -3.060
  271    H3*    A  26           H3*        A  26  -7.758 -10.074  -2.742
  272    H2*    A  26           H2*        A  26  -6.425  -8.849  -4.289
  273   2HO*    A  26          2HO*        A  26  -8.334  -8.480  -5.699
  274    H1*    A  26           H1*        A  26  -6.985  -6.399  -3.373
  275    H8     A  26           H8         A  26  -7.186  -8.449  -0.260
  276   1H6     A  26          1H6         A  26  -1.026  -7.952   0.016
  277   2H6     A  26          2H6         A  26  -2.486  -8.429   0.868
  278    H2     A  26           H2         A  26  -2.322  -6.710  -4.059
  279   1H5*    U  27          1H5*        U  27  -7.568  -9.740  -6.714
  280   2H5*    U  27          2H5*        U  27  -7.435 -11.318  -7.504
  281    H4*    U  27           H4*        U  27  -5.496  -9.952  -8.049
  282    H3*    U  27           H3*        U  27  -4.831 -12.251  -6.173
  283    H2*    U  27           H2*        U  27  -2.530 -11.600  -6.541
  284   2HO*    U  27          2HO*        U  27  -2.888 -11.080  -8.787
  285    H1*    U  27           H1*        U  27  -2.956  -8.973  -6.128
  286    H3     U  27           H3         U  27  -0.961 -10.807  -2.417
  287    H5     U  27           H5         U  27  -5.086 -11.377  -1.866
  288    H6     U  27           H6         U  27  -5.447 -10.617  -4.114
  289   1H5*    A  28          1H5*        A  28  -2.227 -12.489  -9.566
  290   2H5*    A  28          2H5*        A  28  -2.023 -14.173 -10.080
  291    H4*    A  28           H4*        A  28   0.148 -13.107  -9.714
  292    H3*    A  28           H3*        A  28  -0.517 -15.277  -7.682
  293    H2*    A  28           H2*        A  28   1.722 -14.919  -6.854
  294   2HO*    A  28          2HO*        A  28   2.569 -14.553  -9.036
  295    H1*    A  28           H1*        A  28   1.535 -12.244  -6.756
  296    H8     A  28           H8         A  28  -1.979 -13.375  -6.050
  297   1H6     A  28          1H6         A  28  -0.106 -14.211  -0.209
  298   2H6     A  28          2H6         A  28  -1.489 -14.110  -1.286
  299    H2     A  28           H2         A  28   3.507 -13.680  -2.738
  300   1H5*    U  29          1H5*        U  29   3.343 -16.002  -9.135
  301   2H5*    U  29          2H5*        U  29   3.652 -17.719  -9.419
  302    H4*    U  29           H4*        U  29   5.304 -16.726  -7.876
  303    H3*    U  29           H3*        U  29   3.482 -18.796  -6.570
  304    H2*    U  29           H2*        U  29   4.956 -18.520  -4.661
  305   2HO*    U  29          2HO*        U  29   6.871 -18.276  -5.945
  306    H1*    U  29           H1*        U  29   4.892 -15.832  -4.698
  307    H3     U  29           H3         U  29   2.227 -17.408  -1.326
  308    H5     U  29           H5         U  29  -0.273 -17.179  -4.683
  309    H6     U  29           H6         U  29   1.652 -16.712  -6.049
  310   1H5*    C  30          1H5*        C  30   7.466 -19.726  -5.703
  311   2H5*    C  30          2H5*        C  30   7.789 -21.462  -5.762
  312    H4*    C  30           H4*        C  30   8.409 -20.485  -3.582
  313    H3*    C  30           H3*        C  30   6.061 -22.437  -3.462
  314    H2*    C  30           H2*        C  30   6.290 -22.192  -1.061
  315   2HO*    C  30          2HO*        C  30   8.680 -21.972  -1.311
  316    H1*    C  30           H1*        C  30   6.382 -19.497  -1.118
  317   1H4     C  30          1H4         C  30   0.250 -20.903  -0.680
  318   2H4     C  30          2H4         C  30   0.062 -20.753  -2.424
  319    H5     C  30           H5         C  30   1.984 -20.512  -3.931
  320    H6     C  30           H6         C  30   4.368 -20.264  -4.024
  321   1H5*    C  31          1H5*        C  31   8.694 -23.450  -0.468
  322   2H5*    C  31          2H5*        C  31   9.054 -25.180  -0.493
  323    H4*    C  31           H4*        C  31   8.280 -24.549   1.734
  324    H3*    C  31           H3*        C  31   6.248 -26.142   0.118
  325    H2*    C  31           H2*        C  31   5.002 -26.291   2.179
  326   2HO*    C  31          2HO*        C  31   6.970 -26.510   3.484
  327    H1*    C  31           H1*        C  31   5.303 -23.638   2.778
  328   1H4     C  31          1H4         C  31  -0.155 -24.128  -0.306
  329   2H4     C  31          2H4         C  31   0.645 -23.878  -1.855
  330    H5     C  31           H5         C  31   3.092 -23.773  -2.074
  331    H6     C  31           H6         C  31   5.168 -23.833  -0.865
  332    H3T    C  31           H3T        C  31   8.206 -27.219   0.568
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  -8.645 -21.041   6.647
    2   2H5*    G   1          2H5*        G   1  -8.150 -22.035   5.280
    3    H4*    G   1           H4*        G   1  -7.331 -22.550   8.176
    4    H3*    G   1           H3*        G   1  -5.982 -21.016   5.948
    5    H2*    G   1           H2*        G   1  -3.864 -21.851   6.774
    6   2HO*    G   1          2HO*        G   1  -4.501 -21.738   9.008
    7    H1*    G   1           H1*        G   1  -4.636 -24.395   6.880
    8    H8     G   1           H8         G   1  -6.732 -23.004   4.118
    9    H1     G   1           H1         G   1  -0.589 -23.933   2.465
   10   1H2     G   1          1H2         G   1   0.599 -24.310   4.315
   11   2H2     G   1          2H2         G   1  -0.185 -24.342   5.889
   12    H5T    G   1           H5T        G   1  -9.097 -23.842   6.414
   13   1H5*    G   2          1H5*        G   2  -3.696 -20.292   9.347
   14   2H5*    G   2          2H5*        G   2  -3.300 -18.574   9.503
   15    H4*    G   2           H4*        G   2  -1.288 -19.968   9.577
   16    H3*    G   2           H3*        G   2  -1.495 -18.191   7.124
   17    H2*    G   2           H2*        G   2   0.732 -18.985   6.595
   18   2HO*    G   2          2HO*        G   2   1.347 -19.001   8.858
   19    H1*    G   2           H1*        G   2   0.191 -21.573   6.983
   20    H8     G   2           H8         G   2  -3.070 -20.314   5.687
   21    H1     G   2           H1         G   2   1.511 -20.603   1.180
   22   1H2     G   2          1H2         G   2   3.472 -20.888   2.165
   23   2H2     G   2          2H2         G   2   3.589 -21.088   3.921
   24   1H5*    A   3          1H5*        A   3   2.393 -17.716   8.710
   25   2H5*    A   3          2H5*        A   3   2.808 -16.003   8.836
   26    H4*    A   3           H4*        A   3   4.531 -17.242   7.616
   27    H3*    A   3           H3*        A   3   2.971 -15.227   5.970
   28    H2*    A   3           H2*        A   3   4.470 -15.766   4.171
   29   2HO*    A   3          2HO*        A   3   6.295 -15.979   5.672
   30    H1*    A   3           H1*        A   3   4.326 -18.417   4.433
   31    H8     A   3           H8         A   3   0.884 -17.370   5.421
   32   1H6     A   3          1H6         A   3  -0.276 -16.903  -0.667
   33   2H6     A   3          2H6         A   3  -0.958 -16.962   0.958
   34    H2     A   3           H2         A   3   4.113 -17.191  -0.136
   35   1H5*    U   4          1H5*        U   4   7.042 -14.642   5.175
   36   2H5*    U   4          2H5*        U   4   7.480 -12.937   5.114
   37    H4*    U   4           H4*        U   4   8.053 -14.100   3.020
   38    H3*    U   4           H3*        U   4   5.855 -12.018   2.752
   39    H2*    U   4           H2*        U   4   6.091 -12.438   0.361
   40   2HO*    U   4          2HO*        U   4   8.391 -12.706   0.502
   41    H1*    U   4           H1*        U   4   6.026 -15.111   0.579
   42    H3     U   4           H3         U   4   2.006 -13.538  -1.006
   43    H5     U   4           H5         U   4   1.631 -13.545   3.171
   44    H6     U   4           H6         U   4   3.968 -14.030   3.357
   45   1H5*    A   5          1H5*        A   5   8.852 -11.276  -0.145
   46   2H5*    A   5          2H5*        A   5   9.152  -9.549  -0.346
   47    H4*    A   5           H4*        A   5   8.607 -10.625  -2.486
   48    H3*    A   5           H3*        A   5   6.540  -8.619  -1.506
   49    H2*    A   5           H2*        A   5   5.449  -9.001  -3.636
   50   2HO*    A   5          2HO*        A   5   7.478  -9.187  -4.775
   51    H1*    A   5           H1*        A   5   5.527 -11.662  -3.499
   52    H8     A   5           H8         A   5   5.231 -10.697   0.108
   53   1H6     A   5          1H6         A   5  -0.827 -10.063  -1.011
   54   2H6     A   5          2H6         A   5   0.418 -10.170   0.240
   55    H2     A   5           H2         A   5   1.260 -10.219  -4.905
   56   1H5*    U   6          1H5*        U   6   7.422  -7.655  -5.595
   57   2H5*    U   6          2H5*        U   6   7.535  -5.895  -5.759
   58    H4*    U   6           H4*        U   6   5.840  -6.899  -7.273
   59    H3*    U   6           H3*        U   6   4.813  -4.963  -5.168
   60    H2*    U   6           H2*        U   6   2.685  -5.204  -6.200
   61   2HO*    U   6          2HO*        U   6   3.383  -5.190  -8.344
   62    H1*    U   6           H1*        U   6   2.741  -7.873  -6.461
   63    H3     U   6           H3         U   6  -0.169  -6.779  -3.150
   64    H5     U   6           H5         U   6   3.558  -7.010  -1.243
   65    H6     U   6           H6         U   6   4.594  -7.236  -3.396
   66   1H5*    A   7          1H5*        A   7   2.367  -1.371  -7.899
   67   2H5*    A   7          2H5*        A   7   2.287  -2.125  -6.318
   68    H4*    A   7           H4*        A   7   0.751  -3.034  -8.800
   69    H3*    A   7           H3*        A   7   0.164  -1.564  -6.247
   70    H2*    A   7           H2*        A   7  -1.987  -2.535  -6.040
   71   2HO*    A   7          2HO*        A   7  -2.344  -2.818  -8.446
   72    H1*    A   7           H1*        A   7  -1.056  -4.985  -6.293
   73    H8     A   7           H8         A   7   2.065  -3.641  -4.955
   74   1H6     A   7          1H6         A   7  -0.745  -3.114   0.551
   75   2H6     A   7          2H6         A   7   0.823  -3.111  -0.281
   76    H2     A   7           H2         A   7  -3.860  -3.808  -2.440
   77   1H5*    U   8          1H5*        U   8  -3.634   0.849  -8.358
   78   2H5*    U   8          2H5*        U   8  -2.542   0.334  -7.094
   79    H4*    U   8           H4*        U   8  -5.327  -0.821  -7.548
   80    H3*    U   8           H3*        U   8  -4.220   1.352  -5.765
   81    H2*    U   8           H2*        U   8  -5.723   0.620  -4.011
   82   2HO*    U   8          2HO*        U   8  -7.418   0.165  -5.576
   83    H1*    U   8           H1*        U   8  -5.182  -1.982  -4.245
   84    H3     U   8           H3         U   8  -2.956  -0.281  -0.599
   85    H5     U   8           H5         U   8  -0.239  -0.119  -3.791
   86    H6     U   8           H6         U   8  -2.031  -0.661  -5.312
   87   1H5*    G   9          1H5*        G   9  -8.380   1.456  -5.048
   88   2H5*    G   9          2H5*        G   9  -8.924   3.131  -5.210
   89    H4*    G   9           H4*        G   9  -9.592   2.208  -3.054
   90    H3*    G   9           H3*        G   9  -7.511   4.440  -2.886
   91    H2*    G   9           H2*        G   9  -7.750   4.308  -0.560
   92   2HO*    G   9          2HO*        G   9 -10.011   4.054  -0.548
   93    H1*    G   9           H1*        G   9  -7.663   1.657  -0.333
   94    H8     G   9           H8         G   9  -5.369   2.448  -3.239
   95    H1     G   9           H1         G   9  -2.749   3.581   2.526
   96   1H2     G   9          1H2         G   9  -4.296   3.455   4.085
   97   2H2     G   9          2H2         G   9  -5.949   2.988   3.677
   98   1H5*    A  10          1H5*        A  10 -10.162   7.871   0.026
   99   2H5*    A  10          2H5*        A  10  -8.491   7.430  -0.272
  100    H4*    A  10           H4*        A  10 -10.289   6.239   1.879
  101    H3*    A  10           H3*        A  10  -8.141   8.302   1.638
  102    H2*    A  10           H2*        A  10  -7.100   7.635   3.701
  103   2HO*    A  10          2HO*        A  10  -9.269   7.113   4.631
  104    H1*    A  10           H1*        A  10  -6.996   5.064   3.142
  105    H8     A  10           H8         A  10  -6.960   6.171  -0.350
  106   1H6     A  10          1H6         A  10  -0.953   7.541   0.493
  107   2H6     A  10          2H6         A  10  -2.242   7.329  -0.693
  108    H2     A  10           H2         A  10  -2.795   7.179   4.464
  109   1H5*    U  11          1H5*        U  11  -8.792   8.382   5.643
  110   2H5*    U  11          2H5*        U  11  -9.272   9.984   6.197
  111    H4*    U  11           H4*        U  11  -7.245   9.176   7.363
  112    H3*    U  11           H3*        U  11  -7.097  11.603   5.572
  113    H2*    U  11           H2*        U  11  -4.831  11.868   6.037
  114   2HO*    U  11          2HO*        U  11  -5.096  11.587   8.308
  115    H1*    U  11           H1*        U  11  -4.122   9.245   6.212
  116    H3     U  11           H3         U  11  -1.793  10.788   2.681
  117    H5     U  11           H5         U  11  -5.607   9.911   1.140
  118    H6     U  11           H6         U  11  -6.374   9.544   3.397
  119   1H5*    A  12          1H5*        A  12  -5.831  15.339   7.616
  120   2H5*    A  12          2H5*        A  12  -5.349  14.140   6.418
  121    H4*    A  12           H4*        A  12  -3.732  14.703   8.934
  122    H3*    A  12           H3*        A  12  -3.825  16.130   6.284
  123    H2*    A  12           H2*        A  12  -1.420  16.368   6.378
  124   2HO*    A  12          2HO*        A  12  -1.538  16.648   8.759
  125    H1*    A  12           H1*        A  12  -0.874  13.914   7.024
  126    H8     A  12           H8         A  12  -4.006  13.669   4.996
  127   1H6     A  12          1H6         A  12  -0.222  13.529   0.082
  128   2H6     A  12          2H6         A  12  -1.892  13.258   0.619
  129    H2     A  12           H2         A  12   2.206  14.466   3.621
  130   1H5*    C  13          1H5*        C  13  -1.106  18.145   8.774
  131   2H5*    C  13          2H5*        C  13  -1.522  19.883   8.793
  132    H4*    C  13           H4*        C  13   0.792  19.771   8.227
  133    H3*    C  13           H3*        C  13  -0.779  20.170   5.711
  134    H2*    C  13           H2*        C  13   1.485  20.593   4.843
  135   2HO*    C  13          2HO*        C  13   2.285  21.673   6.668
  136    H1*    C  13           H1*        C  13   2.529  18.374   5.879
  137   1H4     C  13          1H4         C  13   0.193  16.569   0.271
  138   2H4     C  13          2H4         C  13  -1.428  16.528   0.929
  139    H5     C  13           H5         C  13  -1.954  17.148   3.230
  140    H6     C  13           H6         C  13  -1.112  17.925   5.255
  141   1H5*    A  14          1H5*        A  14   1.972  23.517   6.604
  142   2H5*    A  14          2H5*        A  14   1.381  24.990   5.803
  143    H4*    A  14           H4*        A  14   3.685  24.342   5.026
  144    H3*    A  14           H3*        A  14   1.564  24.089   2.947
  145    H2*    A  14           H2*        A  14   3.456  23.849   1.453
  146   2HO*    A  14          2HO*        A  14   4.953  25.255   2.648
  147    H1*    A  14           H1*        A  14   4.490  21.951   2.935
  148    H8     A  14           H8         A  14   0.748  21.509   3.417
  149   1H6     A  14          1H6         A  14   0.970  18.586  -2.041
  150   2H6     A  14          2H6         A  14  -0.037  18.984  -0.644
  151    H2     A  14           H2         A  14   4.929  20.352  -1.331
  152   1H5*    A  15          1H5*        A  15   4.069  28.462   1.152
  153   2H5*    A  15          2H5*        A  15   3.125  26.983   0.922
  154    H4*    A  15           H4*        A  15   6.056  27.392   0.163
  155    H3*    A  15           H3*        A  15   3.454  27.132  -1.348
  156    H2*    A  15           H2*        A  15   4.324  25.842  -2.849
  157   2HO*    A  15          2HO*        A  15   6.279  27.226  -3.173
  158    H1*    A  15           H1*        A  15   6.034  24.311  -1.337
  159    H8     A  15           H8         A  15   2.864  25.107   0.007
  160   1H6     A  15          1H6         A  15   0.291  20.839  -3.738
  161   2H6     A  15          2H6         A  15  -0.023  21.860  -2.323
  162    H2     A  15           H2         A  15   4.447  21.629  -4.991
  163   1H5*    U  16          1H5*        U  16   4.799  28.897  -6.113
  164   2H5*    U  16          2H5*        U  16   3.126  28.434  -5.741
  165    H4*    U  16           H4*        U  16   3.930  27.119  -7.602
  166    H3*    U  16           H3*        U  16   3.568  25.600  -5.029
  167    H2*    U  16           H2*        U  16   4.256  23.620  -6.169
  168   2HO*    U  16          2HO*        U  16   2.818  24.210  -7.954
  169    H1*    U  16           H1*        U  16   6.009  24.787  -7.948
  170    H3     U  16           H3         U  16   9.631  23.097  -5.924
  171    H5     U  16           H5         U  16   6.933  23.716  -2.786
  172    H6     U  16           H6         U  16   5.445  24.781  -4.321
  173   1H5*    U  17          1H5*        U  17   1.489  22.923  -8.230
  174   2H5*    U  17          2H5*        U  17   0.101  22.477  -7.270
  175    H4*    U  17           H4*        U  17   2.790  21.130  -6.853
  176    H3*    U  17           H3*        U  17   1.312  20.856  -9.266
  177    H2*    U  17           H2*        U  17  -0.111  19.031  -8.911
  178   2HO*    U  17          2HO*        U  17   1.675  17.668  -8.775
  179    H1*    U  17           H1*        U  17  -0.201  18.684  -6.192
  180    H3     U  17           H3         U  17  -3.638  21.575  -5.104
  181    H5     U  17           H5         U  17  -2.907  22.246  -9.170
  182    H6     U  17           H6         U  17  -0.978  20.859  -9.030
  183   1H5*    U  18          1H5*        U  18   4.151  16.176  -9.192
  184   2H5*    U  18          2H5*        U  18   3.872  17.358  -7.926
  185    H4*    U  18           H4*        U  18   6.676  16.885  -8.969
  186    H3*    U  18           H3*        U  18   5.098  14.957  -7.489
  187    H2*    U  18           H2*        U  18   5.986  15.155  -5.318
  188   2HO*    U  18          2HO*        U  18   8.136  14.844  -6.038
  189    H1*    U  18           H1*        U  18   6.738  17.728  -5.185
  190    H3     U  18           H3         U  18   2.940  19.574  -3.615
  191    H5     U  18           H5         U  18   1.640  16.014  -5.392
  192    H6     U  18           H6         U  18   3.818  15.659  -6.209
  193   1H5*    G  19          1H5*        G  19   7.660  11.284  -5.339
  194   2H5*    G  19          2H5*        G  19   6.218  12.292  -5.118
  195    H4*    G  19           H4*        G  19   8.930  12.949  -3.909
  196    H3*    G  19           H3*        G  19   6.649  11.269  -2.808
  197    H2*    G  19           H2*        G  19   6.836  12.300  -0.713
  198   2HO*    G  19          2HO*        G  19   9.129  12.231  -0.675
  199    H1*    G  19           H1*        G  19   7.161  14.823  -1.539
  200    H8     G  19           H8         G  19   4.837  12.653  -3.613
  201    H1     G  19           H1         G  19   2.088  16.292   0.904
  202   1H2     G  19          1H2         G  19   3.658  17.357   2.051
  203   2H2     G  19          2H2         G  19   5.352  17.113   1.663
  204   1H5*    A  20          1H5*        A  20   7.959   8.637   0.967
  205   2H5*    A  20          2H5*        A  20   6.541   9.419   0.287
  206    H4*    A  20           H4*        A  20   8.302  10.582   2.497
  207    H3*    A  20           H3*        A  20   5.807   8.946   2.313
  208    H2*    A  20           H2*        A  20   4.814  10.104   4.194
  209   2HO*    A  20          2HO*        A  20   6.928  10.340   5.260
  210    H1*    A  20           H1*        A  20   5.221  12.524   3.175
  211    H8     A  20           H8         A  20   5.268  10.922  -0.072
  212   1H6     A  20          1H6         A  20  -0.901  10.131   0.384
  213   2H6     A  20          2H6         A  20   0.491  10.184  -0.714
  214    H2     A  20           H2         A  20   0.639  10.874   4.420
  215   1H5*    U  21          1H5*        U  21   6.285   8.833   6.421
  216   2H5*    U  21          2H5*        U  21   6.383   7.148   6.994
  217    H4*    U  21           H4*        U  21   4.485   8.304   8.054
  218    H3*    U  21           H3*        U  21   3.705   6.282   5.946
  219    H2*    U  21           H2*        U  21   1.448   6.519   6.810
  220   2HO*    U  21          2HO*        U  21   2.021   7.009   9.040
  221    H1*    U  21           H1*        U  21   1.540   9.135   6.516
  222    H3     U  21           H3         U  21  -0.569   7.141   2.938
  223    H5     U  21           H5         U  21   3.418   7.642   1.773
  224    H6     U  21           H6         U  21   3.935   8.297   4.013
  225   1H5*    C  22          1H5*        C  22   2.082   3.316   9.836
  226   2H5*    C  22          2H5*        C  22   2.185   3.831   8.161
  227    H4*    C  22           H4*        C  22  -0.155   4.371  10.040
  228    H3*    C  22           H3*        C  22   0.304   2.521   7.693
  229    H2*    C  22           H2*        C  22  -2.090   2.579   7.316
  230   2HO*    C  22          2HO*        C  22  -2.709   2.911   9.595
  231    H1*    C  22           H1*        C  22  -2.092   5.198   7.237
  232   1H4     C  22          1H4         C  22  -0.312   3.456   1.445
  233   2H4     C  22          2H4         C  22   1.381   3.703   1.880
  234    H5     C  22           H5         C  22   2.098   4.177   4.130
  235    H6     C  22           H6         C  22   1.331   4.578   6.398
  236   1H5*    A  23          1H5*        A  23  -2.982  -0.733  10.166
  237   2H5*    A  23          2H5*        A  23  -2.100  -0.147   8.763
  238    H4*    A  23           H4*        A  23  -5.031   0.458   9.357
  239    H3*    A  23           H3*        A  23  -3.625  -1.608   7.688
  240    H2*    A  23           H2*        A  23  -5.260  -1.329   5.920
  241   2HO*    A  23          2HO*        A  23  -6.988  -0.981   7.588
  242    H1*    A  23           H1*        A  23  -5.171   1.315   5.855
  243    H8     A  23           H8         A  23  -1.706   0.661   6.965
  244   1H6     A  23          1H6         A  23  -0.529  -0.702   1.002
  245   2H6     A  23          2H6         A  23   0.214  -0.362   2.586
  246    H2     A  23           H2         A  23  -4.870  -0.794   1.576
  247   1H5*    G  24          1H5*        G  24  -7.043  -2.489   6.332
  248   2H5*    G  24          2H5*        G  24  -7.716  -3.927   7.101
  249    H4*    G  24           H4*        G  24  -7.947  -4.059   4.689
  250    H3*    G  24           H3*        G  24  -6.738  -5.906   6.398
  251    H2*    G  24           H2*        G  24  -4.637  -5.924   5.750
  252   2HO*    G  24          2HO*        G  24  -6.099  -7.425   3.980
  253    H1*    G  24           H1*        G  24  -5.092  -5.083   2.931
  254    H8     G  24           H8         G  24  -4.026  -3.113   5.926
  255    H1     G  24           H1         G  24   0.816  -5.123   2.185
  256   1H2     G  24          1H2         G  24  -0.031  -6.514   0.636
  257   2H2     G  24          2H2         G  24  -1.728  -6.919   0.674
  258   1H5*    U  25          1H5*        U  25 -10.474  -7.150   2.187
  259   2H5*    U  25          2H5*        U  25  -8.728  -6.995   2.027
  260    H4*    U  25           H4*        U  25 -10.742  -4.907   1.088
  261    H3*    U  25           H3*        U  25  -9.922  -7.398  -0.136
  262    H2*    U  25           H2*        U  25  -8.446  -6.675  -1.801
  263   2HO*    U  25          2HO*        U  25 -10.069  -5.300  -2.696
  264    H1*    U  25           H1*        U  25  -7.482  -4.336  -0.856
  265    H3     U  25           H3         U  25  -3.703  -5.871   0.997
  266    H5     U  25           H5         U  25  -6.148  -9.261   0.926
  267    H6     U  25           H6         U  25  -7.979  -7.875   0.195
  268   1H5*    A  26          1H5*        A  26 -10.604  -8.821  -4.114
  269   2H5*    A  26          2H5*        A  26  -9.392  -8.327  -2.933
  270    H4*    A  26           H4*        A  26  -9.692  -7.107  -5.714
  271    H3*    A  26           H3*        A  26  -7.910  -9.308  -4.639
  272    H2*    A  26           H2*        A  26  -6.206  -8.552  -6.157
  273   2HO*    A  26          2HO*        A  26  -7.837  -8.005  -7.821
  274    H1*    A  26           H1*        A  26  -6.416  -5.965  -5.466
  275    H8     A  26           H8         A  26  -7.321  -8.238  -2.590
  276   1H6     A  26          1H6         A  26  -1.264  -7.993  -1.225
  277   2H6     A  26          2H6         A  26  -2.860  -8.518  -0.630
  278    H2     A  26           H2         A  26  -1.834  -6.316  -5.228
  279   1H5*    U  27          1H5*        U  27  -7.150  -9.449  -8.662
  280   2H5*    U  27          2H5*        U  27  -7.081 -11.118  -9.250
  281    H4*    U  27           H4*        U  27  -4.994  -9.946  -9.728
  282    H3*    U  27           H3*        U  27  -4.667 -12.106  -7.608
  283    H2*    U  27           H2*        U  27  -2.311 -11.636  -7.835
  284   2HO*    U  27          2HO*        U  27  -2.384 -11.305 -10.110
  285    H1*    U  27           H1*        U  27  -2.563  -8.972  -7.667
  286    H3     U  27           H3         U  27  -1.018 -10.533  -3.659
  287    H5     U  27           H5         U  27  -5.191 -10.905  -3.426
  288    H6     U  27           H6         U  27  -5.326 -10.353  -5.757
  289   1H5*    A  28          1H5*        A  28  -1.875 -12.837 -10.783
  290   2H5*    A  28          2H5*        A  28  -1.740 -14.574 -11.109
  291    H4*    A  28           H4*        A  28   0.459 -13.605 -10.688
  292    H3*    A  28           H3*        A  28  -0.469 -15.500  -8.493
  293    H2*    A  28           H2*        A  28   1.720 -15.165  -7.553
  294   2HO*    A  28          2HO*        A  28   2.745 -15.095  -9.664
  295    H1*    A  28           H1*        A  28   1.680 -12.501  -7.716
  296    H8     A  28           H8         A  28  -1.932 -13.416  -7.203
  297   1H6     A  28          1H6         A  28  -0.562 -13.647  -1.180
  298   2H6     A  28          2H6         A  28  -1.851 -13.608  -2.384
  299    H2     A  28           H2         A  28   3.247 -13.520  -3.407
  300   1H5*    U  29          1H5*        U  29   3.392 -16.621  -9.661
  301   2H5*    U  29          2H5*        U  29   3.603 -18.375  -9.685
  302    H4*    U  29           H4*        U  29   5.225 -17.281  -8.193
  303    H3*    U  29           H3*        U  29   3.196 -19.026  -6.722
  304    H2*    U  29           H2*        U  29   4.619 -18.586  -4.802
  305   2HO*    U  29          2HO*        U  29   6.564 -18.631  -6.104
  306    H1*    U  29           H1*        U  29   4.713 -15.934  -5.186
  307    H3     U  29           H3         U  29   1.813 -16.864  -1.795
  308    H5     U  29           H5         U  29  -0.523 -17.053  -5.267
  309    H6     U  29           H6         U  29   1.481 -16.877  -6.588
  310   1H5*    C  30          1H5*        C  30   7.039 -20.083  -5.509
  311   2H5*    C  30          2H5*        C  30   7.242 -21.834  -5.408
  312    H4*    C  30           H4*        C  30   7.849 -20.717  -3.298
  313    H3*    C  30           H3*        C  30   5.388 -22.524  -3.124
  314    H2*    C  30           H2*        C  30   5.508 -22.070  -0.754
  315   2HO*    C  30          2HO*        C  30   7.906 -22.005  -0.899
  316    H1*    C  30           H1*        C  30   5.754 -19.409  -1.008
  317   1H4     C  30          1H4         C  30  -0.439 -20.415  -0.836
  318   2H4     C  30          2H4         C  30  -0.545 -20.319  -2.604
  319    H5     C  30           H5         C  30   1.451 -20.278  -4.006
  320    H6     C  30           H6         C  30   3.842 -20.193  -3.977
  321   1H5*    C  31          1H5*        C  31   7.842 -23.442   0.063
  322   2H5*    C  31          2H5*        C  31   8.148 -25.180   0.134
  323    H4*    C  31           H4*        C  31   7.306 -24.453   2.290
  324    H3*    C  31           H3*        C  31   5.249 -25.996   0.654
  325    H2*    C  31           H2*        C  31   3.929 -26.015   2.663
  326   2HO*    C  31          2HO*        C  31   5.861 -26.276   4.036
  327    H1*    C  31           H1*        C  31   4.326 -23.371   3.183
  328   1H4     C  31          1H4         C  31  -0.972 -23.599  -0.144
  329   2H4     C  31          2H4         C  31  -0.082 -23.435  -1.668
  330    H5     C  31           H5         C  31   2.348 -23.518  -1.776
  331    H6     C  31           H6         C  31   4.357 -23.669  -0.474
  332    H3T    C  31           H3T        C  31   7.130 -27.154   1.207
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1   5.275 -24.549   6.983
    2   2H5*    G   1          2H5*        G   1   6.192 -25.901   7.692
    3    H4*    G   1           H4*        G   1   8.185 -25.206   6.339
    4    H3*    G   1           H3*        G   1   6.229 -23.129   5.330
    5    H2*    G   1           H2*        G   1   7.350 -23.284   3.175
    6   2HO*    G   1          2HO*        G   1   9.484 -23.573   4.089
    7    H1*    G   1           H1*        G   1   7.261 -25.967   3.085
    8    H8     G   1           H8         G   1   4.227 -25.075   5.103
    9    H1     G   1           H1         G   1   3.525 -23.925  -1.168
   10   1H2     G   1          1H2         G   1   5.487 -24.091  -2.184
   11   2H2     G   1          2H2         G   1   6.953 -24.456  -1.294
   12    H5T    G   1           H5T        G   1   6.948 -23.163   7.832
   13   1H5*    G   2          1H5*        G   2  10.033 -22.032   3.972
   14   2H5*    G   2          2H5*        G   2  10.318 -20.288   4.099
   15    H4*    G   2           H4*        G   2  10.698 -21.116   1.806
   16    H3*    G   2           H3*        G   2   8.352 -19.234   2.142
   17    H2*    G   2           H2*        G   2   8.145 -19.352  -0.297
   18   2HO*    G   2          2HO*        G   2  10.477 -19.420  -0.597
   19    H1*    G   2           H1*        G   2   8.314 -22.038  -0.423
   20    H8     G   2           H8         G   2   6.540 -21.481   2.829
   21    H1     G   2           H1         G   2   2.853 -20.248  -2.281
   22   1H2     G   2          1H2         G   2   4.095 -20.188  -4.105
   23   2H2     G   2          2H2         G   2   5.825 -20.487  -4.057
   24   1H5*    A   3          1H5*        A   3  10.754 -17.980  -1.125
   25   2H5*    A   3          2H5*        A   3  10.947 -16.220  -1.210
   26    H4*    A   3           H4*        A   3  10.065 -17.154  -3.324
   27    H3*    A   3           H3*        A   3   8.167 -15.349  -1.796
   28    H2*    A   3           H2*        A   3   6.687 -15.594  -3.740
   29   2HO*    A   3          2HO*        A   3   8.514 -15.655  -5.245
   30    H1*    A   3           H1*        A   3   6.856 -18.272  -3.805
   31    H8     A   3           H8         A   3   7.274 -17.628  -0.149
   32   1H6     A   3          1H6         A   3   1.164 -16.728   0.128
   33   2H6     A   3          2H6         A   3   2.641 -16.967   1.054
   34    H2     A   3           H2         A   3   2.359 -16.720  -4.161
   35   1H5*    U   4          1H5*        U   4   8.170 -14.221  -5.821
   36   2H5*    U   4          2H5*        U   4   8.278 -12.466  -6.055
   37    H4*    U   4           H4*        U   4   6.311 -13.436  -7.219
   38    H3*    U   4           H3*        U   4   5.721 -11.547  -4.918
   39    H2*    U   4           H2*        U   4   3.383 -11.783  -5.559
   40   2HO*    U   4          2HO*        U   4   3.860 -11.861  -7.846
   41    H1*    U   4           H1*        U   4   3.449 -14.477  -5.727
   42    H3     U   4           H3         U   4   1.381 -13.038  -1.867
   43    H5     U   4           H5         U   4   5.406 -13.659  -0.856
   44    H6     U   4           H6         U   4   5.901 -13.903  -3.199
   45   1H5*    A   5          1H5*        A   5   3.485 -10.311  -8.343
   46   2H5*    A   5          2H5*        A   5   3.444  -8.548  -8.517
   47    H4*    A   5           H4*        A   5   1.181  -9.508  -8.489
   48    H3*    A   5           H3*        A   5   1.825  -7.799  -6.069
   49    H2*    A   5           H2*        A   5  -0.514  -8.114  -5.472
   50   2HO*    A   5          2HO*        A   5  -1.227  -8.060  -7.727
   51    H1*    A   5           H1*        A   5  -0.464 -10.782  -5.805
   52    H8     A   5           H8         A   5   3.057 -10.085  -4.730
   53   1H6     A   5          1H6         A   5   0.862  -9.853   1.050
   54   2H6     A   5          2H6         A   5   2.307  -9.959   0.058
   55    H2     A   5           H2         A   5  -2.588  -9.556  -1.730
   56   1H5*    U   6          1H5*        U   6  -1.888  -6.600  -7.635
   57   2H5*    U   6          2H5*        U   6  -2.070  -4.836  -7.621
   58    H4*    U   6           H4*        U   6  -3.894  -6.048  -6.405
   59    H3*    U   6           H3*        U   6  -2.161  -4.106  -4.856
   60    H2*    U   6           H2*        U   6  -3.595  -4.521  -2.974
   61   2HO*    U   6          2HO*        U   6  -5.565  -4.533  -4.114
   62    H1*    U   6           H1*        U   6  -3.741  -7.214  -3.290
   63    H3     U   6           H3         U   6  -1.178  -6.231   0.367
   64    H5     U   6           H5         U   6   1.490  -6.386  -2.869
   65    H6     U   6           H6         U   6  -0.395  -6.485  -4.358
   66   1H5*    A   7          1H5*        A   7  -5.816  -0.840  -2.996
   67   2H5*    A   7          2H5*        A   7  -4.230  -1.461  -2.517
   68    H4*    A   7           H4*        A   7  -6.943  -2.623  -1.717
   69    H3*    A   7           H3*        A   7  -4.710  -1.039  -0.482
   70    H2*    A   7           H2*        A   7  -4.958  -2.100   1.643
   71   2HO*    A   7          2HO*        A   7  -7.442  -2.746   0.873
   72    H1*    A   7           H1*        A   7  -4.773  -4.522   0.592
   73    H8     A   7           H8         A   7  -2.857  -2.897  -2.096
   74   1H6     A   7          1H6         A   7   1.826  -2.284   1.924
   75   2H6     A   7          2H6         A   7   1.330  -2.166   0.250
   76    H2     A   7           H2         A   7  -1.844  -3.429   4.211
   77   1H5*    U   8          1H5*        U   8  -7.748   1.244   2.627
   78   2H5*    U   8          2H5*        U   8  -6.208   0.791   1.890
   79    H4*    U   8           H4*        U   8  -7.179  -0.204   4.608
   80    H3*    U   8           H3*        U   8  -5.505   2.123   3.681
   81    H2*    U   8           H2*        U   8  -4.017   1.844   5.530
   82   2HO*    U   8          2HO*        U   8  -5.677   1.335   7.062
   83    H1*    U   8           H1*        U   8  -3.776  -0.840   5.281
   84    H3     U   8           H3         U   8  -0.063   1.322   3.599
   85    H5     U   8           H5         U   8  -2.556   0.428   0.334
   86    H6     U   8           H6         U   8  -4.326  -0.107   1.894
   87   1H5*    G   9          1H5*        G   9  -5.439   5.750   7.013
   88   2H5*    G   9          2H5*        G   9  -4.386   5.138   5.740
   89    H4*    G   9           H4*        G   9  -4.070   4.679   8.743
   90    H3*    G   9           H3*        G   9  -3.033   6.485   6.611
   91    H2*    G   9           H2*        G   9  -0.762   6.359   7.321
   92   2HO*    G   9          2HO*        G   9  -1.290   6.424   9.598
   93    H1*    G   9           H1*        G   9  -0.673   3.694   7.606
   94    H8     G   9           H8         G   9  -3.241   3.753   4.975
   95    H1     G   9           H1         G   9   2.516   5.444   2.684
   96   1H2     G   9          1H2         G   9   3.886   5.928   4.351
   97   2H2     G   9          2H2         G   9   3.384   5.777   6.025
   98   1H5*    A  10          1H5*        A  10  -1.237  10.755   8.296
   99   2H5*    A  10          2H5*        A  10  -1.152   9.731   6.862
  100    H4*    A  10           H4*        A  10   0.948   9.940   9.075
  101    H3*    A  10           H3*        A  10   0.542  10.756   6.212
  102    H2*    A  10           H2*        A  10   2.885  10.579   5.737
  103   2HO*    A  10          2HO*        A  10   3.559  11.065   8.058
  104    H1*    A  10           H1*        A  10   2.935   8.063   6.596
  105    H8     A  10           H8         A  10  -0.640   7.983   5.902
  106   1H6     A  10          1H6         A  10   0.647   7.824  -0.147
  107   2H6     A  10          2H6         A  10  -0.602   7.626   1.066
  108    H2     A  10           H2         A  10   4.337   9.041   1.996
  109   1H5*    U  11          1H5*        U  11   3.271  14.844   6.825
  110   2H5*    U  11          2H5*        U  11   2.368  13.597   5.958
  111    H4*    U  11           H4*        U  11   5.410  13.813   6.023
  112    H3*    U  11           H3*        U  11   3.282  14.704   4.063
  113    H2*    U  11           H2*        U  11   4.876  14.219   2.275
  114   2HO*    U  11          2HO*        U  11   6.721  14.897   3.605
  115    H1*    U  11           H1*        U  11   5.432  11.753   3.183
  116    H3     U  11           H3         U  11   2.278  11.653  -0.213
  117    H5     U  11           H5         U  11   0.140  11.547   3.401
  118    H6     U  11           H6         U  11   2.188  12.044   4.571
  119   1H5*    A  12          1H5*        A  12   6.943  16.404   2.703
  120   2H5*    A  12          2H5*        A  12   6.692  18.142   2.422
  121    H4*    A  12           H4*        A  12   7.734  17.065   0.464
  122    H3*    A  12           H3*        A  12   4.913  18.077   0.133
  123    H2*    A  12           H2*        A  12   5.114  17.544  -2.222
  124   2HO*    A  12          2HO*        A  12   7.396  18.138  -2.384
  125    H1*    A  12           H1*        A  12   6.151  15.116  -1.796
  126    H8     A  12           H8         A  12   3.878  15.376   1.141
  127   1H6     A  12          1H6         A  12  -0.686  13.600  -2.640
  128   2H6     A  12          2H6         A  12  -0.208  13.838  -0.975
  129    H2     A  12           H2         A  12   2.809  14.761  -5.144
  130   1H5*    C  13          1H5*        C  13   5.522  19.201  -3.862
  131   2H5*    C  13          2H5*        C  13   5.262  20.964  -3.928
  132    H4*    C  13           H4*        C  13   3.337  19.996  -4.924
  133    H3*    C  13           H3*        C  13   2.586  20.636  -2.079
  134    H2*    C  13           H2*        C  13   0.350  20.004  -2.888
  135   2HO*    C  13          2HO*        C  13   0.580  20.906  -4.994
  136    H1*    C  13           H1*        C  13   1.199  17.704  -4.025
  137   1H4     C  13          1H4         C  13  -0.054  16.414   2.085
  138   2H4     C  13          2H4         C  13   1.520  17.045   2.564
  139    H5     C  13           H5         C  13   3.043  18.082   1.005
  140    H6     C  13           H6         C  13   3.393  18.712  -1.296
  141   1H5*    A  14          1H5*        A  14  -0.212  22.351  -5.044
  142   2H5*    A  14          2H5*        A  14  -1.038  23.760  -4.344
  143    H4*    A  14           H4*        A  14  -2.599  21.915  -5.065
  144    H3*    A  14           H3*        A  14  -2.468  22.476  -2.095
  145    H2*    A  14           H2*        A  14  -4.454  21.046  -1.952
  146   2HO*    A  14          2HO*        A  14  -5.314  21.525  -4.113
  147    H1*    A  14           H1*        A  14  -3.233  19.136  -3.272
  148    H8     A  14           H8         A  14  -0.409  20.891  -1.428
  149   1H6     A  14          1H6         A  14  -2.140  17.392   3.402
  150   2H6     A  14          2H6         A  14  -0.919  18.510   2.808
  151    H2     A  14           H2         A  14  -5.135  16.873   0.196
  152   1H5*    A  15          1H5*        A  15  -7.575  23.977  -3.504
  153   2H5*    A  15          2H5*        A  15  -6.404  23.466  -2.274
  154    H4*    A  15           H4*        A  15  -8.124  21.490  -3.834
  155    H3*    A  15           H3*        A  15  -9.395  23.252  -2.277
  156    H2*    A  15           H2*        A  15  -7.613  23.202  -0.641
  157   2HO*    A  15          2HO*        A  15 -10.055  22.476   0.068
  158    H1*    A  15           H1*        A  15  -7.995  20.198  -0.458
  159    H8     A  15           H8         A  15  -5.180  22.780  -0.866
  160   1H6     A  15          1H6         A  15  -2.841  20.441   4.374
  161   2H6     A  15          2H6         A  15  -2.621  21.666   3.132
  162    H2     A  15           H2         A  15  -6.439  18.113   3.278
  163   1H5*    U  16          1H5*        U  16  -9.824  18.647  -1.090
  164   2H5*    U  16          2H5*        U  16 -11.578  18.410  -0.981
  165    H4*    U  16           H4*        U  16 -10.549  16.894   0.609
  166    H3*    U  16           H3*        U  16 -11.945  19.314   1.734
  167    H2*    U  16           H2*        U  16 -11.153  19.018   3.806
  168   2HO*    U  16          2HO*        U  16 -12.125  16.712   3.544
  169    H1*    U  16           H1*        U  16  -8.915  17.309   3.274
  170    H3     U  16           H3         U  16  -7.701  20.593   6.267
  171    H5     U  16           H5         U  16  -8.686  22.641   2.721
  172    H6     U  16           H6         U  16  -9.265  20.563   1.741
  173   1H5*    U  17          1H5*        U  17 -13.366  14.481  -0.861
  174   2H5*    U  17          2H5*        U  17 -12.325  14.634   0.561
  175    H4*    U  17           H4*        U  17 -11.260  15.189  -2.224
  176    H3*    U  17           H3*        U  17 -12.164  12.620  -1.382
  177    H2*    U  17           H2*        U  17 -10.283  11.574  -0.464
  178   2HO*    U  17          2HO*        U  17  -9.175  11.647  -2.445
  179    H1*    U  17           H1*        U  17  -8.601  13.605   0.202
  180    H3     U  17           H3         U  17 -10.269  14.639   4.385
  181    H5     U  17           H5         U  17 -12.915  11.796   2.791
  182    H6     U  17           H6         U  17 -11.797  12.007   0.681
  183   1H5*    U  18          1H5*        U  18  -8.473  10.880  -4.902
  184   2H5*    U  18          2H5*        U  18  -8.588  12.549  -4.322
  185    H4*    U  18           H4*        U  18  -8.893  11.947  -7.269
  186    H3*    U  18           H3*        U  18  -6.537  11.474  -5.685
  187    H2*    U  18           H2*        U  18  -5.179  13.295  -6.012
  188   2HO*    U  18          2HO*        U  18  -6.478  13.548  -8.516
  189    H1*    U  18           H1*        U  18  -6.967  15.280  -6.559
  190    H3     U  18           H3         U  18  -7.983  16.713  -2.389
  191    H5     U  18           H5         U  18  -5.954  13.088  -1.795
  192    H6     U  18           H6         U  18  -6.047  12.697  -4.146
  193   1H5*    G  19          1H5*        G  19  -4.534  10.124 -10.223
  194   2H5*    G  19          2H5*        G  19  -4.198  10.854  -8.645
  195    H4*    G  19           H4*        G  19  -3.281  11.895 -11.357
  196    H3*    G  19           H3*        G  19  -2.124  10.058  -9.375
  197    H2*    G  19           H2*        G  19  -0.277  11.306  -8.689
  198   2HO*    G  19          2HO*        G  19   0.384  11.595 -10.924
  199    H1*    G  19           H1*        G  19  -1.156  13.860  -8.937
  200    H8     G  19           H8         G  19  -2.772  10.716  -7.383
  201    H1     G  19           H1         G  19  -1.969  15.696  -3.440
  202   1H2     G  19          1H2         G  19  -1.092  17.390  -4.532
  203   2H2     G  19          2H2         G  19  -0.774  17.330  -6.255
  204   1H5*    A  20          1H5*        A  20   1.643   7.754  -9.973
  205   2H5*    A  20          2H5*        A  20   0.631   8.674  -8.845
  206    H4*    A  20           H4*        A  20   3.339   9.602  -9.908
  207    H3*    A  20           H3*        A  20   2.515   8.167  -7.380
  208    H2*    A  20           H2*        A  20   4.229   9.450  -6.201
  209   2HO*    A  20          2HO*        A  20   5.712   9.455  -8.033
  210    H1*    A  20           H1*        A  20   3.350  11.806  -7.113
  211    H8     A  20           H8         A  20   0.173   9.872  -7.309
  212   1H6     A  20          1H6         A  20  -0.318  10.575  -1.166
  213   2H6     A  20          2H6         A  20  -1.173  10.126  -2.637
  214    H2     A  20           H2         A  20   3.830  11.610  -2.326
  215   1H5*    U  21          1H5*        U  21   6.771   8.189  -7.364
  216   2H5*    U  21          2H5*        U  21   7.426   6.618  -6.848
  217    H4*    U  21           H4*        U  21   8.220   8.501  -5.398
  218    H3*    U  21           H3*        U  21   6.321   6.553  -4.083
  219    H2*    U  21           H2*        U  21   7.020   7.617  -1.989
  220   2HO*    U  21          2HO*        U  21   9.200   8.269  -2.733
  221    H1*    U  21           H1*        U  21   6.344  10.005  -2.976
  222    H3     U  21           H3         U  21   3.019   8.215  -0.328
  223    H5     U  21           H5         U  21   2.066   7.135  -4.272
  224    H6     U  21           H6         U  21   4.211   7.960  -4.956
  225   1H5*    C  22          1H5*        C  22  10.331   4.931  -1.299
  226   2H5*    C  22          2H5*        C  22   8.605   5.122  -1.642
  227    H4*    C  22           H4*        C  22  10.159   6.758   0.417
  228    H3*    C  22           H3*        C  22   8.534   4.227   0.592
  229    H2*    C  22           H2*        C  22   7.581   4.992   2.683
  230   2HO*    C  22          2HO*        C  22   9.621   5.902   3.404
  231    H1*    C  22           H1*        C  22   7.064   7.514   1.887
  232   1H4     C  22          1H4         C  22   1.822   4.260   0.413
  233   2H4     C  22          2H4         C  22   2.403   4.063  -1.230
  234    H5     C  22           H5         C  22   4.641   4.772  -1.934
  235    H6     C  22           H6         C  22   6.708   5.784  -1.190
  236   1H5*    A  23          1H5*        A  23  10.310   4.591   4.602
  237   2H5*    A  23          2H5*        A  23  10.773   2.952   5.107
  238    H4*    A  23           H4*        A  23   9.191   3.977   6.707
  239    H3*    A  23           H3*        A  23   7.970   1.744   5.085
  240    H2*    A  23           H2*        A  23   6.181   1.864   6.798
  241   2HO*    A  23          2HO*        A  23   7.845   2.909   8.421
  242    H1*    A  23           H1*        A  23   5.837   4.430   6.190
  243    H8     A  23           H8         A  23   7.329   3.114   3.016
  244   1H6     A  23          1H6         A  23   1.725   0.884   1.652
  245   2H6     A  23          2H6         A  23   3.344   1.197   1.042
  246    H2     A  23           H2         A  23   1.728   2.069   5.931
  247   1H5*    G  24          1H5*        G  24   7.097   2.019  10.093
  248   2H5*    G  24          2H5*        G  24   7.633   0.476  10.786
  249    H4*    G  24           H4*        G  24   5.170   0.782  10.935
  250    H3*    G  24           H3*        G  24   6.125  -1.458   9.138
  251    H2*    G  24           H2*        G  24   3.790  -2.072   8.954
  252   2HO*    G  24          2HO*        G  24   3.227  -1.694  11.139
  253    H1*    G  24           H1*        G  24   2.901   0.495   8.601
  254    H8     G  24           H8         G  24   6.218  -0.053   6.817
  255    H1     G  24           H1         G  24   1.079  -2.164   3.623
  256   1H2     G  24          1H2         G  24  -0.710  -1.982   4.871
  257   2H2     G  24          2H2         G  24  -0.646  -1.331   6.499
  258   1H5*    U  25          1H5*        U  25   3.510  -5.410  11.854
  259   2H5*    U  25          2H5*        U  25   3.893  -5.188  10.136
  260    H4*    U  25           H4*        U  25   1.357  -4.259  11.560
  261    H3*    U  25           H3*        U  25   2.042  -6.464   9.612
  262    H2*    U  25           H2*        U  25  -0.097  -6.185   8.560
  263   2HO*    U  25          2HO*        U  25  -1.299  -5.826  10.483
  264    H1*    U  25           H1*        U  25   0.024  -3.487   8.418
  265    H3     U  25           H3         U  25   0.969  -5.268   4.294
  266    H5     U  25           H5         U  25   4.648  -5.134   6.301
  267    H6     U  25           H6         U  25   3.474  -4.482   8.306
  268   1H5*    A  26          1H5*        A  26  -2.260  -9.595  10.206
  269   2H5*    A  26          2H5*        A  26  -1.291  -9.074   8.820
  270    H4*    A  26           H4*        A  26  -3.907  -7.828   9.779
  271    H3*    A  26           H3*        A  26  -3.040  -9.627   7.538
  272    H2*    A  26           H2*        A  26  -4.388  -8.472   5.937
  273   2HO*    A  26          2HO*        A  26  -6.172  -8.184   7.473
  274    H1*    A  26           H1*        A  26  -3.718  -5.982   6.671
  275    H8     A  26           H8         A  26  -0.583  -7.880   7.426
  276   1H6     A  26          1H6         A  26   0.798  -7.159   1.431
  277   2H6     A  26          2H6         A  26   1.412  -7.636   3.003
  278    H2     A  26           H2         A  26  -3.517  -6.246   1.964
  279   1H5*    U  27          1H5*        U  27  -6.963  -9.464   6.697
  280   2H5*    U  27          2H5*        U  27  -7.643 -11.071   6.384
  281    H4*    U  27           H4*        U  27  -7.930  -9.632   4.426
  282    H3*    U  27           H3*        U  27  -5.884 -11.838   4.023
  283    H2*    U  27           H2*        U  27  -5.890 -11.116   1.692
  284   2HO*    U  27          2HO*        U  27  -8.202 -10.682   1.709
  285    H1*    U  27           H1*        U  27  -5.690  -8.476   2.282
  286    H3     U  27           H3         U  27  -1.607  -9.962   0.813
  287    H5     U  27           H5         U  27  -1.675 -10.817   4.924
  288    H6     U  27           H6         U  27  -4.005 -10.206   4.961
  289   1H5*    A  28          1H5*        A  28  -8.671 -12.007   0.857
  290   2H5*    A  28          2H5*        A  28  -9.089 -13.677   0.438
  291    H4*    A  28           H4*        A  28  -8.311 -12.424  -1.526
  292    H3*    A  28           H3*        A  28  -6.452 -14.662  -0.644
  293    H2*    A  28           H2*        A  28  -5.196 -14.145  -2.655
  294   2HO*    A  28          2HO*        A  28  -7.200 -13.685  -3.861
  295    H1*    A  28           H1*        A  28  -5.162 -11.476  -2.246
  296    H8     A  28           H8         A  28  -5.102 -12.832   1.253
  297   1H6     A  28          1H6         A  28   0.995 -13.586   0.433
  298   2H6     A  28          2H6         A  28  -0.301 -13.530   1.613
  299    H2     A  28           H2         A  28  -0.854 -12.913  -3.548
  300   1H5*    U  29          1H5*        U  29  -7.110 -15.004  -4.746
  301   2H5*    U  29          2H5*        U  29  -7.323 -16.681  -5.271
  302    H4*    U  29           H4*        U  29  -5.494 -15.565  -6.490
  303    H3*    U  29           H3*        U  29  -4.568 -17.807  -4.650
  304    H2*    U  29           H2*        U  29  -2.405 -17.453  -5.705
  305   2HO*    U  29          2HO*        U  29  -3.305 -17.010  -7.813
  306    H1*    U  29           H1*        U  29  -2.460 -14.770  -5.415
  307    H3     U  29           H3         U  29   0.357 -16.606  -2.310
  308    H5     U  29           H5         U  29  -3.426 -16.578  -0.486
  309    H6     U  29           H6         U  29  -4.391 -15.932  -2.597
  310   1H5*    C  30          1H5*        C  30  -3.033 -18.405  -8.533
  311   2H5*    C  30          2H5*        C  30  -3.138 -20.104  -9.033
  312    H4*    C  30           H4*        C  30  -0.833 -19.267  -9.241
  313    H3*    C  30           H3*        C  30  -1.269 -21.360  -7.084
  314    H2*    C  30           H2*        C  30   1.145 -21.343  -6.849
  315   2HO*    C  30          2HO*        C  30   1.437 -21.059  -9.193
  316    H1*    C  30           H1*        C  30   1.370 -18.653  -6.811
  317   1H4     C  30          1H4         C  30   0.664 -20.108  -0.711
  318   2H4     C  30          2H4         C  30  -1.070 -19.856  -0.825
  319    H5     C  30           H5         C  30  -2.215 -19.555  -2.978
  320    H6     C  30           H6         C  30  -1.886 -19.273  -5.346
  321   1H5*    C  31          1H5*        C  31   1.893 -22.668  -9.590
  322   2H5*    C  31          2H5*        C  31   1.615 -24.353 -10.087
  323    H4*    C  31           H4*        C  31   3.836 -24.236  -9.118
  324    H3*    C  31           H3*        C  31   1.772 -25.472  -7.250
  325    H2*    C  31           H2*        C  31   3.608 -25.988  -5.788
  326   2HO*    C  31          2HO*        C  31   5.013 -26.513  -7.651
  327    H1*    C  31           H1*        C  31   4.782 -23.526  -6.030
  328   1H4     C  31          1H4         C  31   1.082 -23.282  -0.905
  329   2H4     C  31          2H4         C  31  -0.325 -22.900  -1.880
  330    H5     C  31           H5         C  31  -0.269 -22.863  -4.329
  331    H6     C  31           H6         C  31   1.133 -23.167  -6.263
  332    H3T    C  31           H3T        C  31   2.201 -26.628  -9.161
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -8.477 -22.768   8.215
    2   2H5*    G   1          2H5*        G   1  -8.300 -21.045   8.597
    3    H4*    G   1           H4*        G   1  -6.603 -22.247   9.787
    4    H3*    G   1           H3*        G   1  -5.496 -20.736   7.417
    5    H2*    G   1           H2*        G   1  -3.306 -21.353   8.210
    6   2HO*    G   1          2HO*        G   1  -3.897 -21.163  10.455
    7    H1*    G   1           H1*        G   1  -3.882 -23.930   8.484
    8    H8     G   1           H8         G   1  -6.161 -23.117   5.676
    9    H1     G   1           H1         G   1   0.037 -23.017   3.964
   10   1H2     G   1          1H2         G   1   1.263 -22.962   5.797
   11   2H2     G   1          2H2         G   1   0.504 -23.020   7.387
   12    H5T    G   1           H5T        G   1  -7.262 -20.760   6.584
   13   1H5*    G   2          1H5*        G   2  -3.177 -19.586  10.686
   14   2H5*    G   2          2H5*        G   2  -2.960 -17.833  10.718
   15    H4*    G   2           H4*        G   2  -0.816 -18.989  10.817
   16    H3*    G   2           H3*        G   2  -1.292 -17.399   8.290
   17    H2*    G   2           H2*        G   2   1.005 -17.985   7.699
   18   2HO*    G   2          2HO*        G   2   1.666 -17.827   9.947
   19    H1*    G   2           H1*        G   2   0.767 -20.576   8.206
   20    H8     G   2           H8         G   2  -2.675 -19.791   7.045
   21    H1     G   2           H1         G   2   1.671 -19.643   2.302
   22   1H2     G   2          1H2         G   2   3.677 -19.541   3.174
   23   2H2     G   2          2H2         G   2   3.908 -19.641   4.924
   24   1H5*    A   3          1H5*        A   3   2.603 -16.468   9.738
   25   2H5*    A   3          2H5*        A   3   2.908 -14.729   9.710
   26    H4*    A   3           H4*        A   3   4.654 -15.965   8.524
   27    H3*    A   3           H3*        A   3   2.948 -14.149   6.793
   28    H2*    A   3           H2*        A   3   4.402 -14.776   4.968
   29   2HO*    A   3          2HO*        A   3   6.275 -14.852   6.437
   30    H1*    A   3           H1*        A   3   4.315 -17.390   5.392
   31    H8     A   3           H8         A   3   0.918 -16.369   6.526
   32   1H6     A   3          1H6         A   3  -0.594 -16.306   0.535
   33   2H6     A   3          2H6         A   3  -1.175 -16.245   2.211
   34    H2     A   3           H2         A   3   3.799 -16.448   0.782
   35   1H5*    U   4          1H5*        U   4   6.968 -13.490   5.793
   36   2H5*    U   4          2H5*        U   4   7.341 -11.782   5.591
   37    H4*    U   4           H4*        U   4   7.900 -13.084   3.584
   38    H3*    U   4           H3*        U   4   5.656 -11.071   3.210
   39    H2*    U   4           H2*        U   4   5.764 -11.711   0.858
   40   2HO*    U   4          2HO*        U   4   8.081 -11.955   0.950
   41    H1*    U   4           H1*        U   4   5.744 -14.346   1.292
   42    H3     U   4           H3         U   4   1.628 -12.957  -0.185
   43    H5     U   4           H5         U   4   1.442 -12.712   3.989
   44    H6     U   4           H6         U   4   3.809 -13.091   4.092
   45   1H5*    A   5          1H5*        A   5   8.447 -10.610   0.093
   46   2H5*    A   5          2H5*        A   5   8.740  -8.918  -0.295
   47    H4*    A   5           H4*        A   5   8.048 -10.189  -2.266
   48    H3*    A   5           H3*        A   5   6.038  -8.078  -1.396
   49    H2*    A   5           H2*        A   5   4.829  -8.689  -3.406
   50   2HO*    A   5          2HO*        A   5   6.837  -9.010  -4.584
   51    H1*    A   5           H1*        A   5   4.903 -11.317  -2.971
   52    H8     A   5           H8         A   5   4.817  -9.992   0.520
   53   1H6     A   5          1H6         A   5  -1.311  -9.533  -0.370
   54   2H6     A   5          2H6         A   5  -0.016  -9.499   0.843
   55    H2     A   5           H2         A   5   0.551  -9.965  -4.291
   56   1H5*    U   6          1H5*        U   6   6.664  -7.575  -5.600
   57   2H5*    U   6          2H5*        U   6   6.762  -5.843  -5.944
   58    H4*    U   6           H4*        U   6   4.989  -6.991  -7.241
   59    H3*    U   6           H3*        U   6   4.090  -4.836  -5.313
   60    H2*    U   6           H2*        U   6   1.886  -5.189  -6.167
   61   2HO*    U   6          2HO*        U   6   2.465  -5.388  -8.326
   62    H1*    U   6           H1*        U   6   1.936  -7.873  -6.157
   63    H3     U   6           H3         U   6  -0.832  -6.532  -2.833
   64    H5     U   6           H5         U   6   2.973  -6.514  -1.082
   65    H6     U   6           H6         U   6   3.934  -6.904  -3.256
   66   1H5*    A   7          1H5*        A   7   1.548  -1.512  -8.331
   67   2H5*    A   7          2H5*        A   7   1.473  -2.072  -6.668
   68    H4*    A   7           H4*        A   7  -0.075  -3.230  -9.023
   69    H3*    A   7           H3*        A   7  -0.670  -1.261  -6.860
   70    H2*    A   7           H2*        A   7  -2.644  -2.329  -6.126
   71   2HO*    A   7          2HO*        A   7  -3.194  -2.711  -8.442
   72    H1*    A   7           H1*        A   7  -1.880  -4.878  -6.207
   73    H8     A   7           H8         A   7   1.384  -3.479  -5.180
   74   1H6     A   7          1H6         A   7  -1.157  -2.695   0.412
   75   2H6     A   7          2H6         A   7   0.363  -2.715  -0.513
   76    H2     A   7           H2         A   7  -4.397  -3.669  -2.340
   77   1H5*    U   8          1H5*        U   8  -4.518  -1.440  -8.223
   78   2H5*    U   8          2H5*        U   8  -5.072   0.212  -8.502
   79    H4*    U   8           H4*        U   8  -6.440  -0.943  -6.832
   80    H3*    U   8           H3*        U   8  -4.870   1.430  -5.766
   81    H2*    U   8           H2*        U   8  -6.014   1.055  -3.719
   82   2HO*    U   8          2HO*        U   8  -8.026   0.689  -4.604
   83    H1*    U   8           H1*        U   8  -5.818  -1.623  -3.668
   84    H3     U   8           H3         U   8  -3.076   0.062  -0.423
   85    H5     U   8           H5         U   8  -0.743   0.002  -3.906
   86    H6     U   8           H6         U   8  -2.709  -0.540  -5.187
   87   1H5*    G   9          1H5*        G   9  -8.494   4.550  -3.951
   88   2H5*    G   9          2H5*        G   9  -6.829   4.117  -3.609
   89    H4*    G   9           H4*        G   9  -9.309   2.921  -2.298
   90    H3*    G   9           H3*        G   9  -7.171   4.897  -1.605
   91    H2*    G   9           H2*        G   9  -6.998   4.090   0.661
   92   2HO*    G   9          2HO*        G   9  -9.303   3.677   0.843
   93    H1*    G   9           H1*        G   9  -6.758   1.538   0.014
   94    H8     G   9           H8         G   9  -5.350   2.863  -3.109
   95    H1     G   9           H1         G   9  -1.523   4.020   1.937
   96   1H2     G   9          1H2         G   9  -2.752   3.944   3.772
   97   2H2     G   9          2H2         G   9  -4.384   3.266   3.685
   98   1H5*    A  10          1H5*        A  10  -9.551   5.211   1.922
   99   2H5*    A  10          2H5*        A  10  -9.900   6.924   2.224
  100    H4*    A  10           H4*        A  10  -8.685   5.867   4.092
  101    H3*    A  10           H3*        A  10  -7.208   8.080   2.637
  102    H2*    A  10           H2*        A  10  -5.487   7.820   4.287
  103   2HO*    A  10          2HO*        A  10  -7.029   7.338   6.016
  104    H1*    A  10           H1*        A  10  -5.267   5.206   4.073
  105    H8     A  10           H8         A  10  -6.299   6.024   0.608
  106   1H6     A  10          1H6         A  10  -0.397   7.515  -0.364
  107   2H6     A  10          2H6         A  10  -1.964   7.202  -1.110
  108    H2     A  10           H2         A  10  -1.014   7.311   3.981
  109   1H5*    U  11          1H5*        U  11  -6.699   8.735   6.848
  110   2H5*    U  11          2H5*        U  11  -6.863  10.462   7.188
  111    H4*    U  11           H4*        U  11  -4.650   9.521   7.858
  112    H3*    U  11           H3*        U  11  -4.618  11.533   5.609
  113    H2*    U  11           H2*        U  11  -2.233  11.644   5.944
  114   2HO*    U  11          2HO*        U  11  -2.247  11.189   8.289
  115    H1*    U  11           H1*        U  11  -1.979   9.026   5.854
  116    H3     U  11           H3         U  11  -0.601  10.732   1.887
  117    H5     U  11           H5         U  11  -4.731  10.118   1.430
  118    H6     U  11           H6         U  11  -4.880   9.686   3.774
  119   1H5*    A  12          1H5*        A  12  -2.749  14.806   9.070
  120   2H5*    A  12          2H5*        A  12  -2.828  14.160   7.428
  121    H4*    A  12           H4*        A  12  -0.374  14.130   9.241
  122    H3*    A  12           H3*        A  12  -1.301  15.851   6.942
  123    H2*    A  12           H2*        A  12   0.960  15.959   6.132
  124   2HO*    A  12          2HO*        A  12   1.795  16.051   8.349
  125    H1*    A  12           H1*        A  12   1.553  13.463   6.369
  126    H8     A  12           H8         A  12  -2.107  13.582   5.539
  127   1H6     A  12          1H6         A  12  -0.238  13.474  -0.330
  128   2H6     A  12          2H6         A  12  -1.635  13.180   0.730
  129    H2     A  12           H2         A  12   3.305  13.992   2.121
  130   1H5*    C  13          1H5*        C  13   2.331  17.526   8.375
  131   2H5*    C  13          2H5*        C  13   2.153  19.307   8.504
  132    H4*    C  13           H4*        C  13   4.107  18.836   7.199
  133    H3*    C  13           H3*        C  13   1.927  19.709   5.341
  134    H2*    C  13           H2*        C  13   3.808  19.648   3.735
  135   2HO*    C  13          2HO*        C  13   5.362  20.415   5.224
  136    H1*    C  13           H1*        C  13   4.611  17.206   4.369
  137   1H4     C  13          1H4         C  13   0.035  16.216   0.094
  138   2H4     C  13          2H4         C  13  -1.178  16.417   1.352
  139    H5     C  13           H5         C  13  -0.691  17.056   3.572
  140    H6     C  13           H6         C  13   0.999  17.603   5.114
  141   1H5*    A  14          1H5*        A  14   5.594  22.142   4.846
  142   2H5*    A  14          2H5*        A  14   5.139  23.714   4.166
  143    H4*    A  14           H4*        A  14   6.731  22.398   2.737
  144    H3*    A  14           H3*        A  14   3.993  22.899   1.572
  145    H2*    A  14           H2*        A  14   4.914  22.029  -0.532
  146   2HO*    A  14          2HO*        A  14   7.147  22.756  -0.175
  147    H1*    A  14           H1*        A  14   5.729  19.878   0.625
  148    H8     A  14           H8         A  14   2.678  20.733   2.687
  149   1H6     A  14          1H6         A  14  -0.429  18.001  -1.922
  150   2H6     A  14          2H6         A  14  -0.527  18.697  -0.308
  151    H2     A  14           H2         A  14   3.738  18.515  -3.246
  152   1H5*    A  15          1H5*        A  15   6.937  26.049  -1.771
  153   2H5*    A  15          2H5*        A  15   5.426  25.232  -1.360
  154    H4*    A  15           H4*        A  15   7.602  23.941  -3.074
  155    H3*    A  15           H3*        A  15   6.301  26.019  -4.060
  156    H2*    A  15           H2*        A  15   4.204  25.425  -3.054
  157   2HO*    A  15          2HO*        A  15   4.234  25.578  -5.684
  158    H1*    A  15           H1*        A  15   4.559  22.814  -4.431
  159    H8     A  15           H8         A  15   3.910  23.788  -0.923
  160   1H6     A  15          1H6         A  15  -1.543  20.879  -1.619
  161   2H6     A  15          2H6         A  15  -0.569  21.832  -0.446
  162    H2     A  15           H2         A  15   0.651  20.595  -5.320
  163   1H5*    U  16          1H5*        U  16   5.167  24.075  -9.280
  164   2H5*    U  16          2H5*        U  16   3.826  24.886  -8.449
  165    H4*    U  16           H4*        U  16   3.041  22.966  -9.763
  166    H3*    U  16           H3*        U  16   2.681  22.942  -6.806
  167    H2*    U  16           H2*        U  16   2.027  20.646  -6.810
  168   2HO*    U  16          2HO*        U  16   0.564  20.874  -8.553
  169    H1*    U  16           H1*        U  16   3.523  19.670  -8.768
  170    H3     U  16           H3         U  16   6.848  17.913  -6.370
  171    H5     U  16           H5         U  16   5.455  20.979  -3.907
  172    H6     U  16           H6         U  16   3.946  21.661  -5.664
  173   1H5*    U  17          1H5*        U  17  -2.203  21.390  -8.571
  174   2H5*    U  17          2H5*        U  17  -2.481  21.739  -6.892
  175    H4*    U  17           H4*        U  17  -1.284  19.097  -7.818
  176    H3*    U  17           H3*        U  17  -4.020  19.919  -8.174
  177    H2*    U  17           H2*        U  17  -5.155  19.127  -6.323
  178   2HO*    U  17          2HO*        U  17  -4.074  16.983  -7.143
  179    H1*    U  17           H1*        U  17  -3.183  18.585  -4.462
  180    H3     U  17           H3         U  17  -3.538  22.497  -2.118
  181    H5     U  17           H5         U  17  -5.222  23.422  -5.828
  182    H6     U  17           H6         U  17  -4.638  21.251  -6.610
  183   1H5*    U  18          1H5*        U  18  -1.443  15.724  -9.727
  184   2H5*    U  18          2H5*        U  18  -1.234  16.693  -8.305
  185    H4*    U  18           H4*        U  18   0.839  16.713 -10.533
  186    H3*    U  18           H3*        U  18   0.308  14.562  -8.643
  187    H2*    U  18           H2*        U  18   2.126  14.773  -7.175
  188   2HO*    U  18          2HO*        U  18   3.688  14.763  -8.889
  189    H1*    U  18           H1*        U  18   2.658  17.410  -7.262
  190    H3     U  18           H3         U  18   0.375  18.565  -3.612
  191    H5     U  18           H5         U  18  -1.883  15.372  -5.174
  192    H6     U  18           H6         U  18  -0.380  15.250  -6.961
  193   1H5*    G  19          1H5*        G  19   4.281  11.184  -8.619
  194   2H5*    G  19          2H5*        G  19   3.140  11.864  -7.475
  195    H4*    G  19           H4*        G  19   5.963  12.888  -7.972
  196    H3*    G  19           H3*        G  19   4.752  11.021  -5.974
  197    H2*    G  19           H2*        G  19   5.595  12.111  -4.090
  198   2HO*    G  19          2HO*        G  19   7.717  12.235  -4.932
  199    H1*    G  19           H1*        G  19   5.483  14.668  -4.880
  200    H8     G  19           H8         G  19   2.401  12.754  -5.903
  201    H1     G  19           H1         G  19   2.115  15.784  -0.253
  202   1H2     G  19          1H2         G  19   4.149  16.513   0.291
  203   2H2     G  19          2H2         G  19   5.450  16.299  -0.869
  204   1H5*    A  20          1H5*        A  20   7.959   8.662  -3.284
  205   2H5*    A  20          2H5*        A  20   6.295   9.206  -3.264
  206    H4*    A  20           H4*        A  20   8.656  10.604  -1.917
  207    H3*    A  20           H3*        A  20   6.465   8.716  -1.132
  208    H2*    A  20           H2*        A  20   6.116   9.799   0.974
  209   2HO*    A  20          2HO*        A  20   8.336  10.161   1.384
  210    H1*    A  20           H1*        A  20   5.988  12.257   0.029
  211    H8     A  20           H8         A  20   4.857  10.529  -2.986
  212   1H6     A  20          1H6         A  20  -0.702   9.951  -0.317
  213   2H6     A  20          2H6         A  20   0.204   9.861  -1.821
  214    H2     A  20           H2         A  20   2.206  10.959   2.832
  215   1H5*    U  21          1H5*        U  21   8.072   6.320   3.166
  216   2H5*    U  21          2H5*        U  21   6.565   6.430   2.278
  217    H4*    U  21           H4*        U  21   7.463   8.160   4.622
  218    H3*    U  21           H3*        U  21   5.475   6.054   3.930
  219    H2*    U  21           H2*        U  21   3.726   6.973   5.213
  220   2HO*    U  21          2HO*        U  21   5.068   7.655   6.965
  221    H1*    U  21           H1*        U  21   3.943   9.420   4.279
  222    H3     U  21           H3         U  21   0.695   7.152   1.925
  223    H5     U  21           H5         U  21   4.121   7.087  -0.459
  224    H6     U  21           H6         U  21   5.384   7.952   1.404
  225   1H5*    C  22          1H5*        C  22   3.978   3.689   8.271
  226   2H5*    C  22          2H5*        C  22   3.529   3.678   6.576
  227    H4*    C  22           H4*        C  22   2.371   5.432   8.782
  228    H3*    C  22           H3*        C  22   1.529   3.155   7.043
  229    H2*    C  22           H2*        C  22  -0.695   3.980   6.788
  230   2HO*    C  22          2HO*        C  22  -0.741   4.811   8.980
  231    H1*    C  22           H1*        C  22   0.036   6.444   6.043
  232   1H4     C  22          1H4         C  22   0.551   3.418   0.630
  233   2H4     C  22          2H4         C  22   2.303   3.406   0.769
  234    H5     C  22           H5         C  22   3.446   4.121   2.837
  235    H6     C  22           H6         C  22   3.046   4.997   5.062
  236   1H5*    A  23          1H5*        A  23  -1.841   2.918   9.831
  237   2H5*    A  23          2H5*        A  23  -1.926   1.218  10.335
  238    H4*    A  23           H4*        A  23  -4.018   1.965   9.276
  239    H3*    A  23           H3*        A  23  -2.472  -0.049   7.650
  240    H2*    A  23           H2*        A  23  -4.505  -0.153   6.263
  241   2HO*    A  23          2HO*        A  23  -5.964   0.612   8.191
  242    H1*    A  23           H1*        A  23  -4.414   2.415   5.855
  243    H8     A  23           H8         A  23  -0.771   2.027   6.433
  244   1H6     A  23          1H6         A  23  -0.536   0.046   0.608
  245   2H6     A  23          2H6         A  23   0.383   0.600   2.026
  246    H2     A  23           H2         A  23  -4.717  -0.329   1.937
  247   1H5*    G  24          1H5*        G  24  -6.556  -0.913   6.599
  248   2H5*    G  24          2H5*        G  24  -7.461  -1.997   7.652
  249    H4*    G  24           H4*        G  24  -7.678  -2.798   5.452
  250    H3*    G  24           H3*        G  24  -6.528  -4.297   7.513
  251    H2*    G  24           H2*        G  24  -4.409  -4.401   6.861
  252   2HO*    G  24          2HO*        G  24  -5.866  -6.346   5.614
  253    H1*    G  24           H1*        G  24  -4.984  -4.363   3.914
  254    H8     G  24           H8         G  24  -3.588  -2.033   6.502
  255    H1     G  24           H1         G  24   0.659  -4.286   2.180
  256   1H2     G  24          1H2         G  24  -0.400  -5.866   0.943
  257   2H2     G  24          2H2         G  24  -2.032  -6.318   1.392
  258   1H5*    U  25          1H5*        U  25 -10.264  -6.332   3.721
  259   2H5*    U  25          2H5*        U  25  -8.546  -6.129   3.365
  260    H4*    U  25           H4*        U  25 -10.752  -4.326   2.266
  261    H3*    U  25           H3*        U  25  -9.979  -6.997   1.457
  262    H2*    U  25           H2*        U  25  -8.797  -6.600  -0.514
  263   2HO*    U  25          2HO*        U  25 -10.580  -5.429  -1.422
  264    H1*    U  25           H1*        U  25  -7.788  -4.108  -0.158
  265    H3     U  25           H3         U  25  -3.775  -5.137   1.540
  266    H5     U  25           H5         U  25  -6.009  -8.588   2.289
  267    H6     U  25           H6         U  25  -7.988  -7.409   1.550
  268   1H5*    A  26          1H5*        A  26 -11.235  -9.136  -2.213
  269   2H5*    A  26          2H5*        A  26  -9.861  -8.500  -1.302
  270    H4*    A  26           H4*        A  26 -10.627  -7.608  -4.115
  271    H3*    A  26           H3*        A  26  -8.643  -9.666  -3.115
  272    H2*    A  26           H2*        A  26  -7.154  -9.005  -4.861
  273   2HO*    A  26          2HO*        A  26  -9.018  -8.668  -6.342
  274    H1*    A  26           H1*        A  26  -7.365  -6.362  -4.454
  275    H8     A  26           H8         A  26  -7.761  -8.348  -1.280
  276   1H6     A  26          1H6         A  26  -1.648  -7.409  -0.724
  277   2H6     A  26          2H6         A  26  -3.105  -7.969   0.126
  278    H2     A  26           H2         A  26  -2.797  -6.293  -4.781
  279   1H5*    U  27          1H5*        U  27  -8.418 -10.093  -7.182
  280   2H5*    U  27          2H5*        U  27  -8.297 -11.784  -7.658
  281    H4*    U  27           H4*        U  27  -6.376 -10.526  -8.445
  282    H3*    U  27           H3*        U  27  -5.646 -12.502  -6.261
  283    H2*    U  27           H2*        U  27  -3.366 -11.904  -6.775
  284   2HO*    U  27          2HO*        U  27  -3.791 -11.753  -9.046
  285    H1*    U  27           H1*        U  27  -3.769  -9.260  -6.777
  286    H3     U  27           H3         U  27  -1.634 -10.243  -2.882
  287    H5     U  27           H5         U  27  -5.674 -11.019  -2.084
  288    H6     U  27           H6         U  27  -6.160 -10.741  -4.429
  289   1H5*    A  28          1H5*        A  28  -3.129 -13.235  -9.599
  290   2H5*    A  28          2H5*        A  28  -2.891 -14.972  -9.824
  291    H4*    A  28           H4*        A  28  -0.759 -13.810  -9.648
  292    H3*    A  28           H3*        A  28  -1.320 -15.652  -7.295
  293    H2*    A  28           H2*        A  28   0.907 -15.082  -6.569
  294   2HO*    A  28          2HO*        A  28   1.698 -15.064  -8.785
  295    H1*    A  28           H1*        A  28   0.630 -12.444  -6.861
  296    H8     A  28           H8         A  28  -2.823 -13.592  -5.947
  297   1H6     A  28          1H6         A  28  -0.799 -13.243  -0.103
  298   2H6     A  28          2H6         A  28  -2.202 -13.449  -1.153
  299    H2     A  28           H2         A  28   2.719 -13.063  -2.719
  300   1H5*    U  29          1H5*        U  29   2.526 -16.536  -8.721
  301   2H5*    U  29          2H5*        U  29   2.851 -18.272  -8.708
  302    H4*    U  29           H4*        U  29   4.510 -17.030  -7.401
  303    H3*    U  29           H3*        U  29   2.753 -18.850  -5.705
  304    H2*    U  29           H2*        U  29   4.246 -18.200  -3.903
  305   2HO*    U  29          2HO*        U  29   6.108 -18.202  -5.259
  306    H1*    U  29           H1*        U  29   4.148 -15.586  -4.389
  307    H3     U  29           H3         U  29   1.550 -16.514  -0.749
  308    H5     U  29           H5         U  29  -1.021 -16.955  -4.007
  309    H6     U  29           H6         U  29   0.868 -16.756  -5.499
  310   1H5*    C  30          1H5*        C  30   6.785 -19.602  -4.797
  311   2H5*    C  30          2H5*        C  30   7.102 -21.320  -4.556
  312    H4*    C  30           H4*        C  30   7.760 -19.994  -2.602
  313    H3*    C  30           H3*        C  30   5.419 -21.873  -2.064
  314    H2*    C  30           H2*        C  30   5.717 -21.182   0.251
  315   2HO*    C  30          2HO*        C  30   8.087 -21.007  -0.147
  316    H1*    C  30           H1*        C  30   5.738 -18.563  -0.288
  317   1H4     C  30          1H4         C  30  -0.308 -19.951   0.460
  318   2H4     C  30          2H4         C  30  -0.555 -20.091  -1.289
  319    H5     C  30           H5         C  30   1.313 -20.128  -2.835
  320    H6     C  30           H6         C  30   3.696 -19.863  -3.004
  321   1H5*    C  31          1H5*        C  31   8.216 -22.374   0.971
  322   2H5*    C  31          2H5*        C  31   8.579 -24.087   1.197
  323    H4*    C  31           H4*        C  31   7.927 -23.100   3.331
  324    H3*    C  31           H3*        C  31   5.832 -24.953   2.123
  325    H2*    C  31           H2*        C  31   4.649 -24.750   4.189
  326   2HO*    C  31          2HO*        C  31   6.691 -24.723   5.433
  327    H1*    C  31           H1*        C  31   4.909 -22.041   4.324
  328   1H4     C  31          1H4         C  31  -0.522 -23.124   1.433
  329   2H4     C  31          2H4         C  31   0.245 -23.092  -0.164
  330    H5     C  31           H5         C  31   2.654 -23.020  -0.439
  331    H6     C  31           H6         C  31   4.734 -22.838   0.739
  332    H3T    C  31           H3T        C  31   7.812 -25.927   2.668
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1 -10.460 -21.487   7.749
    2   2H5*    G   1          2H5*        G   1  -9.794 -19.914   8.239
    3    H4*    G   1           H4*        G   1  -8.288 -21.645   8.991
    4    H3*    G   1           H3*        G   1  -7.240 -20.099   6.603
    5    H2*    G   1           H2*        G   1  -5.169 -21.305   6.924
    6   2HO*    G   1          2HO*        G   1  -5.313 -21.288   9.245
    7    H1*    G   1           H1*        G   1  -6.332 -23.703   7.082
    8    H8     G   1           H8         G   1  -8.717 -22.020   4.795
    9    H1     G   1           H1         G   1  -3.036 -23.150   2.029
   10   1H2     G   1          1H2         G   1  -1.550 -23.662   3.600
   11   2H2     G   1          2H2         G   1  -2.017 -23.771   5.287
   12    H5T    G   1           H5T        G   1  -9.033 -19.623   6.127
   13   1H5*    G   2          1H5*        G   2  -4.240 -20.045   9.491
   14   2H5*    G   2          2H5*        G   2  -3.539 -18.432   9.674
   15    H4*    G   2           H4*        G   2  -1.811 -20.126   9.247
   16    H3*    G   2           H3*        G   2  -2.201 -18.081   7.046
   17    H2*    G   2           H2*        G   2  -0.260 -19.119   5.987
   18   2HO*    G   2          2HO*        G   2   0.755 -19.504   8.087
   19    H1*    G   2           H1*        G   2  -1.143 -21.623   6.266
   20    H8     G   2           H8         G   2  -4.355 -19.812   5.799
   21    H1     G   2           H1         G   2  -0.829 -20.101   0.429
   22   1H2     G   2          1H2         G   2   1.233 -20.728   0.937
   23   2H2     G   2          2H2         G   2   1.673 -21.137   2.590
   24   1H5*    A   3          1H5*        A   3   1.936 -18.448   7.790
   25   2H5*    A   3          2H5*        A   3   2.729 -16.878   7.905
   26    H4*    A   3           H4*        A   3   3.831 -18.329   6.253
   27    H3*    A   3           H3*        A   3   2.468 -15.851   5.133
   28    H2*    A   3           H2*        A   3   3.393 -16.513   3.002
   29   2HO*    A   3          2HO*        A   3   5.384 -17.295   4.044
   30    H1*    A   3           H1*        A   3   2.656 -19.075   3.146
   31    H8     A   3           H8         A   3  -0.125 -17.390   4.974
   32   1H6     A   3          1H6         A   3  -2.457 -16.026  -0.604
   33   2H6     A   3          2H6         A   3  -2.748 -16.035   1.141
   34    H2     A   3           H2         A   3   1.708 -17.442  -1.174
   35   1H5*    U   4          1H5*        U   4   6.315 -16.081   3.495
   36   2H5*    U   4          2H5*        U   4   7.115 -14.511   3.398
   37    H4*    U   4           H4*        U   4   6.953 -15.592   1.192
   38    H3*    U   4           H3*        U   4   5.277 -13.060   1.462
   39    H2*    U   4           H2*        U   4   4.896 -13.346  -0.921
   40   2HO*    U   4          2HO*        U   4   7.073 -14.147  -1.277
   41    H1*    U   4           H1*        U   4   4.287 -15.959  -0.755
   42    H3     U   4           H3         U   4   0.483 -13.521  -1.384
   43    H5     U   4           H5         U   4   1.020 -13.642   2.778
   44    H6     U   4           H6         U   4   3.179 -14.636   2.433
   45   1H5*    A   5          1H5*        A   5   7.522 -12.824  -2.024
   46   2H5*    A   5          2H5*        A   5   8.245 -11.234  -2.245
   47    H4*    A   5           H4*        A   5   6.966 -11.914  -4.211
   48    H3*    A   5           H3*        A   5   5.815  -9.513  -2.735
   49    H2*    A   5           H2*        A   5   4.210  -9.364  -4.460
   50   2HO*    A   5          2HO*        A   5   5.689  -9.824  -6.159
   51    H1*    A   5           H1*        A   5   3.621 -11.986  -4.579
   52    H8     A   5           H8         A   5   4.316 -11.435  -0.939
   53   1H6     A   5          1H6         A   5  -1.594  -9.546  -0.576
   54   2H6     A   5          2H6         A   5  -0.173 -10.044   0.346
   55    H2     A   5           H2         A   5  -0.447  -9.654  -4.852
   56   1H5*    U   6          1H5*        U   6   6.171  -5.601  -5.980
   57   2H5*    U   6          2H5*        U   6   5.126  -6.137  -4.664
   58    H4*    U   6           H4*        U   6   4.684  -6.621  -7.646
   59    H3*    U   6           H3*        U   6   3.589  -4.811  -5.526
   60    H2*    U   6           H2*        U   6   1.346  -5.061  -6.338
   61   2HO*    U   6          2HO*        U   6   1.872  -5.005  -8.559
   62    H1*    U   6           H1*        U   6   1.399  -7.712  -6.591
   63    H3     U   6           H3         U   6  -0.772  -6.402  -2.753
   64    H5     U   6           H5         U   6   3.183  -7.289  -1.622
   65    H6     U   6           H6         U   6   3.778  -7.487  -3.950
   66   1H5*    A   7          1H5*        A   7   1.177  -0.865  -7.708
   67   2H5*    A   7          2H5*        A   7   1.335  -1.634  -6.130
   68    H4*    A   7           H4*        A   7  -0.811  -2.181  -8.227
   69    H3*    A   7           H3*        A   7  -0.580  -1.085  -5.436
   70    H2*    A   7           H2*        A   7  -2.742  -1.904  -4.832
   71   2HO*    A   7          2HO*        A   7  -3.404  -1.927  -7.353
   72    H1*    A   7           H1*        A   7  -2.088  -4.374  -5.532
   73    H8     A   7           H8         A   7   1.378  -3.423  -5.044
   74   1H6     A   7          1H6         A   7   0.363  -3.288   1.057
   75   2H6     A   7          2H6         A   7   1.604  -3.306  -0.206
   76    H2     A   7           H2         A   7  -3.559  -3.430  -0.952
   77   1H5*    U   8          1H5*        U   8  -4.368   2.133  -5.987
   78   2H5*    U   8          2H5*        U   8  -3.031   1.315  -5.184
   79    H4*    U   8           H4*        U   8  -6.000   0.729  -4.777
   80    H3*    U   8           H3*        U   8  -3.794   1.911  -3.078
   81    H2*    U   8           H2*        U   8  -5.175   1.203  -1.146
   82   2HO*    U   8          2HO*        U   8  -7.233   1.227  -2.652
   83    H1*    U   8           H1*        U   8  -5.045  -1.283  -2.010
   84    H3     U   8           H3         U   8  -1.484  -0.163   0.831
   85    H5     U   8           H5         U   8  -0.041   0.031  -3.100
   86    H6     U   8           H6         U   8  -2.299  -0.149  -3.895
   87   1H5*    G   9          1H5*        G   9  -8.392   2.267  -0.986
   88   2H5*    G   9          2H5*        G   9  -8.766   4.010  -0.926
   89    H4*    G   9           H4*        G   9  -8.527   3.052   1.338
   90    H3*    G   9           H3*        G   9  -6.223   4.834   0.519
   91    H2*    G   9           H2*        G   9  -5.581   4.739   2.867
   92   2HO*    G   9          2HO*        G   9  -7.758   4.488   3.761
   93    H1*    G   9           H1*        G   9  -5.643   2.091   2.831
   94    H8     G   9           H8         G   9  -4.727   3.002  -0.734
   95    H1     G   9           H1         G   9   0.044   3.805   3.504
   96   1H2     G   9          1H2         G   9  -0.798   3.855   5.545
   97   2H2     G   9          2H2         G   9  -2.506   3.562   5.822
   98   1H5*    A  10          1H5*        A  10  -7.992   8.118   4.091
   99   2H5*    A  10          2H5*        A  10  -6.742   7.383   3.091
  100    H4*    A  10           H4*        A  10  -7.106   6.829   6.067
  101    H3*    A  10           H3*        A  10  -5.395   8.817   4.562
  102    H2*    A  10           H2*        A  10  -3.597   8.404   6.125
  103   2HO*    A  10          2HO*        A  10  -5.162   8.128   7.920
  104    H1*    A  10           H1*        A  10  -3.699   5.757   5.983
  105    H8     A  10           H8         A  10  -4.938   6.592   2.589
  106   1H6     A  10          1H6         A  10   1.018   7.468   1.050
  107   2H6     A  10          2H6         A  10  -0.621   7.299   0.422
  108    H2     A  10           H2         A  10   0.757   7.432   5.437
  109   1H5*    U  11          1H5*        U  11  -4.475   9.527   8.572
  110   2H5*    U  11          2H5*        U  11  -4.596  11.261   8.897
  111    H4*    U  11           H4*        U  11  -2.355  10.378   9.480
  112    H3*    U  11           H3*        U  11  -2.556  12.342   7.184
  113    H2*    U  11           H2*        U  11  -0.135  12.341   7.176
  114   2HO*    U  11          2HO*        U  11   0.019  12.291   9.484
  115    H1*    U  11           H1*        U  11   0.151   9.678   7.407
  116    H3     U  11           H3         U  11   1.303  10.827   3.153
  117    H5     U  11           H5         U  11  -2.878  10.414   3.064
  118    H6     U  11           H6         U  11  -2.847  10.169   5.452
  119   1H5*    A  12          1H5*        A  12   0.515  13.805  10.185
  120   2H5*    A  12          2H5*        A  12   0.242  15.557  10.256
  121    H4*    A  12           H4*        A  12   2.600  15.080   9.789
  122    H3*    A  12           H3*        A  12   1.024  16.318   7.515
  123    H2*    A  12           H2*        A  12   3.157  16.476   6.374
  124   2HO*    A  12          2HO*        A  12   4.371  17.013   8.251
  125    H1*    A  12           H1*        A  12   3.972  14.031   6.957
  126    H8     A  12           H8         A  12   0.230  14.123   6.377
  127   1H6     A  12          1H6         A  12   1.669  13.062   0.454
  128   2H6     A  12          2H6         A  12   0.348  13.082   1.629
  129    H2     A  12           H2         A  12   5.411  13.864   2.640
  130   1H5*    C  13          1H5*        C  13   4.771  18.334   8.423
  131   2H5*    C  13          2H5*        C  13   4.556  20.112   8.382
  132    H4*    C  13           H4*        C  13   6.535  19.476   7.092
  133    H3*    C  13           H3*        C  13   4.200  20.421   5.436
  134    H2*    C  13           H2*        C  13   5.647  20.126   3.524
  135   2HO*    C  13          2HO*        C  13   7.464  21.043   4.718
  136    H1*    C  13           H1*        C  13   6.806  17.811   4.298
  137   1H4     C  13          1H4         C  13   2.152  15.925   0.458
  138   2H4     C  13          2H4         C  13   0.960  16.215   1.693
  139    H5     C  13           H5         C  13   1.489  17.147   3.877
  140    H6     C  13           H6         C  13   3.238  18.064   5.228
  141   1H5*    A  14          1H5*        A  14   7.517  22.527   3.606
  142   2H5*    A  14          2H5*        A  14   6.867  24.100   3.107
  143    H4*    A  14           H4*        A  14   7.573  22.739   1.160
  144    H3*    A  14           H3*        A  14   4.586  23.074   1.395
  145    H2*    A  14           H2*        A  14   4.572  22.162  -0.920
  146   2HO*    A  14          2HO*        A  14   6.979  22.909  -1.228
  147    H1*    A  14           H1*        A  14   5.838  20.045  -0.073
  148    H8     A  14           H8         A  14   4.064  21.171   3.046
  149   1H6     A  14          1H6         A  14  -0.855  18.224   0.722
  150   2H6     A  14          2H6         A  14  -0.182  19.005   2.160
  151    H2     A  14           H2         A  14   2.203  18.429  -2.433
  152   1H5*    A  15          1H5*        A  15   6.206  23.087  -3.043
  153   2H5*    A  15          2H5*        A  15   6.098  24.637  -3.852
  154    H4*    A  15           H4*        A  15   4.694  22.874  -4.865
  155    H3*    A  15           H3*        A  15   3.952  25.505  -4.373
  156    H2*    A  15           H2*        A  15   2.690  25.121  -2.518
  157   2HO*    A  15          2HO*        A  15   0.992  24.672  -4.747
  158    H1*    A  15           H1*        A  15   1.580  22.542  -3.672
  159    H8     A  15           H8         A  15   3.346  23.896  -0.509
  160   1H6     A  15          1H6         A  15  -1.571  21.676   2.536
  161   2H6     A  15          2H6         A  15  -0.015  22.477   2.704
  162    H2     A  15           H2         A  15  -2.046  20.747  -1.760
  163   1H5*    U  16          1H5*        U  16   0.133  21.204  -5.772
  164   2H5*    U  16          2H5*        U  16  -0.125  21.988  -7.288
  165    H4*    U  16           H4*        U  16  -2.273  21.590  -6.369
  166    H3*    U  16           H3*        U  16  -1.547  24.501  -5.928
  167    H2*    U  16           H2*        U  16  -3.492  24.784  -4.741
  168   2HO*    U  16          2HO*        U  16  -4.582  23.613  -6.631
  169    H1*    U  16           H1*        U  16  -3.826  22.096  -3.841
  170    H3     U  16           H3         U  16  -3.991  24.473   0.048
  171    H5     U  16           H5         U  16  -0.274  25.480  -1.641
  172    H6     U  16           H6         U  16  -0.798  24.105  -3.486
  173   1H5*    U  17          1H5*        U  17  -1.889  21.798 -10.714
  174   2H5*    U  17          2H5*        U  17  -2.874  21.568  -9.272
  175    H4*    U  17           H4*        U  17   0.003  20.619  -9.335
  176    H3*    U  17           H3*        U  17  -1.986  19.559 -11.081
  177    H2*    U  17           H2*        U  17  -2.959  17.788  -9.906
  178   2HO*    U  17          2HO*        U  17  -1.002  16.667  -9.915
  179    H1*    U  17           H1*        U  17  -2.320  18.221  -7.282
  180    H3     U  17           H3         U  17  -5.905  20.827  -6.042
  181    H5     U  17           H5         U  17  -6.200  20.523 -10.210
  182    H6     U  17           H6         U  17  -4.045  19.482 -10.253
  183   1H5*    U  18          1H5*        U  18   1.062  15.298 -10.543
  184   2H5*    U  18          2H5*        U  18   1.385  16.800  -9.694
  185    H4*    U  18           H4*        U  18   3.478  15.585 -11.519
  186    H3*    U  18           H3*        U  18   2.543  14.418  -9.031
  187    H2*    U  18           H2*        U  18   4.248  15.000  -7.527
  188   2HO*    U  18          2HO*        U  18   5.879  14.106  -8.896
  189    H1*    U  18           H1*        U  18   5.148  17.354  -8.505
  190    H3     U  18           H3         U  18   2.463  20.185  -6.251
  191    H5     U  18           H5         U  18   0.359  16.536  -6.208
  192    H6     U  18           H6         U  18   1.961  15.622  -7.660
  193   1H5*    G  19          1H5*        G  19   6.232  10.550  -8.082
  194   2H5*    G  19          2H5*        G  19   5.072  11.245  -6.954
  195    H4*    G  19           H4*        G  19   7.943  12.166  -7.390
  196    H3*    G  19           H3*        G  19   6.537  10.490  -5.305
  197    H2*    G  19           H2*        G  19   7.551  11.606  -3.513
  198   2HO*    G  19          2HO*        G  19   9.652  11.586  -4.474
  199    H1*    G  19           H1*        G  19   7.440  14.118  -4.443
  200    H8     G  19           H8         G  19   4.316  12.248  -5.459
  201    H1     G  19           H1         G  19   4.096  15.174   0.244
  202   1H2     G  19          1H2         G  19   6.100  16.056   0.702
  203   2H2     G  19          2H2         G  19   7.450  15.729  -0.353
  204   1H5*    A  20          1H5*        A  20   9.167   7.991  -2.416
  205   2H5*    A  20          2H5*        A  20   7.651   8.875  -2.565
  206    H4*    A  20           H4*        A  20  10.158   9.989  -1.229
  207    H3*    A  20           H3*        A  20   7.798   8.389  -0.297
  208    H2*    A  20           H2*        A  20   7.717   9.656   1.770
  209   2HO*    A  20          2HO*        A  20  10.112   9.876   1.771
  210    H1*    A  20           H1*        A  20   7.704  12.031   0.565
  211    H8     A  20           H8         A  20   6.262  10.268  -2.250
  212   1H6     A  20          1H6         A  20   0.932   9.814   0.921
  213   2H6     A  20          2H6         A  20   1.697   9.700  -0.653
  214    H2     A  20           H2         A  20   4.151  10.778   3.805
  215   1H5*    U  21          1H5*        U  21   9.820   8.844   3.159
  216   2H5*    U  21          2H5*        U  21  10.275   7.300   3.893
  217    H4*    U  21           H4*        U  21   8.996   8.703   5.468
  218    H3*    U  21           H3*        U  21   7.726   6.106   4.522
  219    H2*    U  21           H2*        U  21   5.907   6.517   5.944
  220   2HO*    U  21          2HO*        U  21   7.141   7.256   7.719
  221    H1*    U  21           H1*        U  21   5.609   9.143   5.405
  222    H3     U  21           H3         U  21   2.246   6.773   3.373
  223    H5     U  21           H5         U  21   5.323   7.065   0.541
  224    H6     U  21           H6         U  21   6.736   7.954   2.245
  225   1H5*    C  22          1H5*        C  22   7.096   3.173   8.465
  226   2H5*    C  22          2H5*        C  22   6.402   3.504   6.884
  227    H4*    C  22           H4*        C  22   5.401   4.610   9.545
  228    H3*    C  22           H3*        C  22   4.686   2.359   7.695
  229    H2*    C  22           H2*        C  22   2.353   2.751   7.979
  230   2HO*    C  22          2HO*        C  22   2.455   3.169  10.226
  231    H1*    C  22           H1*        C  22   2.406   5.396   7.670
  232   1H4     C  22          1H4         C  22   1.807   3.109   1.812
  233   2H4     C  22          2H4         C  22   3.531   3.302   1.567
  234    H5     C  22           H5         C  22   5.062   3.975   3.341
  235    H6     C  22           H6         C  22   5.236   4.604   5.649
  236   1H5*    A  23          1H5*        A  23   1.569  -0.798  10.401
  237   2H5*    A  23          2H5*        A  23   1.945  -0.406   8.723
  238    H4*    A  23           H4*        A  23  -0.186   0.934  10.443
  239    H3*    A  23           H3*        A  23  -0.107  -1.008   8.164
  240    H2*    A  23           H2*        A  23  -2.115  -0.070   7.226
  241   2HO*    A  23          2HO*        A  23  -3.064   0.624   9.346
  242    H1*    A  23           H1*        A  23  -1.104   2.318   7.149
  243    H8     A  23           H8         A  23   2.182   0.878   7.173
  244   1H6     A  23          1H6         A  23   1.233  -0.933   1.301
  245   2H6     A  23          2H6         A  23   2.456  -0.725   2.572
  246    H2     A  23           H2         A  23  -2.681  -0.019   3.104
  247   1H5*    G  24          1H5*        G  24  -4.029  -0.598   7.301
  248   2H5*    G  24          2H5*        G  24  -5.145  -1.465   8.351
  249    H4*    G  24           H4*        G  24  -5.731  -2.063   6.159
  250    H3*    G  24           H3*        G  24  -4.968  -3.891   8.049
  251    H2*    G  24           H2*        G  24  -2.944  -4.522   7.300
  252   2HO*    G  24          2HO*        G  24  -4.688  -6.269   6.551
  253    H1*    G  24           H1*        G  24  -3.539  -4.212   4.406
  254    H8     G  24           H8         G  24  -1.573  -2.276   6.974
  255    H1     G  24           H1         G  24   1.924  -5.370   2.537
  256   1H2     G  24          1H2         G  24   0.511  -6.508   1.175
  257   2H2     G  24          2H2         G  24  -1.182  -6.573   1.593
  258   1H5*    U  25          1H5*        U  25  -8.949  -3.903   6.277
  259   2H5*    U  25          2H5*        U  25 -10.102  -5.130   5.721
  260    H4*    U  25           H4*        U  25  -9.607  -3.460   3.957
  261    H3*    U  25           H3*        U  25  -8.703  -6.296   3.431
  262    H2*    U  25           H2*        U  25  -8.090  -5.531   1.246
  263   2HO*    U  25          2HO*        U  25  -9.955  -4.263   0.899
  264    H1*    U  25           H1*        U  25  -6.991  -3.157   2.061
  265    H3     U  25           H3         U  25  -3.133  -5.229   1.100
  266    H5     U  25           H5         U  25  -4.855  -7.797   3.938
  267    H6     U  25           H6         U  25  -6.751  -6.296   4.063
  268   1H5*    A  26          1H5*        A  26 -11.178  -7.620  -0.928
  269   2H5*    A  26          2H5*        A  26  -9.501  -7.589  -0.401
  270    H4*    A  26           H4*        A  26 -10.835  -5.655  -2.345
  271    H3*    A  26           H3*        A  26  -8.931  -7.979  -2.543
  272    H2*    A  26           H2*        A  26  -7.596  -6.873  -4.180
  273   2HO*    A  26          2HO*        A  26  -9.581  -5.973  -5.194
  274    H1*    A  26           H1*        A  26  -7.457  -4.498  -2.953
  275    H8     A  26           H8         A  26  -7.687  -6.879  -0.086
  276   1H6     A  26          1H6         A  26  -1.564  -7.500  -0.738
  277   2H6     A  26          2H6         A  26  -2.941  -7.784   0.341
  278    H2     A  26           H2         A  26  -3.148  -5.683  -4.433
  279   1H5*    U  27          1H5*        U  27  -9.183  -7.335  -6.467
  280   2H5*    U  27          2H5*        U  27  -9.542  -8.834  -7.344
  281    H4*    U  27           H4*        U  27  -7.426  -7.962  -8.117
  282    H3*    U  27           H3*        U  27  -7.021 -10.409  -6.345
  283    H2*    U  27           H2*        U  27  -4.714 -10.247  -7.061
  284   2HO*    U  27          2HO*        U  27  -5.245  -9.595  -9.221
  285    H1*    U  27           H1*        U  27  -4.513  -7.607  -6.563
  286    H3     U  27           H3         U  27  -2.433  -9.875  -3.194
  287    H5     U  27           H5         U  27  -6.470  -9.730  -2.059
  288    H6     U  27           H6         U  27  -6.999  -8.834  -4.236
  289   1H5*    A  28          1H5*        A  28  -5.059 -11.200 -10.050
  290   2H5*    A  28          2H5*        A  28  -5.331 -12.880 -10.547
  291    H4*    A  28           H4*        A  28  -2.948 -12.388 -10.522
  292    H3*    A  28           H3*        A  28  -3.792 -14.305  -8.305
  293    H2*    A  28           H2*        A  28  -1.435 -14.473  -7.831
  294   2HO*    A  28          2HO*        A  28  -0.860 -14.389 -10.107
  295    H1*    A  28           H1*        A  28  -0.958 -11.838  -7.863
  296    H8     A  28           H8         A  28  -4.484 -12.113  -6.580
  297   1H6     A  28          1H6         A  28  -1.906 -13.065  -1.027
  298   2H6     A  28          2H6         A  28  -3.389 -12.669  -1.892
  299    H2     A  28           H2         A  28   1.274 -13.476  -4.085
  300   1H5*    U  29          1H5*        U  29  -0.490 -15.945 -10.287
  301   2H5*    U  29          2H5*        U  29  -0.620 -17.692 -10.494
  302    H4*    U  29           H4*        U  29   1.429 -17.066  -9.282
  303    H3*    U  29           H3*        U  29  -0.581 -18.606  -7.566
  304    H2*    U  29           H2*        U  29   1.219 -18.624  -5.947
  305   2HO*    U  29          2HO*        U  29   2.900 -18.874  -7.503
  306    H1*    U  29           H1*        U  29   1.746 -16.006  -6.142
  307    H3     U  29           H3         U  29  -0.628 -16.815  -2.318
  308    H5     U  29           H5         U  29  -3.526 -16.177  -5.275
  309    H6     U  29           H6         U  29  -1.793 -16.185  -6.940
  310   1H5*    C  30          1H5*        C  30   3.180 -20.450  -7.371
  311   2H5*    C  30          2H5*        C  30   3.068 -22.215  -7.365
  312    H4*    C  30           H4*        C  30   4.307 -21.370  -5.406
  313    H3*    C  30           H3*        C  30   1.627 -22.683  -4.735
  314    H2*    C  30           H2*        C  30   2.373 -22.451  -2.440
  315   2HO*    C  30          2HO*        C  30   4.642 -22.835  -3.134
  316    H1*    C  30           H1*        C  30   3.079 -19.865  -2.686
  317   1H4     C  30          1H4         C  30  -2.999 -19.592  -1.076
  318   2H4     C  30          2H4         C  30  -3.466 -19.438  -2.765
  319    H5     C  30           H5         C  30  -1.888 -19.812  -4.595
  320    H6     C  30           H6         C  30   0.411 -20.196  -5.130
  321   1H5*    C  31          1H5*        C  31   4.515 -24.287  -2.247
  322   2H5*    C  31          2H5*        C  31   4.443 -26.053  -2.258
  323    H4*    C  31           H4*        C  31   4.316 -25.267   0.046
  324    H3*    C  31           H3*        C  31   1.667 -26.296  -1.054
  325    H2*    C  31           H2*        C  31   0.865 -26.124   1.214
  326   2HO*    C  31          2HO*        C  31   2.966 -26.840   2.087
  327    H1*    C  31           H1*        C  31   1.923 -23.635   1.610
  328   1H4     C  31          1H4         C  31  -3.972 -22.726  -0.410
  329   2H4     C  31          2H4         C  31  -3.430 -22.679  -2.088
  330    H5     C  31           H5         C  31  -1.143 -23.216  -2.751
  331    H6     C  31           H6         C  31   1.036 -23.812  -1.940
  332    H3T    C  31           H3T        C  31   3.340 -27.828  -0.945
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -8.133 -23.011   8.426
    2   2H5*    G   1          2H5*        G   1  -7.521 -23.881   7.011
    3    H4*    G   1           H4*        G   1  -6.374 -24.128   9.829
    4    H3*    G   1           H3*        G   1  -5.597 -22.389   7.475
    5    H2*    G   1           H2*        G   1  -3.286 -22.669   8.184
    6   2HO*    G   1          2HO*        G   1  -3.737 -22.648  10.458
    7    H1*    G   1           H1*        G   1  -3.443 -25.332   8.383
    8    H8     G   1           H8         G   1  -5.963 -24.428   5.747
    9    H1     G   1           H1         G   1   0.101 -24.303   3.653
   10   1H2     G   1          1H2         G   1   1.486 -24.443   5.373
   11   2H2     G   1          2H2         G   1   0.888 -24.513   7.019
   12    H5T    G   1           H5T        G   1  -7.919 -25.837   8.199
   13   1H5*    G   2          1H5*        G   2  -3.431 -21.131  10.830
   14   2H5*    G   2          2H5*        G   2  -3.293 -19.367  10.936
   15    H4*    G   2           H4*        G   2  -1.080 -20.472  10.979
   16    H3*    G   2           H3*        G   2  -1.656 -18.780   8.532
   17    H2*    G   2           H2*        G   2   0.664 -19.246   7.896
   18   2HO*    G   2          2HO*        G   2   1.375 -19.159  10.150
   19    H1*    G   2           H1*        G   2   0.495 -21.894   8.335
   20    H8     G   2           H8         G   2  -2.942 -21.000   7.135
   21    H1     G   2           H1         G   2   1.499 -20.961   2.493
   22   1H2     G   2          1H2         G   2   3.518 -21.127   3.404
   23   2H2     G   2          2H2         G   2   3.731 -21.261   5.141
   24   1H5*    A   3          1H5*        A   3   2.172 -17.811   9.997
   25   2H5*    A   3          2H5*        A   3   2.456 -16.065  10.022
   26    H4*    A   3           H4*        A   3   4.229 -17.259   8.791
   27    H3*    A   3           H3*        A   3   2.477 -15.405   7.142
   28    H2*    A   3           H2*        A   3   3.969 -15.918   5.293
   29   2HO*    A   3          2HO*        A   3   5.851 -16.007   6.767
   30    H1*    A   3           H1*        A   3   3.927 -18.578   5.652
   31    H8     A   3           H8         A   3   0.494 -17.634   6.778
   32   1H6     A   3          1H6         A   3  -1.023 -17.217   0.789
   33   2H6     A   3          2H6         A   3  -1.632 -17.257   2.442
   34    H2     A   3           H2         A   3   3.401 -17.470   1.069
   35   1H5*    U   4          1H5*        U   4   6.436 -14.638   6.127
   36   2H5*    U   4          2H5*        U   4   6.788 -12.905   6.058
   37    H4*    U   4           H4*        U   4   7.356 -14.027   3.937
   38    H3*    U   4           H3*        U   4   5.031 -12.074   3.799
   39    H2*    U   4           H2*        U   4   5.160 -12.429   1.393
   40   2HO*    U   4          2HO*        U   4   7.487 -12.562   1.375
   41    H1*    U   4           H1*        U   4   5.300 -15.120   1.565
   42    H3     U   4           H3         U   4   1.120 -13.789   0.188
   43    H5     U   4           H5         U   4   0.931 -13.960   4.382
   44    H6     U   4           H6         U   4   3.318 -14.252   4.436
   45   1H5*    A   5          1H5*        A   5   7.925 -11.106   0.872
   46   2H5*    A   5          2H5*        A   5   8.113  -9.360   0.661
   47    H4*    A   5           H4*        A   5   7.581 -10.465  -1.467
   48    H3*    A   5           H3*        A   5   5.379  -8.648  -0.413
   49    H2*    A   5           H2*        A   5   4.317  -9.056  -2.554
   50   2HO*    A   5          2HO*        A   5   6.346  -9.073  -3.728
   51    H1*    A   5           H1*        A   5   4.626 -11.723  -2.449
   52    H8     A   5           H8         A   5   4.246 -10.737   1.163
   53   1H6     A   5          1H6         A   5  -1.855 -10.744   0.066
   54   2H6     A   5          2H6         A   5  -0.610 -10.709   1.313
   55    H2     A   5           H2         A   5   0.239 -10.848  -3.841
   56   1H5*    U   6          1H5*        U   6   6.265  -7.571  -4.413
   57   2H5*    U   6          2H5*        U   6   6.250  -5.809  -4.598
   58    H4*    U   6           H4*        U   6   4.682  -6.937  -6.158
   59    H3*    U   6           H3*        U   6   3.412  -5.130  -4.054
   60    H2*    U   6           H2*        U   6   1.364  -5.505  -5.207
   61   2HO*    U   6          2HO*        U   6   2.234  -5.389  -7.323
   62    H1*    U   6           H1*        U   6   1.704  -8.190  -5.506
   63    H3     U   6           H3         U   6  -1.482  -7.521  -2.343
   64    H5     U   6           H5         U   6   2.144  -7.342  -0.243
   65    H6     U   6           H6         U   6   3.311  -7.388  -2.346
   66   1H5*    A   7          1H5*        A   7   1.232  -1.350  -6.544
   67   2H5*    A   7          2H5*        A   7   0.903  -2.369  -5.140
   68    H4*    A   7           H4*        A   7  -0.297  -2.697  -7.930
   69    H3*    A   7           H3*        A   7  -1.155  -1.735  -5.210
   70    H2*    A   7           H2*        A   7  -3.395  -2.520  -5.553
   71   2HO*    A   7          2HO*        A   7  -2.826  -2.455  -8.175
   72    H1*    A   7           H1*        A   7  -2.545  -4.959  -6.145
   73    H8     A   7           H8         A   7   0.432  -4.074  -4.146
   74   1H6     A   7          1H6         A   7  -3.077  -5.004   0.892
   75   2H6     A   7          2H6         A   7  -1.425  -4.978   0.277
   76    H2     A   7           H2         A   7  -5.784  -4.394  -2.562
   77   1H5*    U   8          1H5*        U   8  -4.263   1.603  -7.607
   78   2H5*    U   8          2H5*        U   8  -3.503   0.827  -6.226
   79    H4*    U   8           H4*        U   8  -6.304   0.179  -7.266
   80    H3*    U   8           H3*        U   8  -5.110   1.814  -5.034
   81    H2*    U   8           H2*        U   8  -7.115   1.385  -3.712
   82   2HO*    U   8          2HO*        U   8  -8.403   0.900  -5.885
   83    H1*    U   8           H1*        U   8  -6.682  -1.213  -3.927
   84    H3     U   8           H3         U   8  -4.462   0.869  -0.309
   85    H5     U   8           H5         U   8  -1.602  -0.258  -3.188
   86    H6     U   8           H6         U   8  -3.388  -0.683  -4.741
   87   1H5*    G   9          1H5*        G   9  -8.733   5.178  -5.280
   88   2H5*    G   9          2H5*        G   9  -7.328   4.357  -4.606
   89    H4*    G   9           H4*        G   9 -10.147   4.196  -3.455
   90    H3*    G   9           H3*        G   9  -7.729   5.920  -2.947
   91    H2*    G   9           H2*        G   9  -8.163   5.853  -0.563
   92   2HO*    G   9          2HO*        G   9 -10.526   5.859  -0.941
   93    H1*    G   9           H1*        G   9  -8.426   3.201  -0.440
   94    H8     G   9           H8         G   9  -6.154   3.305  -3.325
   95    H1     G   9           H1         G   9  -3.199   5.075   2.096
   96   1H2     G   9          1H2         G   9  -4.701   5.622   3.628
   97   2H2     G   9          2H2         G   9  -6.415   5.427   3.322
   98   1H5*    A  10          1H5*        A  10 -10.461   7.364  -0.202
   99   2H5*    A  10          2H5*        A  10 -10.657   9.111  -0.411
  100    H4*    A  10           H4*        A  10 -10.083   8.553   1.909
  101    H3*    A  10           H3*        A  10  -8.003  10.137   0.344
  102    H2*    A  10           H2*        A  10  -6.793  10.307   2.372
  103   2HO*    A  10          2HO*        A  10  -8.602  10.665   3.733
  104    H1*    A  10           H1*        A  10  -7.034   7.718   3.106
  105    H8     A  10           H8         A  10  -6.905   7.512  -0.628
  106   1H6     A  10          1H6         A  10  -0.752   7.777  -0.137
  107   2H6     A  10          2H6         A  10  -2.112   7.477  -1.203
  108    H2     A  10           H2         A  10  -2.472   8.920   3.797
  109   1H5*    U  11          1H5*        U  11  -7.759  14.473   3.207
  110   2H5*    U  11          2H5*        U  11  -6.720  13.518   2.137
  111    H4*    U  11           H4*        U  11  -7.016  13.122   5.143
  112    H3*    U  11           H3*        U  11  -4.974  14.269   3.245
  113    H2*    U  11           H2*        U  11  -3.185  13.553   4.678
  114   2HO*    U  11          2HO*        U  11  -4.387  13.750   6.733
  115    H1*    U  11           H1*        U  11  -4.095  11.062   4.764
  116    H3     U  11           H3         U  11  -0.884  11.537   1.445
  117    H5     U  11           H5         U  11  -4.648  11.461  -0.430
  118    H6     U  11           H6         U  11  -5.675  11.780   1.718
  119   1H5*    A  12          1H5*        A  12  -3.605  17.361   7.060
  120   2H5*    A  12          2H5*        A  12  -3.509  16.547   5.492
  121    H4*    A  12           H4*        A  12  -1.804  15.899   7.935
  122    H3*    A  12           H3*        A  12  -1.410  17.325   5.291
  123    H2*    A  12           H2*        A  12   0.921  16.615   5.383
  124   2HO*    A  12          2HO*        A  12   1.065  16.764   7.734
  125    H1*    A  12           H1*        A  12   0.313  14.086   5.850
  126    H8     A  12           H8         A  12  -2.651  15.328   3.922
  127   1H6     A  12          1H6         A  12   0.599  14.091  -1.178
  128   2H6     A  12          2H6         A  12  -0.987  14.495  -0.531
  129    H2     A  12           H2         A  12   3.383  13.973   2.292
  130   1H5*    C  13          1H5*        C  13   1.798  18.002   7.782
  131   2H5*    C  13          2H5*        C  13   2.138  19.748   7.932
  132    H4*    C  13           H4*        C  13   4.228  18.574   7.492
  133    H3*    C  13           H3*        C  13   3.245  20.188   5.171
  134    H2*    C  13           H2*        C  13   5.379  19.645   4.165
  135   2HO*    C  13          2HO*        C  13   6.616  19.895   6.076
  136    H1*    C  13           H1*        C  13   5.347  17.017   4.886
  137   1H4     C  13          1H4         C  13   2.764  17.079  -0.899
  138   2H4     C  13          2H4         C  13   1.159  17.231  -0.218
  139    H5     C  13           H5         C  13   0.787  17.599   2.199
  140    H6     C  13           H6         C  13   1.849  17.868   4.301
  141   1H5*    A  14          1H5*        A  14   5.293  24.315   4.406
  142   2H5*    A  14          2H5*        A  14   4.638  23.402   3.037
  143    H4*    A  14           H4*        A  14   7.438  23.409   4.139
  144    H3*    A  14           H3*        A  14   6.036  23.377   1.481
  145    H2*    A  14           H2*        A  14   8.023  22.397   0.479
  146   2HO*    A  14          2HO*        A  14   9.486  23.518   1.979
  147    H1*    A  14           H1*        A  14   7.962  20.331   2.144
  148    H8     A  14           H8         A  14   4.541  20.897   2.862
  149   1H6     A  14          1H6         A  14   2.951  19.579  -2.998
  150   2H6     A  14          2H6         A  14   2.383  19.693  -1.330
  151    H2     A  14           H2         A  14   7.275  20.603  -2.962
  152   1H5*    A  15          1H5*        A  15   4.324  25.439   0.477
  153   2H5*    A  15          2H5*        A  15   5.517  24.348  -0.199
  154    H4*    A  15           H4*        A  15   4.304  26.796  -1.534
  155    H3*    A  15           H3*        A  15   3.089  24.395  -1.371
  156    H2*    A  15           H2*        A  15   5.022  23.132  -1.782
  157   2HO*    A  15          2HO*        A  15   3.124  22.849  -3.433
  158    H1*    A  15           H1*        A  15   5.713  24.660  -4.275
  159    H8     A  15           H8         A  15   6.975  23.435  -0.903
  160   1H6     A  15          1H6         A  15  12.229  21.987  -3.816
  161   2H6     A  15          2H6         A  15  11.426  22.055  -2.247
  162    H2     A  15           H2         A  15   9.322  23.524  -6.760
  163   1H5*    U  16          1H5*        U  16   3.162  26.508  -5.693
  164   2H5*    U  16          2H5*        U  16   1.709  26.013  -6.586
  165    H4*    U  16           H4*        U  16   3.521  26.149  -8.167
  166    H3*    U  16           H3*        U  16   2.860  23.291  -7.412
  167    H2*    U  16           H2*        U  16   4.444  22.583  -8.901
  168   2HO*    U  16          2HO*        U  16   3.725  24.059 -10.686
  169    H1*    U  16           H1*        U  16   6.244  24.688  -8.612
  170    H3     U  16           H3         U  16   8.390  20.779  -7.618
  171    H5     U  16           H5         U  16   5.456  21.179  -4.636
  172    H6     U  16           H6         U  16   4.682  23.122  -5.722
  173   1H5*    U  17          1H5*        U  17   0.214  20.820  -9.992
  174   2H5*    U  17          2H5*        U  17   0.521  21.335  -8.324
  175    H4*    U  17           H4*        U  17   2.449  19.494  -9.731
  176    H3*    U  17           H3*        U  17  -0.298  18.819  -9.201
  177    H2*    U  17           H2*        U  17  -0.258  17.605  -7.236
  178   2HO*    U  17          2HO*        U  17   2.361  16.880  -8.027
  179    H1*    U  17           H1*        U  17   1.978  18.488  -5.985
  180    H3     U  17           H3         U  17   0.367  22.170  -3.849
  181    H5     U  17           H5         U  17  -2.687  21.056  -6.510
  182    H6     U  17           H6         U  17  -1.190  19.467  -7.498
  183   1H5*    U  18          1H5*        U  18   2.557  13.598  -9.137
  184   2H5*    U  18          2H5*        U  18   3.016  15.064  -8.310
  185    H4*    U  18           H4*        U  18   4.514  14.069 -10.758
  186    H3*    U  18           H3*        U  18   4.352  12.798  -8.191
  187    H2*    U  18           H2*        U  18   6.284  13.488  -7.078
  188   2HO*    U  18          2HO*        U  18   7.604  12.590  -8.761
  189    H1*    U  18           H1*        U  18   6.933  15.849  -8.267
  190    H3     U  18           H3         U  18   4.707  18.677  -5.524
  191    H5     U  18           H5         U  18   2.953  14.927  -4.791
  192    H6     U  18           H6         U  18   4.234  14.026  -6.584
  193   1H5*    G  19          1H5*        G  19   7.649   9.131  -7.254
  194   2H5*    G  19          2H5*        G  19   6.231   9.846  -6.491
  195    H4*    G  19           H4*        G  19   9.106  10.810  -6.265
  196    H3*    G  19           H3*        G  19   7.193   9.272  -4.563
  197    H2*    G  19           H2*        G  19   7.428  10.606  -2.647
  198   2HO*    G  19          2HO*        G  19   9.751  10.564  -2.785
  199    H1*    G  19           H1*        G  19   7.729  13.053  -3.785
  200    H8     G  19           H8         G  19   5.072  11.101  -5.661
  201    H1     G  19           H1         G  19   2.978  14.386  -0.580
  202   1H2     G  19          1H2         G  19   4.725  15.195   0.560
  203   2H2     G  19          2H2         G  19   6.363  14.788   0.107
  204   1H5*    A  20          1H5*        A  20   8.559   7.134  -0.867
  205   2H5*    A  20          2H5*        A  20   7.290   8.083  -1.639
  206    H4*    A  20           H4*        A  20   9.141   9.155   0.538
  207    H3*    A  20           H3*        A  20   6.506   7.703   0.574
  208    H2*    A  20           H2*        A  20   5.733   9.108   2.371
  209   2HO*    A  20          2HO*        A  20   7.794   9.180   3.452
  210    H1*    A  20           H1*        A  20   6.446  11.423   1.227
  211    H8     A  20           H8         A  20   5.850   9.410  -1.825
  212   1H6     A  20          1H6         A  20  -0.217  10.262  -0.983
  213   2H6     A  20          2H6         A  20   1.023   9.703  -2.094
  214    H2     A  20           H2         A  20   1.822  11.406   2.769
  215   1H5*    U  21          1H5*        U  21   6.164   6.014   5.576
  216   2H5*    U  21          2H5*        U  21   5.037   6.168   4.223
  217    H4*    U  21           H4*        U  21   5.598   8.240   6.393
  218    H3*    U  21           H3*        U  21   3.377   6.505   5.356
  219    H2*    U  21           H2*        U  21   1.701   8.074   6.013
  220   2HO*    U  21          2HO*        U  21   3.376   9.040   7.767
  221    H1*    U  21           H1*        U  21   2.903  10.046   4.685
  222    H3     U  21           H3         U  21  -0.309   7.882   2.097
  223    H5     U  21           H5         U  21   3.476   6.609   0.782
  224    H6     U  21           H6         U  21   4.446   7.634   2.722
  225   1H5*    C  22          1H5*        C  22   1.322   5.670   9.612
  226   2H5*    C  22          2H5*        C  22   1.530   5.661   7.864
  227    H4*    C  22           H4*        C  22  -0.519   7.353   9.359
  228    H3*    C  22           H3*        C  22  -0.624   4.623   8.051
  229    H2*    C  22           H2*        C  22  -2.809   5.096   7.229
  230   2HO*    C  22          2HO*        C  22  -3.513   6.162   9.168
  231    H1*    C  22           H1*        C  22  -2.284   7.606   6.359
  232   1H4     C  22          1H4         C  22  -0.935   4.034   1.325
  233   2H4     C  22          2H4         C  22   0.768   4.049   1.759
  234    H5     C  22           H5         C  22   1.578   4.990   3.894
  235    H6     C  22           H6         C  22   0.898   6.115   5.923
  236   1H5*    A  23          1H5*        A  23  -4.115   1.717  10.042
  237   2H5*    A  23          2H5*        A  23  -3.407   2.039   8.453
  238    H4*    A  23           H4*        A  23  -6.113   3.008   9.481
  239    H3*    A  23           H3*        A  23  -5.123   0.985   7.492
  240    H2*    A  23           H2*        A  23  -7.046   1.402   6.083
  241   2HO*    A  23          2HO*        A  23  -8.497   2.013   7.966
  242    H1*    A  23           H1*        A  23  -6.537   3.978   5.967
  243    H8     A  23           H8         A  23  -3.062   3.172   6.834
  244   1H6     A  23          1H6         A  23  -2.269   1.332   0.972
  245   2H6     A  23          2H6         A  23  -1.480   1.780   2.481
  246    H2     A  23           H2         A  23  -6.627   1.482   1.767
  247   1H5*    G  24          1H5*        G  24  -9.068   0.720   6.117
  248   2H5*    G  24          2H5*        G  24 -10.038  -0.553   6.866
  249    H4*    G  24           H4*        G  24 -10.020  -0.999   4.544
  250    H3*    G  24           H3*        G  24  -9.110  -2.834   6.402
  251    H2*    G  24           H2*        G  24  -6.870  -2.741   5.982
  252   2HO*    G  24          2HO*        G  24  -7.810  -4.794   4.904
  253    H1*    G  24           H1*        G  24  -7.150  -2.200   3.059
  254    H8     G  24           H8         G  24  -5.950  -0.598   6.298
  255    H1     G  24           H1         G  24  -1.434  -1.354   1.805
  256   1H2     G  24          1H2         G  24  -4.113  -2.431  -0.138
  257   2H2     G  24          2H2         G  24  -2.401  -2.075  -0.072
  258   1H5*    U  25          1H5*        U  25 -11.935  -3.871   2.964
  259   2H5*    U  25          2H5*        U  25 -12.617  -5.513   2.959
  260    H4*    U  25           H4*        U  25 -12.478  -4.673   0.664
  261    H3*    U  25           H3*        U  25 -10.608  -6.868   1.459
  262    H2*    U  25           H2*        U  25  -9.484  -6.775  -0.654
  263   2HO*    U  25          2HO*        U  25 -11.390  -6.599  -1.910
  264    H1*    U  25           H1*        U  25  -9.442  -4.070  -0.948
  265    H3     U  25           H3         U  25  -5.520  -3.191   1.061
  266    H5     U  25           H5         U  25  -6.521  -7.000   2.474
  267    H6     U  25           H6         U  25  -8.707  -6.725   1.509
  268   1H5*    A  26          1H5*        A  26 -11.419 -10.260  -2.634
  269   2H5*    A  26          2H5*        A  26  -9.976  -9.686  -1.791
  270    H4*    A  26           H4*        A  26 -11.066  -8.649  -4.444
  271    H3*    A  26           H3*        A  26  -8.802 -10.414  -3.550
  272    H2*    A  26           H2*        A  26  -7.285  -9.411  -5.115
  273   2HO*    A  26          2HO*        A  26  -9.028  -9.253  -6.754
  274    H1*    A  26           H1*        A  26  -7.918  -6.864  -4.596
  275    H8     A  26           H8         A  26  -8.534  -8.464  -1.274
  276   1H6     A  26          1H6         A  26  -2.431  -8.036  -0.314
  277   2H6     A  26          2H6         A  26  -3.997  -8.359   0.417
  278    H2     A  26           H2         A  26  -3.201  -7.288  -4.631
  279   1H5*    U  27          1H5*        U  27  -8.283 -10.681  -7.556
  280   2H5*    U  27          2H5*        U  27  -8.061 -12.362  -8.080
  281    H4*    U  27           H4*        U  27  -6.103 -11.016  -8.669
  282    H3*    U  27           H3*        U  27  -5.574 -13.006  -6.434
  283    H2*    U  27           H2*        U  27  -3.241 -12.357  -6.738
  284   2HO*    U  27          2HO*        U  27  -3.428 -12.155  -9.048
  285    H1*    U  27           H1*        U  27  -3.762  -9.707  -6.707
  286    H3     U  27           H3         U  27  -2.010 -11.018  -2.654
  287    H5     U  27           H5         U  27  -6.156 -11.587  -2.313
  288    H6     U  27           H6         U  27  -6.360 -11.138  -4.671
  289   1H5*    A  28          1H5*        A  28  -2.742 -13.633  -9.584
  290   2H5*    A  28          2H5*        A  28  -2.437 -15.362  -9.839
  291    H4*    A  28           H4*        A  28  -0.339 -14.126  -9.478
  292    H3*    A  28           H3*        A  28  -1.063 -16.075  -7.255
  293    H2*    A  28           H2*        A  28   1.104 -15.518  -6.324
  294   2HO*    A  28          2HO*        A  28   2.078 -15.335  -8.488
  295    H1*    A  28           H1*        A  28   0.779 -12.860  -6.535
  296    H8     A  28           H8         A  28  -2.739 -14.032  -5.970
  297   1H6     A  28          1H6         A  28  -1.303 -14.258   0.043
  298   2H6     A  28          2H6         A  28  -2.607 -14.215  -1.134
  299    H2     A  28           H2         A  28   2.487 -13.979  -2.266
  300   1H5*    U  29          1H5*        U  29   2.907 -16.734  -8.287
  301   2H5*    U  29          2H5*        U  29   3.303 -18.455  -8.383
  302    H4*    U  29           H4*        U  29   4.788 -17.269  -6.821
  303    H3*    U  29           H3*        U  29   2.921 -19.262  -5.455
  304    H2*    U  29           H2*        U  29   4.248 -18.790  -3.493
  305   2HO*    U  29          2HO*        U  29   6.249 -18.609  -4.670
  306    H1*    U  29           H1*        U  29   4.123 -16.116  -3.774
  307    H3     U  29           H3         U  29   1.205 -17.457  -0.511
  308    H5     U  29           H5         U  29  -0.991 -17.615  -4.086
  309    H6     U  29           H6         U  29   1.044 -17.213  -5.304
  310   1H5*    C  30          1H5*        C  30   6.908 -20.084  -4.355
  311   2H5*    C  30          2H5*        C  30   7.240 -21.825  -4.427
  312    H4*    C  30           H4*        C  30   7.856 -20.892  -2.233
  313    H3*    C  30           H3*        C  30   5.501 -22.823  -2.230
  314    H2*    C  30           H2*        C  30   5.567 -22.635   0.166
  315   2HO*    C  30          2HO*        C  30   7.939 -22.588   0.170
  316    H1*    C  30           H1*        C  30   5.852 -19.957   0.243
  317   1H4     C  30          1H4         C  30  -0.387 -20.733   0.584
  318   2H4     C  30          2H4         C  30  -0.536 -20.571  -1.160
  319    H5     C  30           H5         C  30   1.419 -20.535  -2.647
  320    H6     C  30           H6         C  30   3.816 -20.513  -2.723
  321   1H5*    C  31          1H5*        C  31   8.277 -24.182   0.639
  322   2H5*    C  31          2H5*        C  31   8.593 -25.916   0.409
  323    H4*    C  31           H4*        C  31   7.914 -25.594   2.713
  324    H3*    C  31           H3*        C  31   5.685 -26.748   0.981
  325    H2*    C  31           H2*        C  31   4.472 -27.050   3.036
  326   2HO*    C  31          2HO*        C  31   6.448 -27.693   4.198
  327    H1*    C  31           H1*        C  31   5.114 -24.565   4.023
  328   1H4     C  31          1H4         C  31  -0.513 -23.937   1.256
  329   2H4     C  31          2H4         C  31   0.238 -23.662  -0.309
  330    H5     C  31           H5         C  31   2.645 -23.898  -0.685
  331    H6     C  31           H6         C  31   4.760 -24.364   0.366
  332    H3T    C  31           H3T        C  31   7.534 -28.053   1.195
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  -9.885 -19.430   5.508
    2   2H5*    G   1          2H5*        G   1  -8.982 -20.681   4.659
    3    H4*    G   1           H4*        G   1  -9.296 -20.576   7.695
    4    H3*    G   1           H3*        G   1  -7.204 -19.406   5.858
    5    H2*    G   1           H2*        G   1  -5.552 -19.938   7.564
    6   2HO*    G   1          2HO*        G   1  -6.935 -19.436   9.344
    7    H1*    G   1           H1*        G   1  -6.359 -22.463   7.874
    8    H8     G   1           H8         G   1  -7.239 -21.765   4.319
    9    H1     G   1           H1         G   1  -0.937 -22.537   5.245
   10   1H2     G   1          1H2         G   1  -0.508 -22.463   7.422
   11   2H2     G   1          2H2         G   1  -1.795 -22.271   8.589
   12    H5T    G   1           H5T        G   1 -11.196 -21.097   6.398
   13   1H5*    G   2          1H5*        G   2  -6.404 -17.831   9.667
   14   2H5*    G   2          2H5*        G   2  -6.050 -16.099   9.588
   15    H4*    G   2           H4*        G   2  -4.245 -17.338  10.706
   16    H3*    G   2           H3*        G   2  -3.480 -16.098   8.030
   17    H2*    G   2           H2*        G   2  -1.246 -16.855   8.497
   18   2HO*    G   2          2HO*        G   2  -1.453 -16.387  10.780
   19    H1*    G   2           H1*        G   2  -1.949 -19.342   9.210
   20    H8     G   2           H8         G   2  -4.481 -18.547   6.597
   21    H1     G   2           H1         G   2   1.398 -19.474   4.214
   22   1H2     G   2          1H2         G   2   2.872 -19.396   5.871
   23   2H2     G   2          2H2         G   2   2.353 -19.218   7.546
   24   1H5*    A   3          1H5*        A   3  -0.414 -15.092  10.716
   25   2H5*    A   3          2H5*        A   3  -0.098 -13.353  10.669
   26    H4*    A   3           H4*        A   3   1.978 -14.605  10.372
   27    H3*    A   3           H3*        A   3   1.013 -13.116   7.911
   28    H2*    A   3           H2*        A   3   3.102 -13.781   6.889
   29   2HO*    A   3          2HO*        A   3   4.271 -13.500   8.934
   30    H1*    A   3           H1*        A   3   2.985 -16.336   7.688
   31    H8     A   3           H8         A   3  -0.613 -15.577   7.067
   32   1H6     A   3          1H6         A   3  -0.468 -16.457   2.137
   33   2H6     A   3          2H6         A   3   0.757 -16.611   1.047
   34    H2     A   3           H2         A   3   4.502 -15.984   3.163
   35   1H5*    U   4          1H5*        U   4   5.104 -12.217   8.345
   36   2H5*    U   4          2H5*        U   4   5.458 -10.506   8.107
   37    H4*    U   4           H4*        U   4   6.754 -11.926   6.568
   38    H3*    U   4           H3*        U   4   4.676 -10.161   5.216
   39    H2*    U   4           H2*        U   4   5.667 -10.961   3.144
   40   2HO*    U   4          2HO*        U   4   7.822 -10.944   4.066
   41    H1*    U   4           H1*        U   4   5.688 -13.558   3.859
   42    H3     U   4           H3         U   4   2.303 -12.696   0.867
   43    H5     U   4           H5         U   4   0.628 -12.085   4.665
   44    H6     U   4           H6         U   4   2.813 -12.300   5.624
   45   1H5*    A   5          1H5*        A   5   8.315  -9.661   3.166
   46   2H5*    A   5          2H5*        A   5   8.616  -7.973   2.758
   47    H4*    A   5           H4*        A   5   8.730  -9.395   0.775
   48    H3*    A   5           H3*        A   5   6.357  -7.477   0.761
   49    H2*    A   5           H2*        A   5   6.001  -8.273  -1.485
   50   2HO*    A   5          2HO*        A   5   8.270  -8.405  -1.969
   51    H1*    A   5           H1*        A   5   6.201 -10.870  -0.877
   52    H8     A   5           H8         A   5   4.729  -9.452   2.260
   53   1H6     A   5          1H6         A   5  -0.721  -9.656  -0.717
   54   2H6     A   5          2H6         A   5   0.071  -9.441   0.838
   55    H2     A   5           H2         A   5   2.500 -10.130  -3.721
   56   1H5*    U   6          1H5*        U   6   8.397  -6.962  -3.001
   57   2H5*    U   6          2H5*        U   6   8.419  -5.232  -3.379
   58    H4*    U   6           H4*        U   6   7.357  -6.593  -5.165
   59    H3*    U   6           H3*        U   6   5.551  -4.581  -3.751
   60    H2*    U   6           H2*        U   6   3.897  -5.191  -5.360
   61   2HO*    U   6          2HO*        U   6   5.307  -5.308  -7.141
   62    H1*    U   6           H1*        U   6   4.306  -7.869  -5.206
   63    H3     U   6           H3         U   6   0.368  -6.793  -3.214
   64    H5     U   6           H5         U   6   3.257  -6.334  -0.196
   65    H6     U   6           H6         U   6   4.968  -6.640  -1.843
   66   1H5*    A   7          1H5*        A   7   3.868  -1.406  -7.257
   67   2H5*    A   7          2H5*        A   7   3.278  -2.192  -5.800
   68    H4*    A   7           H4*        A   7   2.833  -3.169  -8.655
   69    H3*    A   7           H3*        A   7   1.283  -1.500  -6.711
   70    H2*    A   7           H2*        A   7  -0.744  -2.716  -7.031
   71   2HO*    A   7          2HO*        A   7  -0.264  -2.888  -9.373
   72    H1*    A   7           H1*        A   7   0.251  -5.165  -6.901
   73    H8     A   7           H8         A   7   2.726  -3.704  -4.558
   74   1H6     A   7          1H6         A   7  -1.885  -3.332  -0.427
   75   2H6     A   7          2H6         A   7  -0.148  -3.183  -0.684
   76    H2     A   7           H2         A   7  -3.698  -4.230  -4.362
   77   1H5*    U   8          1H5*        U   8  -1.661  -1.572  -9.337
   78   2H5*    U   8          2H5*        U   8  -2.099   0.077  -9.819
   79    H4*    U   8           H4*        U   8  -4.023  -1.078  -8.860
   80    H3*    U   8           H3*        U   8  -2.949   1.247  -7.190
   81    H2*    U   8           H2*        U   8  -4.760   0.882  -5.722
   82   2HO*    U   8          2HO*        U   8  -6.314   0.505  -7.352
   83    H1*    U   8           H1*        U   8  -4.577  -1.810  -5.609
   84    H3     U   8           H3         U   8  -2.909  -0.024  -1.723
   85    H5     U   8           H5         U   8   0.364  -0.427  -4.306
   86    H6     U   8           H6         U   8  -1.162  -0.936  -6.087
   87   1H5*    G   9          1H5*        G   9  -6.644   4.685  -7.015
   88   2H5*    G   9          2H5*        G   9  -5.372   4.080  -5.963
   89    H4*    G   9           H4*        G   9  -8.330   3.326  -5.849
   90    H3*    G   9           H3*        G   9  -6.354   4.939  -4.255
   91    H2*    G   9           H2*        G   9  -7.455   4.397  -2.200
   92   2HO*    G   9          2HO*        G   9  -9.655   4.158  -3.126
   93    H1*    G   9           H1*        G   9  -7.265   1.834  -2.656
   94    H8     G   9           H8         G   9  -4.419   2.660  -4.836
   95    H1     G   9           H1         G   9  -3.117   3.956   1.340
   96   1H2     G   9          1H2         G   9  -4.971   4.024   2.510
   97   2H2     G   9          2H2         G   9  -6.512   3.577   1.783
   98   1H5*    A  10          1H5*        A  10 -10.222   7.861  -2.603
   99   2H5*    A  10          2H5*        A  10  -8.568   7.292  -2.726
  100    H4*    A  10           H4*        A  10 -10.538   6.461  -0.556
  101    H3*    A  10           H3*        A  10  -8.377   8.553  -0.785
  102    H2*    A  10           H2*        A  10  -7.629   8.093   1.451
  103   2HO*    A  10          2HO*        A  10  -9.887   7.724   2.160
  104    H1*    A  10           H1*        A  10  -7.566   5.448   1.214
  105    H8     A  10           H8         A  10  -6.821   6.363  -2.293
  106   1H6     A  10          1H6         A  10  -0.976   7.341  -0.396
  107   2H6     A  10          2H6         A  10  -2.034   7.203  -1.807
  108    H2     A  10           H2         A  10  -3.557   7.054   3.184
  109   1H5*    U  11          1H5*        U  11  -9.758   9.087   3.159
  110   2H5*    U  11          2H5*        U  11 -10.090  10.804   3.413
  111    H4*    U  11           H4*        U  11  -8.425   9.955   5.028
  112    H3*    U  11           H3*        U  11  -7.440  11.957   2.974
  113    H2*    U  11           H2*        U  11  -5.383  11.981   4.244
  114   2HO*    U  11          2HO*        U  11  -6.413  11.938   6.284
  115    H1*    U  11           H1*        U  11  -5.263   9.311   4.634
  116    H3     U  11           H3         U  11  -1.884  10.390   1.814
  117    H5     U  11           H5         U  11  -5.281  10.086  -0.654
  118    H6     U  11           H6         U  11  -6.647   9.868   1.323
  119   1H5*    A  12          1H5*        A  12  -6.468  13.218   7.243
  120   2H5*    A  12          2H5*        A  12  -6.744  14.967   7.259
  121    H4*    A  12           H4*        A  12  -4.507  14.413   8.143
  122    H3*    A  12           H3*        A  12  -4.648  15.921   5.520
  123    H2*    A  12           H2*        A  12  -2.234  16.084   5.652
  124   2HO*    A  12          2HO*        A  12  -2.315  16.444   7.968
  125    H1*    A  12           H1*        A  12  -1.809  13.597   6.459
  126    H8     A  12           H8         A  12  -4.572  13.745   3.880
  127   1H6     A  12          1H6         A  12   0.004  12.923  -0.232
  128   2H6     A  12          2H6         A  12  -1.725  12.993  -0.037
  129    H2     A  12           H2         A  12   1.821  13.588   3.731
  130   1H5*    C  13          1H5*        C  13  -1.780  17.810   8.285
  131   2H5*    C  13          2H5*        C  13  -2.086  19.574   8.213
  132    H4*    C  13           H4*        C  13   0.270  19.253   7.827
  133    H3*    C  13           H3*        C  13  -1.111  19.817   5.236
  134    H2*    C  13           H2*        C  13   1.226  19.999   4.466
  135   2HO*    C  13          2HO*        C  13   1.991  20.989   6.381
  136    H1*    C  13           H1*        C  13   2.002  17.704   5.533
  137   1H4     C  13          1H4         C  13  -0.359  15.898  -0.082
  138   2H4     C  13          2H4         C  13  -1.989  16.075   0.529
  139    H5     C  13           H5         C  13  -2.525  16.891   2.739
  140    H6     C  13           H6         C  13  -1.616  17.741   4.767
  141   1H5*    A  14          1H5*        A  14   2.100  22.772   6.008
  142   2H5*    A  14          2H5*        A  14   1.652  24.282   5.190
  143    H4*    A  14           H4*        A  14   3.840  23.367   4.405
  144    H3*    A  14           H3*        A  14   1.633  23.262   2.352
  145    H2*    A  14           H2*        A  14   3.456  22.826   0.780
  146   2HO*    A  14          2HO*        A  14   5.125  24.067   1.890
  147    H1*    A  14           H1*        A  14   4.306  20.840   2.313
  148    H8     A  14           H8         A  14   0.608  20.823   2.954
  149   1H6     A  14          1H6         A  14   0.264  17.723  -2.393
  150   2H6     A  14          2H6         A  14  -0.588  18.144  -0.901
  151    H2     A  14           H2         A  14   4.252  19.624  -2.201
  152   1H5*    A  15          1H5*        A  15   4.588  27.319   0.364
  153   2H5*    A  15          2H5*        A  15   3.449  25.997   0.055
  154    H4*    A  15           H4*        A  15   6.442  25.823  -0.535
  155    H3*    A  15           H3*        A  15   4.921  27.546  -1.886
  156    H2*    A  15           H2*        A  15   3.058  26.044  -2.010
  157   2HO*    A  15          2HO*        A  15   4.398  26.024  -4.503
  158    H1*    A  15           H1*        A  15   4.939  24.021  -3.136
  159    H8     A  15           H8         A  15   2.444  24.054  -0.403
  160   1H6     A  15          1H6         A  15  -0.759  20.052  -3.917
  161   2H6     A  15          2H6         A  15  -0.800  20.955  -2.390
  162    H2     A  15           H2         A  15   3.081  20.996  -5.900
  163   1H5*    U  16          1H5*        U  16   6.277  26.952  -7.119
  164   2H5*    U  16          2H5*        U  16   4.570  27.020  -6.637
  165    H4*    U  16           H4*        U  16   4.784  25.492  -8.496
  166    H3*    U  16           H3*        U  16   4.312  24.335  -5.820
  167    H2*    U  16           H2*        U  16   4.710  22.075  -6.427
  168   2HO*    U  16          2HO*        U  16   4.209  23.012  -8.987
  169    H1*    U  16           H1*        U  16   6.857  22.477  -7.910
  170    H3     U  16           H3         U  16  10.132  23.018  -4.796
  171    H5     U  16           H5         U  16   6.538  22.835  -2.660
  172    H6     U  16           H6         U  16   5.357  23.173  -4.664
  173   1H5*    U  17          1H5*        U  17   2.881  21.614  -9.758
  174   2H5*    U  17          2H5*        U  17   1.210  21.612 -10.230
  175    H4*    U  17           H4*        U  17   1.671  20.384  -7.569
  176    H3*    U  17           H3*        U  17   3.382  19.613  -9.833
  177    H2*    U  17           H2*        U  17   2.691  17.307  -9.922
  178   2HO*    U  17          2HO*        U  17   2.631  17.234  -7.507
  179    H1*    U  17           H1*        U  17   0.061  17.684  -9.748
  180    H3     U  17           H3         U  17  -1.034  19.966 -13.634
  181    H5     U  17           H5         U  17   3.116  19.457 -13.708
  182    H6     U  17           H6         U  17   3.036  18.603 -11.497
  183   1H5*    U  18          1H5*        U  18   5.402  15.376  -8.416
  184   2H5*    U  18          2H5*        U  18   3.715  15.741  -8.656
  185    H4*    U  18           H4*        U  18   4.731  14.715  -5.992
  186    H3*    U  18           H3*        U  18   4.733  13.258  -8.477
  187    H2*    U  18           H2*        U  18   2.837  11.950  -8.302
  188   2HO*    U  18          2HO*        U  18   3.589  10.911  -6.473
  189    H1*    U  18           H1*        U  18   1.201  13.290  -6.586
  190    H3     U  18           H3         U  18  -1.250  15.501  -9.675
  191    H5     U  18           H5         U  18   2.328  14.654 -11.691
  192    H6     U  18           H6         U  18   3.206  13.775  -9.673
  193   1H5*    G  19          1H5*        G  19   6.731   9.215  -4.601
  194   2H5*    G  19          2H5*        G  19   5.292  10.208  -4.884
  195    H4*    G  19           H4*        G  19   7.882  11.106  -3.545
  196    H3*    G  19           H3*        G  19   5.017  10.697  -2.670
  197    H2*    G  19           H2*        G  19   5.525  12.149  -0.800
  198   2HO*    G  19          2HO*        G  19   8.089  11.508  -1.228
  199    H1*    G  19           H1*        G  19   6.554  13.965  -2.459
  200    H8     G  19           H8         G  19   3.882  12.663  -4.677
  201    H1     G  19           H1         G  19   1.547  15.822   0.428
  202   1H2     G  19          1H2         G  19   3.179  16.196   1.893
  203   2H2     G  19          2H2         G  19   4.789  15.588   1.584
  204   1H5*    A  20          1H5*        A  20   8.409  11.247   0.974
  205   2H5*    A  20          2H5*        A  20   8.954   9.695   1.645
  206    H4*    A  20           H4*        A  20   7.945  10.982   3.420
  207    H3*    A  20           H3*        A  20   6.246   8.621   2.496
  208    H2*    A  20           H2*        A  20   4.634   9.180   4.084
  209   2HO*    A  20          2HO*        A  20   6.125   9.628   5.774
  210    H1*    A  20           H1*        A  20   4.607  11.846   3.712
  211    H8     A  20           H8         A  20   5.292  10.536   0.306
  212   1H6     A  20          1H6         A  20  -0.803   9.677  -0.255
  213   2H6     A  20          2H6         A  20   0.756   9.696  -1.079
  214    H2     A  20           H2         A  20   0.094  10.366   4.045
  215   1H5*    U  21          1H5*        U  21   5.567   5.743   6.602
  216   2H5*    U  21          2H5*        U  21   4.773   6.111   5.071
  217    H4*    U  21           H4*        U  21   4.198   7.431   7.760
  218    H3*    U  21           H3*        U  21   2.920   5.347   6.010
  219    H2*    U  21           H2*        U  21   0.726   6.177   6.544
  220   2HO*    U  21          2HO*        U  21   1.397   6.673   8.783
  221    H1*    U  21           H1*        U  21   1.282   8.735   6.087
  222    H3     U  21           H3         U  21  -0.855   6.766   2.485
  223    H5     U  21           H5         U  21   3.252   6.746   1.609
  224    H6     U  21           H6         U  21   3.730   7.422   3.861
  225   1H5*    C  22          1H5*        C  22   0.351   5.347   9.282
  226   2H5*    C  22          2H5*        C  22   0.054   3.692   9.838
  227    H4*    C  22           H4*        C  22  -2.036   4.854   9.221
  228    H3*    C  22           H3*        C  22  -1.283   2.458   7.495
  229    H2*    C  22           H2*        C  22  -3.368   2.770   6.414
  230   2HO*    C  22          2HO*        C  22  -4.567   3.221   8.286
  231    H1*    C  22           H1*        C  22  -3.235   5.455   6.147
  232   1H4     C  22          1H4         C  22  -0.760   3.063   0.829
  233   2H4     C  22          2H4         C  22   0.816   2.991   1.577
  234    H5     C  22           H5         C  22   1.217   3.593   3.902
  235    H6     C  22           H6         C  22   0.171   4.321   5.928
  236   1H5*    A  23          1H5*        A  23  -5.436  -0.586   7.959
  237   2H5*    A  23          2H5*        A  23  -4.194  -0.166   6.783
  238    H4*    A  23           H4*        A  23  -6.876   1.258   7.097
  239    H3*    A  23           H3*        A  23  -5.734  -0.774   5.250
  240    H2*    A  23           H2*        A  23  -6.930   0.192   3.360
  241   2HO*    A  23          2HO*        A  23  -8.795   0.969   4.553
  242    H1*    A  23           H1*        A  23  -5.880   2.547   3.804
  243    H8     A  23           H8         A  23  -3.139   0.973   5.520
  244   1H6     A  23          1H6         A  23  -0.971  -0.799  -0.034
  245   2H6     A  23          2H6         A  23  -0.564  -0.545   1.670
  246    H2     A  23           H2         A  23  -5.303   0.006  -0.445
  247   1H5*    G  24          1H5*        G  24  -8.452  -0.822   2.256
  248   2H5*    G  24          2H5*        G  24  -9.898  -1.777   2.609
  249    H4*    G  24           H4*        G  24  -9.055  -2.695   0.639
  250    H3*    G  24           H3*        G  24  -9.176  -4.189   2.999
  251    H2*    G  24           H2*        G  24  -7.033  -4.741   3.366
  252   2HO*    G  24          2HO*        G  24  -7.902  -6.616   1.955
  253    H1*    G  24           H1*        G  24  -5.919  -4.330   0.680
  254    H8     G  24           H8         G  24  -6.139  -2.030   3.651
  255    H1     G  24           H1         G  24  -0.390  -4.683   2.708
  256   1H2     G  24          1H2         G  24  -0.521  -6.083   0.910
  257   2H2     G  24          2H2         G  24  -2.078  -6.394   0.201
  258   1H5*    U  25          1H5*        U  25 -11.543  -8.268  -0.915
  259   2H5*    U  25          2H5*        U  25  -9.923  -8.204  -0.249
  260    H4*    U  25           H4*        U  25 -11.095  -6.418  -2.428
  261    H3*    U  25           H3*        U  25  -9.146  -8.717  -2.319
  262    H2*    U  25           H2*        U  25  -7.840  -7.714  -4.048
  263   2HO*    U  25          2HO*        U  25  -9.691  -7.122  -5.298
  264    H1*    U  25           H1*        U  25  -8.005  -5.146  -3.123
  265    H3     U  25           H3         U  25  -3.831  -5.737  -1.609
  266    H5     U  25           H5         U  25  -5.952  -8.776   0.364
  267    H6     U  25           H6         U  25  -7.937  -8.073  -0.813
  268   1H5*    A  26          1H5*        A  26  -8.577 -11.217  -6.372
  269   2H5*    A  26          2H5*        A  26  -7.619 -10.430  -5.123
  270    H4*    A  26           H4*        A  26  -7.933  -9.493  -8.010
  271    H3*    A  26           H3*        A  26  -5.846 -10.989  -6.433
  272    H2*    A  26           H2*        A  26  -4.075  -9.806  -7.509
  273   2HO*    A  26          2HO*        A  26  -5.265  -9.859  -9.591
  274    H1*    A  26           H1*        A  26  -5.144  -7.359  -7.277
  275    H8     A  26           H8         A  26  -6.383  -9.134  -4.235
  276   1H6     A  26          1H6         A  26  -0.935  -7.629  -1.691
  277   2H6     A  26          2H6         A  26  -2.571  -8.204  -1.363
  278    H2     A  26           H2         A  26  -0.629  -6.967  -6.040
  279   1H5*    U  27          1H5*        U  27  -4.015 -11.388  -9.924
  280   2H5*    U  27          2H5*        U  27  -3.537 -13.071 -10.219
  281    H4*    U  27           H4*        U  27  -1.560 -11.681 -10.166
  282    H3*    U  27           H3*        U  27  -1.785 -13.390  -7.652
  283    H2*    U  27           H2*        U  27   0.449 -12.571  -7.198
  284   2HO*    U  27          2HO*        U  27   1.098 -12.630  -9.425
  285    H1*    U  27           H1*        U  27  -0.150  -9.996  -7.679
  286    H3     U  27           H3         U  27   0.051 -10.666  -3.157
  287    H5     U  27           H5         U  27  -3.896 -11.585  -4.227
  288    H6     U  27           H6         U  27  -3.259 -11.434  -6.544
  289   1H5*    A  28          1H5*        A  28   2.012 -14.242  -9.479
  290   2H5*    A  28          2H5*        A  28   2.358 -15.979  -9.395
  291    H4*    A  28           H4*        A  28   4.219 -14.723  -8.467
  292    H3*    A  28           H3*        A  28   2.640 -16.233  -6.337
  293    H2*    A  28           H2*        A  28   4.371 -15.494  -4.829
  294   2HO*    A  28          2HO*        A  28   6.053 -15.722  -6.469
  295    H1*    A  28           H1*        A  28   4.286 -12.932  -5.592
  296    H8     A  28           H8         A  28   0.760 -14.119  -6.109
  297   1H6     A  28          1H6         A  28  -0.045 -13.151  -0.051
  298   2H6     A  28          2H6         A  28  -0.842 -13.423  -1.596
  299    H2     A  28           H2         A  28   4.314 -13.052  -0.873
  300   1H5*    U  29          1H5*        U  29   6.695 -17.072  -5.814
  301   2H5*    U  29          2H5*        U  29   6.993 -18.769  -5.428
  302    H4*    U  29           H4*        U  29   7.937 -17.260  -3.721
  303    H3*    U  29           H3*        U  29   5.620 -18.987  -2.727
  304    H2*    U  29           H2*        U  29   6.237 -18.074  -0.548
  305   2HO*    U  29          2HO*        U  29   8.523 -18.074  -1.093
  306    H1*    U  29           H1*        U  29   6.278 -15.526  -1.373
  307    H3     U  29           H3         U  29   2.360 -16.417   0.909
  308    H5     U  29           H5         U  29   1.550 -17.254  -3.150
  309    H6     U  29           H6         U  29   3.873 -16.981  -3.647
  310   1H5*    C  30          1H5*        C  30   8.878 -19.371  -0.103
  311   2H5*    C  30          2H5*        C  30   9.144 -21.045   0.399
  312    H4*    C  30           H4*        C  30   8.895 -19.532   2.335
  313    H3*    C  30           H3*        C  30   6.639 -21.580   2.012
  314    H2*    C  30           H2*        C  30   5.875 -20.747   4.143
  315   2HO*    C  30          2HO*        C  30   8.156 -20.385   4.824
  316    H1*    C  30           H1*        C  30   6.021 -18.153   3.461
  317   1H4     C  30          1H4         C  30   0.277 -19.897   1.613
  318   2H4     C  30          2H4         C  30   0.839 -20.110  -0.051
  319    H5     C  30           H5         C  30   3.217 -20.045  -0.627
  320    H6     C  30           H6         C  30   5.404 -19.645   0.240
  321   1H5*    C  31          1H5*        C  31   7.776 -21.644   5.969
  322   2H5*    C  31          2H5*        C  31   8.131 -23.294   6.491
  323    H4*    C  31           H4*        C  31   6.506 -22.324   8.017
  324    H3*    C  31           H3*        C  31   5.302 -24.368   6.100
  325    H2*    C  31           H2*        C  31   3.319 -24.203   7.463
  326   2HO*    C  31          2HO*        C  31   4.612 -24.000   9.459
  327    H1*    C  31           H1*        C  31   3.372 -21.475   7.565
  328   1H4     C  31          1H4         C  31  -0.345 -22.929   2.720
  329   2H4     C  31          2H4         C  31   1.028 -22.980   1.615
  330    H5     C  31           H5         C  31   3.340 -22.751   2.378
  331    H6     C  31           H6         C  31   4.748 -22.399   4.289
  332    H3T    C  31           H3T        C  31   6.894 -25.171   7.516
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  -3.816 -23.363   7.726
    2   2H5*    G   1          2H5*        G   1  -3.247 -24.189   6.283
    3    H4*    G   1           H4*        G   1  -1.971 -24.484   9.036
    4    H3*    G   1           H3*        G   1  -1.425 -22.565   6.770
    5    H2*    G   1           H2*        G   1   0.932 -22.738   7.293
    6   2HO*    G   1          2HO*        G   1   0.560 -22.869   9.583
    7    H1*    G   1           H1*        G   1   0.985 -25.386   7.328
    8    H8     G   1           H8         G   1  -1.789 -24.757   4.931
    9    H1     G   1           H1         G   1   4.017 -23.401   2.500
   10   1H2     G   1          1H2         G   1   5.480 -23.389   4.149
   11   2H2     G   1          2H2         G   1   4.961 -23.737   5.800
   12    H5T    G   1           H5T        G   1  -4.933 -25.349   7.355
   13   1H5*    G   2          1H5*        G   2   0.942 -21.241   9.929
   14   2H5*    G   2          2H5*        G   2   0.819 -19.489  10.122
   15    H4*    G   2           H4*        G   2   3.147 -20.200   9.885
   16    H3*    G   2           H3*        G   2   2.098 -18.513   7.588
   17    H2*    G   2           H2*        G   2   4.366 -18.590   6.746
   18   2HO*    G   2          2HO*        G   2   5.256 -18.479   8.892
   19    H1*    G   2           H1*        G   2   4.673 -21.215   6.998
   20    H8     G   2           H8         G   2   1.036 -20.989   6.235
   21    H1     G   2           H1         G   2   4.770 -19.657   1.169
   22   1H2     G   2          1H2         G   2   6.832 -19.313   1.873
   23   2H2     G   2          2H2         G   2   7.246 -19.540   3.585
   24   1H5*    A   3          1H5*        A   3   5.848 -16.960   8.772
   25   2H5*    A   3          2H5*        A   3   5.785 -15.206   8.917
   26    H4*    A   3           H4*        A   3   7.617 -15.915   7.456
   27    H3*    A   3           H3*        A   3   5.393 -14.365   6.100
   28    H2*    A   3           H2*        A   3   6.752 -14.462   4.113
   29   2HO*    A   3          2HO*        A   3   8.737 -14.228   5.384
   30    H1*    A   3           H1*        A   3   7.305 -17.052   4.244
   31    H8     A   3           H8         A   3   3.868 -16.956   5.691
   32   1H6     A   3          1H6         A   3   1.894 -16.700  -0.196
   33   2H6     A   3          2H6         A   3   1.472 -16.968   1.488
   34    H2     A   3           H2         A   3   6.222 -15.793  -0.190
   35   1H5*    U   4          1H5*        U   4   9.040 -12.703   4.847
   36   2H5*    U   4          2H5*        U   4   9.014 -10.944   4.850
   37    H4*    U   4           H4*        U   4   9.590 -11.838   2.641
   38    H3*    U   4           H3*        U   4   6.924 -10.370   2.732
   39    H2*    U   4           H2*        U   4   6.937 -10.688   0.330
   40   2HO*    U   4          2HO*        U   4   9.227 -10.367   0.189
   41    H1*    U   4           H1*        U   4   7.551 -13.282   0.393
   42    H3     U   4           H3         U   4   3.072 -12.696  -0.529
   43    H5     U   4           H5         U   4   3.322 -13.047   3.637
   44    H6     U   4           H6         U   4   5.708 -12.883   3.486
   45   1H5*    A   5          1H5*        A   5   9.227  -8.857  -0.476
   46   2H5*    A   5          2H5*        A   5   9.072  -7.107  -0.613
   47    H4*    A   5           H4*        A   5   8.498  -8.218  -2.713
   48    H3*    A   5           H3*        A   5   6.155  -6.818  -1.368
   49    H2*    A   5           H2*        A   5   4.911  -7.410  -3.328
   50   2HO*    A   5          2HO*        A   5   6.705  -7.026  -4.756
   51    H1*    A   5           H1*        A   5   5.686  -9.973  -3.411
   52    H8     A   5           H8         A   5   5.623  -9.208   0.255
   53   1H6     A   5          1H6         A   5  -0.463 -10.283  -0.103
   54   2H6     A   5          2H6         A   5   0.934 -10.074   0.971
   55    H2     A   5           H2         A   5   1.023  -9.764  -4.214
   56   1H5*    U   6          1H5*        U   6   6.138  -5.534  -5.453
   57   2H5*    U   6          2H5*        U   6   5.757  -3.804  -5.467
   58    H4*    U   6           H4*        U   6   4.148  -5.141  -6.779
   59    H3*    U   6           H3*        U   6   2.986  -3.966  -4.255
   60    H2*    U   6           H2*        U   6   0.843  -4.549  -5.248
   61   2HO*    U   6          2HO*        U   6   1.492  -4.285  -7.504
   62    H1*    U   6           H1*        U   6   1.644  -7.034  -5.699
   63    H3     U   6           H3         U   6  -1.095  -6.891  -2.074
   64    H5     U   6           H5         U   6   2.747  -6.214  -0.526
   65    H6     U   6           H6         U   6   3.587  -6.019  -2.781
   66   1H5*    A   7          1H5*        A   7   0.526  -0.634  -7.198
   67   2H5*    A   7          2H5*        A   7   0.686  -1.646  -5.776
   68    H4*    A   7           H4*        A   7  -1.287  -2.112  -8.055
   69    H3*    A   7           H3*        A   7  -1.585  -0.889  -5.302
   70    H2*    A   7           H2*        A   7  -3.810  -1.903  -5.216
   71   2HO*    A   7          2HO*        A   7  -4.071  -1.580  -7.571
   72    H1*    A   7           H1*        A   7  -2.973  -4.338  -5.819
   73    H8     A   7           H8         A   7   0.153  -2.974  -4.317
   74   1H6     A   7          1H6         A   7  -2.465  -4.095   1.211
   75   2H6     A   7          2H6         A   7  -1.009  -3.673   0.333
   76    H2     A   7           H2         A   7  -5.649  -4.287  -1.923
   77   1H5*    U   8          1H5*        U   8  -5.368  -0.455  -6.960
   78   2H5*    U   8          2H5*        U   8  -5.835   1.253  -6.894
   79    H4*    U   8           H4*        U   8  -7.544  -0.234  -5.894
   80    H3*    U   8           H3*        U   8  -6.085   1.615  -4.019
   81    H2*    U   8           H2*        U   8  -7.786   1.050  -2.364
   82   2HO*    U   8          2HO*        U   8  -9.366   0.348  -4.284
   83    H1*    U   8           H1*        U   8  -7.289  -1.537  -2.677
   84    H3     U   8           H3         U   8  -4.878   0.405   0.860
   85    H5     U   8           H5         U   8  -2.245  -0.138  -2.350
   86    H6     U   8           H6         U   8  -4.134  -0.599  -3.756
   87   1H5*    G   9          1H5*        G   9 -10.165   4.699  -4.021
   88   2H5*    G   9          2H5*        G   9  -8.625   4.118  -3.416
   89    H4*    G   9           H4*        G   9 -11.327   3.858  -2.029
   90    H3*    G   9           H3*        G   9  -8.869   5.562  -1.696
   91    H2*    G   9           H2*        G   9  -9.043   5.427   0.706
   92   2HO*    G   9          2HO*        G   9 -11.418   5.480   0.581
   93    H1*    G   9           H1*        G   9  -9.316   2.791   0.832
   94    H8     G   9           H8         G   9  -7.334   3.001  -2.314
   95    H1     G   9           H1         G   9  -3.875   4.474   2.899
   96   1H2     G   9          1H2         G   9  -5.252   4.912   4.583
   97   2H2     G   9          2H2         G   9  -6.986   4.690   4.365
   98   1H5*    A  10          1H5*        A  10 -11.288   7.136   1.444
   99   2H5*    A  10          2H5*        A  10 -11.349   8.888   1.192
  100    H4*    A  10           H4*        A  10 -10.546   8.358   3.419
  101    H3*    A  10           H3*        A  10  -8.355   9.446   1.627
  102    H2*    A  10           H2*        A  10  -7.112   9.714   3.664
  103   2HO*    A  10          2HO*        A  10  -8.998  10.085   5.088
  104    H1*    A  10           H1*        A  10  -7.457   7.212   4.317
  105    H8     A  10           H8         A  10  -7.723   7.025   0.604
  106   1H6     A  10          1H6         A  10  -1.522   7.280   0.586
  107   2H6     A  10          2H6         A  10  -2.958   6.977  -0.380
  108    H2     A  10           H2         A  10  -2.882   8.424   4.587
  109   1H5*    U  11          1H5*        U  11  -8.665  13.734   4.356
  110   2H5*    U  11          2H5*        U  11  -7.883  12.560   3.318
  111    H4*    U  11           H4*        U  11  -7.399  12.790   6.321
  112    H3*    U  11           H3*        U  11  -5.972  13.973   3.932
  113    H2*    U  11           H2*        U  11  -3.894  13.609   5.133
  114   2HO*    U  11          2HO*        U  11  -4.756  14.169   7.162
  115    H1*    U  11           H1*        U  11  -4.388  11.095   5.849
  116    H3     U  11           H3         U  11  -1.484  11.107   2.261
  117    H5     U  11           H5         U  11  -5.315  10.841   0.604
  118    H6     U  11           H6         U  11  -6.265  11.313   2.794
  119   1H5*    A  12          1H5*        A  12  -4.386  15.687   7.594
  120   2H5*    A  12          2H5*        A  12  -4.014  17.392   7.319
  121    H4*    A  12           H4*        A  12  -2.046  16.091   8.101
  122    H3*    A  12           H3*        A  12  -1.903  17.279   5.324
  123    H2*    A  12           H2*        A  12   0.436  16.524   5.379
  124   2HO*    A  12          2HO*        A  12   0.659  16.978   7.652
  125    H1*    A  12           H1*        A  12  -0.086  14.117   6.206
  126    H8     A  12           H8         A  12  -3.062  15.027   4.071
  127   1H6     A  12          1H6         A  12   0.396  13.157  -0.697
  128   2H6     A  12          2H6         A  12  -1.212  13.635  -0.142
  129    H2     A  12           H2         A  12   3.047  13.518   2.811
  130   1H5*    C  13          1H5*        C  13   1.573  18.182   7.546
  131   2H5*    C  13          2H5*        C  13   1.971  19.926   7.452
  132    H4*    C  13           H4*        C  13   3.950  18.576   6.938
  133    H3*    C  13           H3*        C  13   2.731  19.993   4.632
  134    H2*    C  13           H2*        C  13   4.619  19.207   3.309
  135   2HO*    C  13          2HO*        C  13   6.185  19.427   5.000
  136    H1*    C  13           H1*        C  13   4.501  16.747   4.084
  137   1H4     C  13          1H4         C  13   0.819  16.274  -0.850
  138   2H4     C  13          2H4         C  13  -0.590  16.709   0.128
  139    H5     C  13           H5         C  13  -0.458  17.369   2.405
  140    H6     C  13           H6         C  13   1.048  17.910   4.156
  141   1H5*    A  14          1H5*        A  14   6.635  20.827   2.692
  142   2H5*    A  14          2H5*        A  14   6.409  22.537   2.295
  143    H4*    A  14           H4*        A  14   6.115  20.995   0.349
  144    H3*    A  14           H3*        A  14   3.755  22.648   0.992
  145    H2*    A  14           H2*        A  14   2.840  21.554  -1.013
  146   2HO*    A  14          2HO*        A  14   4.658  21.508  -2.243
  147    H1*    A  14           H1*        A  14   3.457  19.066  -0.334
  148    H8     A  14           H8         A  14   2.854  20.798   2.879
  149   1H6     A  14          1H6         A  14  -3.136  19.618   1.785
  150   2H6     A  14          2H6         A  14  -1.949  20.073   3.025
  151    H2     A  14           H2         A  14  -0.911  18.960  -1.970
  152   1H5*    A  15          1H5*        A  15   5.492  22.376  -3.210
  153   2H5*    A  15          2H5*        A  15   5.307  23.912  -4.028
  154    H4*    A  15           H4*        A  15   4.420  21.791  -5.238
  155    H3*    A  15           H3*        A  15   3.636  24.396  -5.555
  156    H2*    A  15           H2*        A  15   2.165  24.268  -3.721
  157   2HO*    A  15          2HO*        A  15   1.219  24.748  -6.096
  158    H1*    A  15           H1*        A  15   1.008  21.738  -4.999
  159    H8     A  15           H8         A  15   1.943  23.223  -1.598
  160   1H6     A  15          1H6         A  15  -3.958  22.052  -0.117
  161   2H6     A  15          2H6         A  15  -2.443  22.784   0.451
  162    H2     A  15           H2         A  15  -3.222  20.503  -4.114
  163   1H5*    U  16          1H5*        U  16   0.890  20.957  -7.506
  164   2H5*    U  16          2H5*        U  16   0.679  21.508  -9.170
  165    H4*    U  16           H4*        U  16  -1.327  20.382  -8.496
  166    H3*    U  16           H3*        U  16  -1.494  23.397  -8.618
  167    H2*    U  16           H2*        U  16  -3.445  23.567  -7.864
  168   2HO*    U  16          2HO*        U  16  -4.044  21.132  -9.218
  169    H1*    U  16           H1*        U  16  -3.746  21.002  -6.621
  170    H3     U  16           H3         U  16  -5.244  24.154  -3.630
  171    H5     U  16           H5         U  16  -1.227  25.143  -4.340
  172    H6     U  16           H6         U  16  -1.077  23.377  -5.838
  173   1H5*    U  17          1H5*        U  17  -1.459  18.021 -11.160
  174   2H5*    U  17          2H5*        U  17  -1.331  18.524  -9.504
  175    H4*    U  17           H4*        U  17   1.103  18.488 -11.331
  176    H3*    U  17           H3*        U  17  -0.336  16.233 -10.221
  177    H2*    U  17           H2*        U  17   1.127  15.548  -8.479
  178   2HO*    U  17          2HO*        U  17   2.981  15.662 -10.004
  179    H1*    U  17           H1*        U  17   2.193  17.864  -7.677
  180    H3     U  17           H3         U  17  -0.970  19.416  -4.778
  181    H5     U  17           H5         U  17  -3.031  16.600  -7.126
  182    H6     U  17           H6         U  17  -1.073  16.270  -8.403
  183   1H5*    U  18          1H5*        U  18   2.366  12.336  -9.698
  184   2H5*    U  18          2H5*        U  18   2.415  13.864  -8.896
  185    H4*    U  18           H4*        U  18   4.884  12.829 -10.323
  186    H3*    U  18           H3*        U  18   3.702  11.651  -7.966
  187    H2*    U  18           H2*        U  18   5.126  12.464  -6.250
  188   2HO*    U  18          2HO*        U  18   6.963  11.719  -7.458
  189    H1*    U  18           H1*        U  18   5.957  14.841  -7.209
  190    H3     U  18           H3         U  18   2.840  17.496  -5.314
  191    H5     U  18           H5         U  18   0.960  13.744  -5.571
  192    H6     U  18           H6         U  18   2.786  12.941  -6.781
  193   1H5*    G  19          1H5*        G  19   7.939  10.360  -7.269
  194   2H5*    G  19          2H5*        G  19   7.787   8.717  -6.645
  195    H4*    G  19           H4*        G  19   8.950  10.315  -5.108
  196    H3*    G  19           H3*        G  19   6.475   8.915  -3.992
  197    H2*    G  19           H2*        G  19   6.839  10.041  -2.001
  198   2HO*    G  19          2HO*        G  19   9.088   9.787  -1.986
  199    H1*    G  19           H1*        G  19   7.291  12.477  -3.020
  200    H8     G  19           H8         G  19   4.862  10.056  -4.689
  201    H1     G  19           H1         G  19   2.282  14.514  -0.855
  202   1H2     G  19          1H2         G  19   3.905  15.781  -0.027
  203   2H2     G  19          2H2         G  19   5.553  15.434  -0.410
  204   1H5*    A  20          1H5*        A  20   7.750   6.587   0.123
  205   2H5*    A  20          2H5*        A  20   6.394   7.433  -0.596
  206    H4*    A  20           H4*        A  20   8.442   8.676   1.292
  207    H3*    A  20           H3*        A  20   5.692   7.509   1.530
  208    H2*    A  20           H2*        A  20   5.079   9.171   3.176
  209   2HO*    A  20          2HO*        A  20   7.283   9.219   4.075
  210    H1*    A  20           H1*        A  20   5.831  11.228   1.687
  211    H8     A  20           H8         A  20   5.206   8.947  -1.159
  212   1H6     A  20          1H6         A  20  -0.870   9.864  -0.169
  213   2H6     A  20          2H6         A  20   0.367   9.284  -1.302
  214    H2     A  20           H2         A  20   1.232  11.036   3.488
  215   1H5*    U  21          1H5*        U  21   6.549   8.093   5.581
  216   2H5*    U  21          2H5*        U  21   6.316   6.571   6.477
  217    H4*    U  21           H4*        U  21   4.889   8.377   7.364
  218    H3*    U  21           H3*        U  21   3.459   6.048   6.055
  219    H2*    U  21           H2*        U  21   1.417   7.104   6.755
  220   2HO*    U  21          2HO*        U  21   2.409   7.791   8.785
  221    H1*    U  21           H1*        U  21   2.032   9.565   5.917
  222    H3     U  21           H3         U  21  -0.938   7.607   3.033
  223    H5     U  21           H5         U  21   2.837   6.707   1.493
  224    H6     U  21           H6         U  21   3.816   7.604   3.485
  225   1H5*    C  22          1H5*        C  22   1.330   6.663   9.733
  226   2H5*    C  22          2H5*        C  22   1.033   5.064  10.435
  227    H4*    C  22           H4*        C  22  -1.051   6.315  10.025
  228    H3*    C  22           H3*        C  22  -0.706   3.915   8.216
  229    H2*    C  22           H2*        C  22  -3.046   4.251   7.710
  230   2HO*    C  22          2HO*        C  22  -3.668   5.109   9.823
  231    H1*    C  22           H1*        C  22  -2.678   6.794   7.166
  232   1H4     C  22          1H4         C  22  -1.653   3.691   1.795
  233   2H4     C  22          2H4         C  22   0.089   3.645   2.116
  234    H5     C  22           H5         C  22   1.064   4.363   4.231
  235    H6     C  22           H6         C  22   0.549   5.309   6.379
  236   1H5*    A  23          1H5*        A  23  -4.342   1.719  11.297
  237   2H5*    A  23          2H5*        A  23  -3.533   1.885   9.752
  238    H4*    A  23           H4*        A  23  -6.355   2.849  10.408
  239    H3*    A  23           H3*        A  23  -5.248   0.432   8.987
  240    H2*    A  23           H2*        A  23  -6.985   0.606   7.321
  241   2HO*    A  23          2HO*        A  23  -8.542   1.245   8.968
  242    H1*    A  23           H1*        A  23  -6.736   3.187   6.842
  243    H8     A  23           H8         A  23  -3.234   2.328   7.803
  244   1H6     A  23          1H6         A  23  -2.575   0.364   2.002
  245   2H6     A  23          2H6         A  23  -1.778   0.735   3.539
  246    H2     A  23           H2         A  23  -6.885   0.948   2.685
  247   1H5*    G  24          1H5*        G  24  -9.490  -0.151   8.820
  248   2H5*    G  24          2H5*        G  24  -9.830  -1.832   9.237
  249    H4*    G  24           H4*        G  24 -10.697  -1.204   6.990
  250    H3*    G  24           H3*        G  24  -8.561  -3.321   7.151
  251    H2*    G  24           H2*        G  24  -8.805  -3.608   4.774
  252   2HO*    G  24          2HO*        G  24 -11.068  -3.432   4.768
  253    H1*    G  24           H1*        G  24  -8.849  -0.961   4.156
  254    H8     G  24           H8         G  24  -6.418  -1.331   6.981
  255    H1     G  24           H1         G  24  -4.105  -3.065   1.238
  256   1H2     G  24          1H2         G  24  -5.713  -3.116  -0.183
  257   2H2     G  24          2H2         G  24  -7.342  -2.585   0.272
  258   1H5*    U  25          1H5*        U  25 -11.020  -7.395   4.937
  259   2H5*    U  25          2H5*        U  25  -9.373  -6.785   4.867
  260    H4*    U  25           H4*        U  25 -11.582  -6.256   2.826
  261    H3*    U  25           H3*        U  25  -9.143  -8.038   2.900
  262    H2*    U  25           H2*        U  25  -8.869  -7.680   0.554
  263   2HO*    U  25          2HO*        U  25 -11.066  -7.774   0.010
  264    H1*    U  25           H1*        U  25  -9.186  -5.019   0.614
  265    H3     U  25           H3         U  25  -4.712  -5.896   0.208
  266    H5     U  25           H5         U  25  -5.430  -6.108   4.311
  267    H6     U  25           H6         U  25  -7.805  -5.838   3.879
  268   1H5*    A  26          1H5*        A  26 -10.312 -11.560  -0.898
  269   2H5*    A  26          2H5*        A  26  -8.844 -10.788  -0.337
  270    H4*    A  26           H4*        A  26 -10.585  -9.909  -2.674
  271    H3*    A  26           H3*        A  26  -7.902 -11.196  -2.278
  272    H2*    A  26           H2*        A  26  -6.900  -9.908  -3.995
  273   2HO*    A  26          2HO*        A  26  -8.918 -10.048  -5.298
  274    H1*    A  26           H1*        A  26  -7.852  -7.545  -3.281
  275    H8     A  26           H8         A  26  -7.652  -9.235   0.028
  276   1H6     A  26          1H6         A  26  -1.619  -7.741  -0.076
  277   2H6     A  26          2H6         A  26  -2.966  -8.325   0.903
  278    H2     A  26           H2         A  26  -3.214  -7.151  -4.141
  279   1H5*    U  27          1H5*        U  27  -8.038 -11.222  -6.330
  280   2H5*    U  27          2H5*        U  27  -7.603 -12.808  -6.983
  281    H4*    U  27           H4*        U  27  -6.077 -11.092  -7.798
  282    H3*    U  27           H3*        U  27  -4.773 -13.058  -5.885
  283    H2*    U  27           H2*        U  27  -2.720 -11.930  -6.482
  284   2HO*    U  27          2HO*        U  27  -3.350 -11.668  -8.686
  285    H1*    U  27           H1*        U  27  -3.650  -9.452  -6.155
  286    H3     U  27           H3         U  27  -1.028 -10.534  -2.538
  287    H5     U  27           H5         U  27  -4.871 -11.913  -1.567
  288    H6     U  27           H6         U  27  -5.571 -11.434  -3.810
  289   1H5*    A  28          1H5*        A  28  -2.488 -12.983  -9.468
  290   2H5*    A  28          2H5*        A  28  -1.943 -14.610  -9.898
  291    H4*    A  28           H4*        A  28  -0.062 -13.074  -9.754
  292    H3*    A  28           H3*        A  28  -0.042 -15.175  -7.550
  293    H2*    A  28           H2*        A  28   2.100 -14.232  -6.980
  294   2HO*    A  28          2HO*        A  28   2.665 -13.872  -9.217
  295    H1*    A  28           H1*        A  28   1.295 -11.701  -6.975
  296    H8     A  28           H8         A  28  -1.786 -13.554  -5.906
  297   1H6     A  28          1H6         A  28   0.728 -13.494  -0.253
  298   2H6     A  28          2H6         A  28  -0.750 -13.717  -1.198
  299    H2     A  28           H2         A  28   3.916 -12.501  -3.124
  300   1H5*    U  29          1H5*        U  29   3.721 -15.117  -9.417
  301   2H5*    U  29          2H5*        U  29   4.389 -16.741  -9.607
  302    H4*    U  29           H4*        U  29   5.908 -15.269  -8.353
  303    H3*    U  29           H3*        U  29   4.768 -17.571  -6.708
  304    H2*    U  29           H2*        U  29   6.317 -16.785  -5.009
  305   2HO*    U  29          2HO*        U  29   7.921 -16.202  -6.608
  306    H1*    U  29           H1*        U  29   5.575 -14.230  -5.148
  307    H3     U  29           H3         U  29   3.673 -16.217  -1.499
  308    H5     U  29           H5         U  29   0.910 -16.812  -4.581
  309    H6     U  29           H6         U  29   2.524 -15.974  -6.140
  310   1H5*    C  30          1H5*        C  30   8.910 -17.491  -6.190
  311   2H5*    C  30          2H5*        C  30   9.617 -19.108  -6.251
  312    H4*    C  30           H4*        C  30  10.200 -17.932  -4.176
  313    H3*    C  30           H3*        C  30   8.423 -20.380  -3.748
  314    H2*    C  30           H2*        C  30   8.790 -19.949  -1.408
  315   2HO*    C  30          2HO*        C  30  10.999 -19.175  -1.908
  316    H1*    C  30           H1*        C  30   8.199 -17.347  -1.515
  317   1H4     C  30          1H4         C  30   2.645 -20.040  -0.543
  318   2H4     C  30          2H4         C  30   2.248 -19.946  -2.270
  319    H5     C  30           H5         C  30   3.908 -19.364  -3.931
  320    H6     C  30           H6         C  30   6.160 -18.613  -4.234
  321   1H5*    C  31          1H5*        C  31  11.539 -20.581  -1.040
  322   2H5*    C  31          2H5*        C  31  12.319 -22.160  -1.111
  323    H4*    C  31           H4*        C  31  11.672 -21.699   1.182
  324    H3*    C  31           H3*        C  31   9.912 -23.783  -0.169
  325    H2*    C  31           H2*        C  31   8.970 -24.164   1.998
  326   2HO*    C  31          2HO*        C  31  11.084 -23.861   3.065
  327    H1*    C  31           H1*        C  31   8.661 -21.525   2.570
  328   1H4     C  31          1H4         C  31   3.237 -23.304   0.076
  329   2H4     C  31          2H4         C  31   3.799 -22.934  -1.568
  330    H5     C  31           H5         C  31   6.076 -22.309  -2.054
  331    H6     C  31           H6         C  31   8.219 -21.843  -1.084
  332    H3T    C  31           H3T        C  31  12.095 -24.354   0.038
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -7.617 -23.324   4.830
    2   2H5*    G   1          2H5*        G   1  -8.528 -24.522   5.781
    3    H4*    G   1           H4*        G   1  -6.863 -24.243   7.641
    4    H3*    G   1           H3*        G   1  -5.590 -22.375   5.626
    5    H2*    G   1           H2*        G   1  -3.437 -23.073   6.506
    6   2HO*    G   1          2HO*        G   1  -4.187 -23.215   8.715
    7    H1*    G   1           H1*        G   1  -3.989 -25.694   6.392
    8    H8     G   1           H8         G   1  -5.998 -24.473   3.512
    9    H1     G   1           H1         G   1   0.312 -24.212   2.401
   10   1H2     G   1          1H2         G   1   1.414 -24.452   4.320
   11   2H2     G   1          2H2         G   1   0.561 -24.731   5.827
   12    H5T    G   1           H5T        G   1  -7.954 -21.858   6.618
   13   1H5*    G   2          1H5*        G   2  -3.566 -21.798   9.238
   14   2H5*    G   2          2H5*        G   2  -3.318 -20.081   9.588
   15    H4*    G   2           H4*        G   2  -1.201 -21.341   9.660
   16    H3*    G   2           H3*        G   2  -1.436 -19.316   7.422
   17    H2*    G   2           H2*        G   2   0.898 -19.864   6.930
   18   2HO*    G   2          2HO*        G   2   1.407 -20.122   9.221
   19    H1*    G   2           H1*        G   2   0.529 -22.521   6.981
   20    H8     G   2           H8         G   2  -2.754 -21.379   5.650
   21    H1     G   2           H1         G   2   2.021 -20.689   1.416
   22   1H2     G   2          1H2         G   2   3.967 -20.871   2.449
   23   2H2     G   2          2H2         G   2   4.058 -21.238   4.163
   24   1H5*    A   3          1H5*        A   3   2.327 -18.796   9.315
   25   2H5*    A   3          2H5*        A   3   2.702 -17.091   9.594
   26    H4*    A   3           H4*        A   3   4.508 -18.226   8.365
   27    H3*    A   3           H3*        A   3   3.018 -16.089   6.808
   28    H2*    A   3           H2*        A   3   4.655 -16.485   5.049
   29   2HO*    A   3          2HO*        A   3   6.391 -16.849   6.605
   30    H1*    A   3           H1*        A   3   4.401 -19.150   5.070
   31    H8     A   3           H8         A   3   0.950 -18.109   6.032
   32   1H6     A   3          1H6         A   3   0.004 -16.844   0.052
   33   2H6     A   3          2H6         A   3  -0.747 -17.032   1.635
   34    H2     A   3           H2         A   3   4.371 -17.421   0.659
   35   1H5*    U   4          1H5*        U   4   7.121 -15.429   6.258
   36   2H5*    U   4          2H5*        U   4   7.554 -13.718   6.397
   37    H4*    U   4           H4*        U   4   8.282 -14.679   4.237
   38    H3*    U   4           H3*        U   4   6.103 -12.571   4.053
   39    H2*    U   4           H2*        U   4   6.420 -12.751   1.642
   40   2HO*    U   4          2HO*        U   4   8.741 -13.074   1.871
   41    H1*    U   4           H1*        U   4   6.358 -15.451   1.605
   42    H3     U   4           H3         U   4   2.429 -13.686   0.039
   43    H5     U   4           H5         U   4   1.863 -14.196   4.168
   44    H6     U   4           H6         U   4   4.204 -14.688   4.380
   45   1H5*    A   5          1H5*        A   5   9.061 -11.612   1.278
   46   2H5*    A   5          2H5*        A   5   9.411  -9.882   1.232
   47    H4*    A   5           H4*        A   5   8.834 -10.741  -0.989
   48    H3*    A   5           H3*        A   5   6.775  -8.800   0.148
   49    H2*    A   5           H2*        A   5   5.742  -8.948  -2.025
   50   2HO*    A   5          2HO*        A   5   7.813  -9.065  -3.136
   51    H1*    A   5           H1*        A   5   5.807 -11.639  -2.147
   52    H8     A   5           H8         A   5   5.424 -11.032   1.526
   53   1H6     A   5          1H6         A   5  -0.610 -10.242   0.359
   54   2H6     A   5          2H6         A   5   0.598 -10.485   1.620
   55    H2     A   5           H2         A   5   1.545 -10.039  -3.494
   56   1H5*    U   6          1H5*        U   6   7.780  -7.504  -3.751
   57   2H5*    U   6          2H5*        U   6   7.910  -5.738  -3.778
   58    H4*    U   6           H4*        U   6   6.255  -6.596  -5.412
   59    H3*    U   6           H3*        U   6   5.100  -4.901  -3.159
   60    H2*    U   6           H2*        U   6   3.059  -5.009  -4.402
   61   2HO*    U   6          2HO*        U   6   3.974  -4.766  -6.467
   62    H1*    U   6           H1*        U   6   3.213  -7.678  -4.926
   63    H3     U   6           H3         U   6  -0.055  -6.935  -1.837
   64    H5     U   6           H5         U   6   3.492  -7.254   0.396
   65    H6     U   6           H6         U   6   4.750  -7.267  -1.655
   66   1H5*    A   7          1H5*        A   7   3.072  -0.863  -5.692
   67   2H5*    A   7          2H5*        A   7   2.658  -1.885  -4.311
   68    H4*    A   7           H4*        A   7   1.714  -2.288  -7.181
   69    H3*    A   7           H3*        A   7   0.549  -1.084  -4.693
   70    H2*    A   7           H2*        A   7  -1.552  -2.225  -5.007
   71   2HO*    A   7          2HO*        A   7  -1.386  -1.935  -7.376
   72    H1*    A   7           H1*        A   7  -0.539  -4.656  -5.445
   73    H8     A   7           H8         A   7   2.274  -3.601  -3.306
   74   1H6     A   7          1H6         A   7  -1.553  -4.111   1.549
   75   2H6     A   7          2H6         A   7   0.129  -4.013   1.047
   76    H2     A   7           H2         A   7  -4.025  -3.936  -2.118
   77   1H5*    U   8          1H5*        U   8  -2.746  -0.935  -6.953
   78   2H5*    U   8          2H5*        U   8  -3.302   0.738  -7.118
   79    H4*    U   8           H4*        U   8  -5.087  -0.704  -6.195
   80    H3*    U   8           H3*        U   8  -3.841   1.294  -4.305
   81    H2*    U   8           H2*        U   8  -5.681   0.823  -2.796
   82   2HO*    U   8          2HO*        U   8  -7.245   0.308  -4.566
   83    H1*    U   8           H1*        U   8  -5.205  -1.801  -2.937
   84    H3     U   8           H3         U   8  -3.248   0.222   0.791
   85    H5     U   8           H5         U   8  -0.237  -0.316  -2.080
   86    H6     U   8           H6         U   8  -1.940  -0.827  -3.683
   87   1H5*    G   9          1H5*        G   9  -8.106   4.139  -5.082
   88   2H5*    G   9          2H5*        G   9  -6.627   3.683  -4.237
   89    H4*    G   9           H4*        G   9  -9.473   3.292  -3.217
   90    H3*    G   9           H3*        G   9  -7.201   5.198  -2.671
   91    H2*    G   9           H2*        G   9  -7.705   5.173  -0.305
   92   2HO*    G   9          2HO*        G   9 -10.038   5.068  -0.711
   93    H1*    G   9           H1*        G   9  -7.821   2.510  -0.087
   94    H8     G   9           H8         G   9  -5.417   2.751  -2.925
   95    H1     G   9           H1         G   9  -2.837   4.716   2.607
   96   1H2     G   9          1H2         G   9  -4.441   5.056   4.113
   97   2H2     G   9          2H2         G   9  -6.120   4.702   3.732
   98   1H5*    A  10          1H5*        A  10 -10.103   6.654   0.007
   99   2H5*    A  10          2H5*        A  10 -10.287   8.393  -0.287
  100    H4*    A  10           H4*        A  10  -9.726   7.979   2.061
  101    H3*    A  10           H3*        A  10  -7.429   9.162   0.478
  102    H2*    A  10           H2*        A  10  -6.476   9.633   2.673
  103   2HO*    A  10          2HO*        A  10  -8.534   9.881   3.838
  104    H1*    A  10           H1*        A  10  -6.696   7.074   3.320
  105    H8     A  10           H8         A  10  -6.500   6.829  -0.394
  106   1H6     A  10          1H6         A  10  -0.391   7.716   0.145
  107   2H6     A  10          2H6         A  10  -1.684   7.211  -0.931
  108    H2     A  10           H2         A  10  -2.260   8.794   4.002
  109   1H5*    U  11          1H5*        U  11  -8.475  13.482   3.074
  110   2H5*    U  11          2H5*        U  11  -7.460  12.369   2.157
  111    H4*    U  11           H4*        U  11  -7.330  12.728   5.181
  112    H3*    U  11           H3*        U  11  -5.657  13.741   2.872
  113    H2*    U  11           H2*        U  11  -3.788  13.829   4.423
  114   2HO*    U  11          2HO*        U  11  -5.069  14.272   6.373
  115    H1*    U  11           H1*        U  11  -4.171  11.295   5.093
  116    H3     U  11           H3         U  11  -0.917  11.614   1.847
  117    H5     U  11           H5         U  11  -4.515  10.885  -0.193
  118    H6     U  11           H6         U  11  -5.713  11.240   1.878
  119   1H5*    A  12          1H5*        A  12  -4.927  17.938   6.021
  120   2H5*    A  12          2H5*        A  12  -4.556  16.908   4.629
  121    H4*    A  12           H4*        A  12  -3.055  16.913   7.285
  122    H3*    A  12           H3*        A  12  -2.592  18.120   4.562
  123    H2*    A  12           H2*        A  12  -0.238  17.574   4.709
  124   2HO*    A  12          2HO*        A  12  -0.242  18.063   7.057
  125    H1*    A  12           H1*        A  12  -0.549  15.098   5.551
  126    H8     A  12           H8         A  12  -3.583  15.524   3.412
  127   1H6     A  12          1H6         A  12   0.139  14.113  -1.355
  128   2H6     A  12          2H6         A  12  -1.530  14.381  -0.869
  129    H2     A  12           H2         A  12   2.671  14.850   2.202
  130   1H5*    C  13          1H5*        C  13   0.708  19.351   6.751
  131   2H5*    C  13          2H5*        C  13   0.876  21.128   6.643
  132    H4*    C  13           H4*        C  13   2.983  20.053   6.008
  133    H3*    C  13           H3*        C  13   1.485  21.363   3.748
  134    H2*    C  13           H2*        C  13   3.332  20.743   2.339
  135   2HO*    C  13          2HO*        C  13   4.954  21.334   3.823
  136    H1*    C  13           H1*        C  13   3.745  18.267   3.395
  137   1H4     C  13          1H4         C  13   0.295  17.374  -1.829
  138   2H4     C  13          2H4         C  13  -1.179  17.541  -0.903
  139    H5     C  13           H5         C  13  -1.200  18.165   1.493
  140    H6     C  13           H6         C  13   0.177  18.852   3.320
  141   1H5*    A  14          1H5*        A  14   4.397  24.715   1.460
  142   2H5*    A  14          2H5*        A  14   2.963  23.727   1.212
  143    H4*    A  14           H4*        A  14   5.831  22.982   0.504
  144    H3*    A  14           H3*        A  14   3.323  23.747  -0.922
  145    H2*    A  14           H2*        A  14   3.651  22.126  -2.640
  146   2HO*    A  14          2HO*        A  14   6.004  22.400  -2.661
  147    H1*    A  14           H1*        A  14   4.007  20.070  -0.999
  148    H8     A  14           H8         A  14   2.068  21.970   1.404
  149   1H6     A  14          1H6         A  14  -2.941  21.290  -2.185
  150   2H6     A  14          2H6         A  14  -2.378  21.721  -0.565
  151    H2     A  14           H2         A  14   0.600  20.318  -4.611
  152   1H5*    A  15          1H5*        A  15   4.493  27.112  -4.338
  153   2H5*    A  15          2H5*        A  15   3.249  27.641  -3.188
  154    H4*    A  15           H4*        A  15   2.289  27.421  -5.419
  155    H3*    A  15           H3*        A  15   1.107  26.400  -3.196
  156    H2*    A  15           H2*        A  15   2.096  24.216  -3.472
  157   2HO*    A  15          2HO*        A  15  -0.449  24.279  -3.620
  158    H1*    A  15           H1*        A  15   1.238  24.484  -6.331
  159    H8     A  15           H8         A  15   4.153  23.190  -4.288
  160   1H6     A  15          1H6         A  15   3.972  18.317  -8.195
  161   2H6     A  15          2H6         A  15   4.811  18.973  -6.786
  162    H2     A  15           H2         A  15   0.772  21.172  -9.310
  163   1H5*    U  16          1H5*        U  16  -1.749  23.783  -5.511
  164   2H5*    U  16          2H5*        U  16  -0.636  24.595  -6.598
  165    H4*    U  16           H4*        U  16  -3.466  23.699  -7.165
  166    H3*    U  16           H3*        U  16  -0.865  22.509  -7.412
  167    H2*    U  16           H2*        U  16  -0.218  22.892  -9.580
  168   2HO*    U  16          2HO*        U  16  -2.488  21.673  -9.919
  169    H1*    U  16           H1*        U  16  -2.010  24.684 -10.560
  170    H3     U  16           H3         U  16   0.746  28.231 -10.708
  171    H5     U  16           H5         U  16   2.558  25.612  -7.980
  172    H6     U  16           H6         U  16   0.662  24.249  -8.057
  173   1H5*    U  17          1H5*        U  17  -1.375  19.145  -8.709
  174   2H5*    U  17          2H5*        U  17  -2.443  18.118  -7.780
  175    H4*    U  17           H4*        U  17   0.498  18.434  -7.076
  176    H3*    U  17           H3*        U  17  -0.558  17.186  -9.424
  177    H2*    U  17           H2*        U  17  -0.721  14.915  -8.879
  178   2HO*    U  17          2HO*        U  17   1.488  14.734  -8.509
  179    H1*    U  17           H1*        U  17  -0.944  14.880  -6.172
  180    H3     U  17           H3         U  17  -5.441  15.702  -5.681
  181    H5     U  17           H5         U  17  -4.662  16.164  -9.776
  182    H6     U  17           H6         U  17  -2.329  15.993  -9.312
  183   1H5*    U  18          1H5*        U  18   3.540  14.306  -9.098
  184   2H5*    U  18          2H5*        U  18   3.387  15.549  -7.859
  185    H4*    U  18           H4*        U  18   5.914  15.266  -9.509
  186    H3*    U  18           H3*        U  18   4.896  13.380  -7.548
  187    H2*    U  18           H2*        U  18   6.228  13.847  -5.672
  188   2HO*    U  18          2HO*        U  18   8.181  13.608  -6.910
  189    H1*    U  18           H1*        U  18   6.747  16.481  -5.916
  190    H3     U  18           H3         U  18   3.110  18.296  -3.925
  191    H5     U  18           H5         U  18   1.918  14.376  -4.838
  192    H6     U  18           H6         U  18   3.979  14.053  -5.986
  193   1H5*    G  19          1H5*        G  19   8.135   9.969  -5.972
  194   2H5*    G  19          2H5*        G  19   6.669  10.852  -5.527
  195    H4*    G  19           H4*        G  19   9.499  11.675  -4.763
  196    H3*    G  19           H3*        G  19   7.438   9.969  -3.423
  197    H2*    G  19           H2*        G  19   7.416  11.175  -1.399
  198   2HO*    G  19          2HO*        G  19   9.725  11.355  -1.284
  199    H1*    G  19           H1*        G  19   7.494  13.661  -2.376
  200    H8     G  19           H8         G  19   5.603  10.688  -3.949
  201    H1     G  19           H1         G  19   2.062  15.282  -1.276
  202   1H2     G  19          1H2         G  19   3.404  16.945  -0.602
  203   2H2     G  19          2H2         G  19   5.121  16.843  -0.790
  204   1H5*    A  20          1H5*        A  20   8.988   7.809   0.683
  205   2H5*    A  20          2H5*        A  20   7.507   8.425  -0.054
  206    H4*    A  20           H4*        A  20   9.218   9.843   2.037
  207    H3*    A  20           H3*        A  20   6.633   8.309   2.006
  208    H2*    A  20           H2*        A  20   5.639   9.854   3.575
  209   2HO*    A  20          2HO*        A  20   7.710  10.088   4.742
  210    H1*    A  20           H1*        A  20   6.359  12.073   2.280
  211    H8     A  20           H8         A  20   6.178   9.757  -0.631
  212   1H6     A  20          1H6         A  20   0.030  10.513  -0.482
  213   2H6     A  20          2H6         A  20   1.395   9.927  -1.426
  214    H2     A  20           H2         A  20   1.647  11.960   3.367
  215   1H5*    U  21          1H5*        U  21   6.986   8.984   6.077
  216   2H5*    U  21          2H5*        U  21   6.706   7.480   6.984
  217    H4*    U  21           H4*        U  21   5.028   9.191   7.594
  218    H3*    U  21           H3*        U  21   3.932   6.943   5.889
  219    H2*    U  21           H2*        U  21   1.739   7.809   6.507
  220   2HO*    U  21          2HO*        U  21   2.339   8.663   8.635
  221    H1*    U  21           H1*        U  21   2.438  10.250   5.710
  222    H3     U  21           H3         U  21  -0.040   8.204   2.456
  223    H5     U  21           H5         U  21   3.939   7.184   1.612
  224    H6     U  21           H6         U  21   4.569   8.166   3.711
  225   1H5*    C  22          1H5*        C  22   1.593   5.251  10.130
  226   2H5*    C  22          2H5*        C  22   1.819   5.381   8.387
  227    H4*    C  22           H4*        C  22  -0.445   6.671   9.981
  228    H3*    C  22           H3*        C  22  -0.216   4.306   8.112
  229    H2*    C  22           H2*        C  22  -2.560   4.623   7.575
  230   2HO*    C  22          2HO*        C  22  -3.191   5.516   9.698
  231    H1*    C  22           H1*        C  22  -2.135   7.155   6.952
  232   1H4     C  22          1H4         C  22  -0.411   4.042   1.706
  233   2H4     C  22          2H4         C  22   1.275   4.162   2.186
  234    H5     C  22           H5         C  22   1.964   4.986   4.396
  235    H6     C  22           H6         C  22   1.161   5.916   6.484
  236   1H5*    A  23          1H5*        A  23  -3.998   2.189  11.183
  237   2H5*    A  23          2H5*        A  23  -3.030   2.263   9.708
  238    H4*    A  23           H4*        A  23  -5.890   3.282  10.018
  239    H3*    A  23           H3*        A  23  -4.635   0.794   8.895
  240    H2*    A  23           H2*        A  23  -6.110   0.846   6.974
  241   2HO*    A  23          2HO*        A  23  -7.886   1.623   8.430
  242    H1*    A  23           H1*        A  23  -5.823   3.468   6.424
  243    H8     A  23           H8         A  23  -2.466   2.679   7.833
  244   1H6     A  23          1H6         A  23  -1.079   0.303   2.270
  245   2H6     A  23          2H6         A  23  -0.429   0.817   3.825
  246    H2     A  23           H2         A  23  -5.477   0.794   2.510
  247   1H5*    G  24          1H5*        G  24  -8.130  -0.219   7.672
  248   2H5*    G  24          2H5*        G  24  -8.643  -1.796   8.294
  249    H4*    G  24           H4*        G  24  -8.506  -1.722   5.811
  250    H3*    G  24           H3*        G  24  -6.735  -3.637   7.313
  251    H2*    G  24           H2*        G  24  -5.893  -4.428   5.200
  252   2HO*    G  24          2HO*        G  24  -7.893  -4.239   4.028
  253    H1*    G  24           H1*        G  24  -5.341  -2.000   4.192
  254    H8     G  24           H8         G  24  -4.620  -0.612   7.279
  255    H1     G  24           H1         G  24  -0.807  -5.708   6.629
  256   1H2     G  24          1H2         G  24  -1.538  -6.990   4.976
  257   2H2     G  24          2H2         G  24  -2.910  -6.533   4.009
  258   1H5*    U  25          1H5*        U  25 -10.388  -4.591   4.289
  259   2H5*    U  25          2H5*        U  25 -10.712  -6.337   4.250
  260    H4*    U  25           H4*        U  25 -10.846  -5.230   1.996
  261    H3*    U  25           H3*        U  25  -8.775  -7.395   2.377
  262    H2*    U  25           H2*        U  25  -8.249  -7.114   0.034
  263   2HO*    U  25          2HO*        U  25 -10.366  -6.828  -0.718
  264    H1*    U  25           H1*        U  25  -8.179  -4.408   0.101
  265    H3     U  25           H3         U  25  -3.749  -5.062   0.159
  266    H5     U  25           H5         U  25  -4.996  -6.960   3.682
  267    H6     U  25           H6         U  25  -7.248  -6.431   3.096
  268   1H5*    A  26          1H5*        A  26  -9.971 -10.428  -1.905
  269   2H5*    A  26          2H5*        A  26  -8.518  -9.873  -1.073
  270    H4*    A  26           H4*        A  26  -9.864  -8.492  -3.434
  271    H3*    A  26           H3*        A  26  -7.456 -10.249  -3.041
  272    H2*    A  26           H2*        A  26  -6.116  -8.898  -4.504
  273   2HO*    A  26          2HO*        A  26  -7.985  -8.553  -5.965
  274    H1*    A  26           H1*        A  26  -6.828  -6.522  -3.495
  275    H8     A  26           H8         A  26  -7.047  -8.724  -0.479
  276   1H6     A  26          1H6         A  26  -0.933  -7.978   0.066
  277   2H6     A  26          2H6         A  26  -2.416  -8.505   0.852
  278    H2     A  26           H2         A  26  -2.114  -6.615  -3.998
  279   1H5*    U  27          1H5*        U  27  -7.100  -9.793  -7.004
  280   2H5*    U  27          2H5*        U  27  -6.863 -11.343  -7.829
  281    H4*    U  27           H4*        U  27  -4.966  -9.880  -8.257
  282    H3*    U  27           H3*        U  27  -4.260 -12.171  -6.381
  283    H2*    U  27           H2*        U  27  -1.981 -11.390  -6.640
  284   2HO*    U  27          2HO*        U  27  -2.289 -10.853  -8.899
  285    H1*    U  27           H1*        U  27  -2.587  -8.788  -6.193
  286    H3     U  27           H3         U  27  -0.671 -10.568  -2.424
  287    H5     U  27           H5         U  27  -4.772 -11.379  -2.069
  288    H6     U  27           H6         U  27  -5.066 -10.629  -4.340
  289   1H5*    A  28          1H5*        A  28  -1.422 -12.262  -9.562
  290   2H5*    A  28          2H5*        A  28  -1.183 -13.932 -10.109
  291    H4*    A  28           H4*        A  28   0.964 -12.909  -9.594
  292    H3*    A  28           H3*        A  28   0.150 -15.059  -7.601
  293    H2*    A  28           H2*        A  28   2.356 -14.734  -6.653
  294   2HO*    A  28          2HO*        A  28   3.319 -14.394  -8.796
  295    H1*    A  28           H1*        A  28   2.203 -12.047  -6.594
  296    H8     A  28           H8         A  28  -1.354 -13.105  -6.007
  297   1H6     A  28          1H6         A  28   0.302 -13.867  -0.076
  298   2H6     A  28          2H6         A  28  -1.035 -13.703  -1.185
  299    H2     A  28           H2         A  28   4.011 -13.574  -2.516
  300   1H5*    U  29          1H5*        U  29   4.071 -15.881  -8.800
  301   2H5*    U  29          2H5*        U  29   4.362 -17.610  -9.047
  302    H4*    U  29           H4*        U  29   5.930 -16.641  -7.405
  303    H3*    U  29           H3*        U  29   3.965 -18.642  -6.209
  304    H2*    U  29           H2*        U  29   5.306 -18.389  -4.200
  305   2HO*    U  29          2HO*        U  29   7.320 -18.214  -5.343
  306    H1*    U  29           H1*        U  29   5.335 -15.697  -4.276
  307    H3     U  29           H3         U  29   2.408 -17.134  -1.065
  308    H5     U  29           H5         U  29   0.143 -16.878  -4.581
  309    H6     U  29           H6         U  29   2.175 -16.513  -5.822
  310   1H5*    C  30          1H5*        C  30   7.853 -19.690  -5.058
  311   2H5*    C  30          2H5*        C  30   8.124 -21.438  -5.087
  312    H4*    C  30           H4*        C  30   8.624 -20.472  -2.873
  313    H3*    C  30           H3*        C  30   6.208 -22.334  -2.908
  314    H2*    C  30           H2*        C  30   6.304 -22.093  -0.486
  315   2HO*    C  30          2HO*        C  30   8.705 -21.964  -0.586
  316    H1*    C  30           H1*        C  30   6.452 -19.405  -0.552
  317   1H4     C  30          1H4         C  30   0.264 -20.711  -0.623
  318   2H4     C  30          2H4         C  30   0.234 -20.586  -2.378
  319    H5     C  30           H5         C  30   2.280 -20.347  -3.714
  320    H6     C  30           H6         C  30   4.662 -20.118  -3.601
  321   1H5*    C  31          1H5*        C  31   8.710 -23.465   0.221
  322   2H5*    C  31          2H5*        C  31   9.021 -25.209   0.176
  323    H4*    C  31           H4*        C  31   8.218 -24.595   2.400
  324    H3*    C  31           H3*        C  31   6.197 -26.104   0.697
  325    H2*    C  31           H2*        C  31   4.844 -26.227   2.690
  326   2HO*    C  31          2HO*        C  31   6.750 -26.527   4.085
  327    H1*    C  31           H1*        C  31   5.181 -23.595   3.325
  328   1H4     C  31          1H4         C  31  -0.043 -23.875  -0.205
  329   2H4     C  31          2H4         C  31   0.892 -23.625  -1.675
  330    H5     C  31           H5         C  31   3.344 -23.606  -1.692
  331    H6     C  31           H6         C  31   5.304 -23.757  -0.316
  332    H3T    C  31           H3T        C  31   8.091 -27.246   1.234
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  -5.170 -21.308   9.637
    2   2H5*    G   1          2H5*        G   1  -4.551 -22.240   8.274
    3    H4*    G   1           H4*        G   1  -3.185 -22.018  10.994
    4    H3*    G   1           H3*        G   1  -2.795 -20.475   8.419
    5    H2*    G   1           H2*        G   1  -0.433 -20.409   8.966
    6   2HO*    G   1          2HO*        G   1  -0.737 -20.176  11.234
    7    H1*    G   1           H1*        G   1  -0.218 -23.004   9.445
    8    H8     G   1           H8         G   1  -3.004 -22.713   6.961
    9    H1     G   1           H1         G   1   2.858 -22.179   4.379
   10   1H2     G   1          1H2         G   1   4.345 -21.989   5.979
   11   2H2     G   1          2H2         G   1   3.834 -21.920   7.666
   12    H5T    G   1           H5T        G   1  -4.579 -24.094   9.691
   13   1H5*    G   2          1H5*        G   2  -0.586 -18.592  11.438
   14   2H5*    G   2          2H5*        G   2  -0.681 -16.830  11.339
   15    H4*    G   2           H4*        G   2   1.652 -17.617  11.305
   16    H3*    G   2           H3*        G   2   0.675 -16.308   8.751
   17    H2*    G   2           H2*        G   2   2.975 -16.572   7.961
   18   2HO*    G   2          2HO*        G   2   3.810 -16.124  10.108
   19    H1*    G   2           H1*        G   2   3.219 -19.119   8.678
   20    H8     G   2           H8         G   2  -0.388 -18.813   7.728
   21    H1     G   2           H1         G   2   3.628 -18.908   2.700
   22   1H2     G   2          1H2         G   2   5.702 -18.767   3.437
   23   2H2     G   2          2H2         G   2   6.041 -18.662   5.170
   24   1H5*    A   3          1H5*        A   3   4.452 -14.681   9.811
   25   2H5*    A   3          2H5*        A   3   4.477 -12.929   9.635
   26    H4*    A   3           H4*        A   3   6.312 -13.995   8.385
   27    H3*    A   3           H3*        A   3   4.215 -12.571   6.718
   28    H2*    A   3           H2*        A   3   5.601 -13.117   4.805
   29   2HO*    A   3          2HO*        A   3   7.578 -12.796   6.077
   30    H1*    A   3           H1*        A   3   5.960 -15.682   5.405
   31    H8     A   3           H8         A   3   2.527 -15.076   6.734
   32   1H6     A   3          1H6         A   3   0.566 -15.545   0.882
   33   2H6     A   3          2H6         A   3   0.097 -15.442   2.589
   34    H2     A   3           H2         A   3   4.959 -15.180   0.786
   35   1H5*    U   4          1H5*        U   4   7.990 -11.425   5.290
   36   2H5*    U   4          2H5*        U   4   8.093  -9.693   4.971
   37    H4*    U   4           H4*        U   4   8.640 -11.024   2.977
   38    H3*    U   4           H3*        U   4   6.089  -9.368   2.712
   39    H2*    U   4           H2*        U   4   6.103 -10.134   0.417
   40   2HO*    U   4          2HO*        U   4   8.426 -10.046   0.283
   41    H1*    U   4           H1*        U   4   6.516 -12.710   0.983
   42    H3     U   4           H3         U   4   2.132 -11.992  -0.150
   43    H5     U   4           H5         U   4   2.288 -11.567   4.022
   44    H6     U   4           H6         U   4   4.684 -11.606   3.898
   45   1H5*    A   5          1H5*        A   5   8.450  -8.742  -0.649
   46   2H5*    A   5          2H5*        A   5   8.516  -7.046  -1.104
   47    H4*    A   5           H4*        A   5   7.819  -8.435  -2.965
   48    H3*    A   5           H3*        A   5   5.628  -6.543  -2.022
   49    H2*    A   5           H2*        A   5   4.350  -7.313  -3.815
   50   2HO*    A   5          2HO*        A   5   6.071  -7.348  -5.309
   51    H1*    A   5           H1*        A   5   4.845  -9.926  -3.484
   52    H8     A   5           H8         A   5   4.849  -8.623   0.027
   53   1H6     A   5          1H6         A   5  -1.319  -9.397  -0.248
   54   2H6     A   5          2H6         A   5   0.062  -9.113   0.817
   55    H2     A   5           H2         A   5   0.230  -9.507  -4.363
   56   1H5*    U   6          1H5*        U   6   4.811  -3.411  -5.916
   57   2H5*    U   6          2H5*        U   6   3.929  -4.117  -4.571
   58    H4*    U   6           H4*        U   6   4.090  -5.240  -7.405
   59    H3*    U   6           H3*        U   6   2.137  -3.692  -5.756
   60    H2*    U   6           H2*        U   6   0.271  -4.918  -6.601
   61   2HO*    U   6          2HO*        U   6   1.067  -5.005  -8.753
   62    H1*    U   6           H1*        U   6   1.359  -7.352  -6.320
   63    H3     U   6           H3         U   6  -1.634  -6.504  -2.964
   64    H5     U   6           H5         U   6   2.149  -5.513  -1.416
   65    H6     U   6           H6         U   6   3.087  -5.742  -3.633
   66   1H5*    A   7          1H5*        A   7  -1.091  -1.105  -8.257
   67   2H5*    A   7          2H5*        A   7  -0.896  -1.806  -6.662
   68    H4*    A   7           H4*        A   7  -2.485  -3.006  -8.969
   69    H3*    A   7           H3*        A   7  -3.086  -1.209  -6.690
   70    H2*    A   7           H2*        A   7  -4.744  -2.491  -5.688
   71   2HO*    A   7          2HO*        A   7  -5.801  -2.826  -7.765
   72    H1*    A   7           H1*        A   7  -3.827  -4.981  -6.100
   73    H8     A   7           H8         A   7  -0.587  -3.371  -5.355
   74   1H6     A   7          1H6         A   7  -2.502  -3.053   0.536
   75   2H6     A   7          2H6         A   7  -1.145  -2.786  -0.576
   76    H2     A   7           H2         A   7  -5.930  -4.319  -1.938
   77   1H5*    U   8          1H5*        U   8  -6.717   1.406  -6.454
   78   2H5*    U   8          2H5*        U   8  -5.478   0.632  -5.491
   79    H4*    U   8           H4*        U   8  -8.405  -0.241  -5.672
   80    H3*    U   8           H3*        U   8  -6.720   1.304  -3.702
   81    H2*    U   8           H2*        U   8  -8.163   0.519  -1.909
   82   2HO*    U   8          2HO*        U   8  -9.989   0.033  -3.716
   83    H1*    U   8           H1*        U   8  -7.641  -1.992  -2.552
   84    H3     U   8           H3         U   8  -4.513  -0.100   0.439
   85    H5     U   8           H5         U   8  -2.685  -0.412  -3.330
   86    H6     U   8           H6         U   8  -4.835  -0.953  -4.274
   87   1H5*    G   9          1H5*        G   9 -10.539   4.375  -2.707
   88   2H5*    G   9          2H5*        G   9  -8.968   3.656  -2.433
   89    H4*    G   9           H4*        G   9 -11.421   3.309  -0.645
   90    H3*    G   9           H3*        G   9  -8.835   4.854  -0.546
   91    H2*    G   9           H2*        G   9  -8.773   4.650   1.846
   92   2HO*    G   9          2HO*        G   9 -11.167   4.562   2.133
   93    H1*    G   9           H1*        G   9  -8.980   2.028   1.720
   94    H8     G   9           H8         G   9  -7.514   2.432  -1.639
   95    H1     G   9           H1         G   9  -3.285   3.918   2.978
   96   1H2     G   9          1H2         G   9  -4.350   4.226   4.896
   97   2H2     G   9          2H2         G   9  -6.092   3.966   4.993
   98   1H5*    A  10          1H5*        A  10 -11.102   8.423   2.239
   99   2H5*    A  10          2H5*        A  10  -9.763   7.574   1.500
  100    H4*    A  10           H4*        A  10 -10.533   7.408   4.453
  101    H3*    A  10           H3*        A  10  -8.400   8.801   2.845
  102    H2*    A  10           H2*        A  10  -6.900   8.650   4.719
  103   2HO*    A  10          2HO*        A  10  -8.574   8.673   6.432
  104    H1*    A  10           H1*        A  10  -7.225   6.055   4.893
  105    H8     A  10           H8         A  10  -8.051   6.467   1.306
  106   1H6     A  10          1H6         A  10  -1.930   6.970   0.367
  107   2H6     A  10          2H6         A  10  -3.487   6.715  -0.431
  108    H2     A  10           H2         A  10  -2.647   7.514   4.634
  109   1H5*    U  11          1H5*        U  11  -8.234  12.431   6.271
  110   2H5*    U  11          2H5*        U  11  -7.667  11.476   4.912
  111    H4*    U  11           H4*        U  11  -6.571  11.263   7.750
  112    H3*    U  11           H3*        U  11  -5.687  12.666   5.219
  113    H2*    U  11           H2*        U  11  -3.406  12.513   5.988
  114   2HO*    U  11          2HO*        U  11  -3.969  12.573   8.342
  115    H1*    U  11           H1*        U  11  -3.630   9.934   6.411
  116    H3     U  11           H3         U  11  -1.648  10.608   2.330
  117    H5     U  11           H5         U  11  -5.773  10.281   1.560
  118    H6     U  11           H6         U  11  -6.178  10.357   3.942
  119   1H5*    A  12          1H5*        A  12  -4.033  16.407   8.129
  120   2H5*    A  12          2H5*        A  12  -4.048  15.395   6.685
  121    H4*    A  12           H4*        A  12  -1.745  15.637   8.662
  122    H3*    A  12           H3*        A  12  -2.365  16.690   5.891
  123    H2*    A  12           H2*        A  12   0.026  16.617   5.460
  124   2HO*    A  12          2HO*        A  12   0.556  17.174   7.695
  125    H1*    A  12           H1*        A  12   0.348  14.194   6.253
  126    H8     A  12           H8         A  12  -3.203  14.307   5.068
  127   1H6     A  12          1H6         A  12  -0.896  12.918  -0.503
  128   2H6     A  12          2H6         A  12  -2.352  13.113   0.455
  129    H2     A  12           H2         A  12   2.494  13.960   2.175
  130   1H5*    C  13          1H5*        C  13   1.086  18.557   7.463
  131   2H5*    C  13          2H5*        C  13   0.931  20.328   7.276
  132    H4*    C  13           H4*        C  13   3.090  19.677   6.414
  133    H3*    C  13           H3*        C  13   1.185  20.090   4.147
  134    H2*    C  13           H2*        C  13   3.200  20.094   2.811
  135   2HO*    C  13          2HO*        C  13   4.605  21.075   4.460
  136    H1*    C  13           H1*        C  13   4.063  17.841   3.886
  137   1H4     C  13          1H4         C  13   0.364  16.252  -0.959
  138   2H4     C  13          2H4         C  13  -1.101  16.419   0.021
  139    H5     C  13           H5         C  13  -1.025  17.164   2.353
  140    H6     C  13           H6         C  13   0.348  17.903   4.077
  141   1H5*    A  14          1H5*        A  14   3.811  24.570   3.485
  142   2H5*    A  14          2H5*        A  14   2.720  23.249   3.030
  143    H4*    A  14           H4*        A  14   5.642  23.486   2.179
  144    H3*    A  14           H3*        A  14   3.088  23.861   0.724
  145    H2*    A  14           H2*        A  14   4.320  22.984  -1.176
  146   2HO*    A  14          2HO*        A  14   6.251  24.082  -0.802
  147    H1*    A  14           H1*        A  14   5.450  20.928   0.128
  148    H8     A  14           H8         A  14   2.037  21.175   1.668
  149   1H6     A  14          1H6         A  14   0.205  17.866  -3.222
  150   2H6     A  14          2H6         A  14  -0.278  18.502  -1.621
  151    H2     A  14           H2         A  14   4.275  19.136  -4.018
  152   1H5*    A  15          1H5*        A  15   5.658  27.001  -3.008
  153   2H5*    A  15          2H5*        A  15   4.275  25.918  -3.130
  154    H4*    A  15           H4*        A  15   7.201  25.074  -3.469
  155    H3*    A  15           H3*        A  15   5.994  26.436  -5.362
  156    H2*    A  15           H2*        A  15   3.838  25.443  -5.002
  157   2HO*    A  15          2HO*        A  15   3.330  24.295  -6.975
  158    H1*    A  15           H1*        A  15   5.147  22.827  -5.408
  159    H8     A  15           H8         A  15   3.398  24.081  -2.427
  160   1H6     A  15          1H6         A  15  -1.300  20.351  -4.204
  161   2H6     A  15          2H6         A  15  -0.823  21.579  -3.002
  162    H2     A  15           H2         A  15   2.081  19.856  -6.941
  163   1H5*    U  16          1H5*        U  16   7.056  23.852 -10.119
  164   2H5*    U  16          2H5*        U  16   5.555  24.718  -9.724
  165    H4*    U  16           H4*        U  16   4.977  22.827 -11.052
  166    H3*    U  16           H3*        U  16   4.189  22.775  -8.234
  167    H2*    U  16           H2*        U  16   3.756  20.451  -8.104
  168   2HO*    U  16          2HO*        U  16   3.587  19.147  -9.977
  169    H1*    U  16           H1*        U  16   5.740  19.478  -9.580
  170    H3     U  16           H3         U  16   9.433  19.665  -6.945
  171    H5     U  16           H5         U  16   6.371  21.424  -4.721
  172    H6     U  16           H6         U  16   5.045  21.579  -6.712
  173   1H5*    U  17          1H5*        U  17   1.095  20.579 -10.446
  174   2H5*    U  17          2H5*        U  17  -0.487  21.209 -10.103
  175    H4*    U  17           H4*        U  17   0.034  19.581  -7.859
  176    H3*    U  17           H3*        U  17   1.542  18.640 -10.166
  177    H2*    U  17           H2*        U  17   0.440  16.600 -10.569
  178   2HO*    U  17          2HO*        U  17   0.491  16.299  -8.114
  179    H1*    U  17           H1*        U  17  -2.108  17.302 -10.082
  180    H3     U  17           H3         U  17  -3.315  19.843 -13.700
  181    H5     U  17           H5         U  17   0.817  19.342 -14.068
  182    H6     U  17           H6         U  17   0.871  18.254 -11.968
  183   1H5*    U  18          1H5*        U  18   3.155  14.511  -9.816
  184   2H5*    U  18          2H5*        U  18   1.489  14.890  -9.443
  185    H4*    U  18           H4*        U  18   3.152  13.254  -7.519
  186    H3*    U  18           H3*        U  18   2.456  12.408 -10.181
  187    H2*    U  18           H2*        U  18   0.606  11.079  -9.827
  188   2HO*    U  18          2HO*        U  18   1.756   9.618  -8.608
  189    H1*    U  18           H1*        U  18  -0.454  11.908  -7.455
  190    H3     U  18           H3         U  18  -3.522  14.809  -9.101
  191    H5     U  18           H5         U  18  -0.722  14.491 -12.205
  192    H6     U  18           H6         U  18   0.648  13.162 -10.779
  193   1H5*    G  19          1H5*        G  19   5.526   8.091  -7.463
  194   2H5*    G  19          2H5*        G  19   3.961   8.901  -7.335
  195    H4*    G  19           H4*        G  19   6.685  10.196  -6.886
  196    H3*    G  19           H3*        G  19   4.562   9.174  -4.966
  197    H2*    G  19           H2*        G  19   5.374  10.835  -3.420
  198   2HO*    G  19          2HO*        G  19   7.605  10.555  -4.082
  199    H1*    G  19           H1*        G  19   5.310  12.832  -5.228
  200    H8     G  19           H8         G  19   2.445  10.799  -6.439
  201    H1     G  19           H1         G  19   1.280  13.631  -0.758
  202   1H2     G  19          1H2         G  19   3.116  14.569  -0.019
  203   2H2     G  19          2H2         G  19   4.631  14.374  -0.889
  204   1H5*    A  20          1H5*        A  20   7.896   9.765  -2.332
  205   2H5*    A  20          2H5*        A  20   8.155   8.182  -1.569
  206    H4*    A  20           H4*        A  20   7.959   9.870   0.153
  207    H3*    A  20           H3*        A  20   5.496   8.141  -0.083
  208    H2*    A  20           H2*        A  20   4.859   9.088   2.065
  209   2HO*    A  20          2HO*        A  20   7.074   9.423   2.867
  210    H1*    A  20           H1*        A  20   5.174  11.537   1.155
  211    H8     A  20           H8         A  20   4.257   9.817  -2.017
  212   1H6     A  20          1H6         A  20  -1.598   9.856   0.065
  213   2H6     A  20          2H6         A  20  -0.539   9.662  -1.330
  214    H2     A  20           H2         A  20   1.033  10.723   3.492
  215   1H5*    U  21          1H5*        U  21   6.926   5.898   4.260
  216   2H5*    U  21          2H5*        U  21   5.791   6.373   3.015
  217    H4*    U  21           H4*        U  21   6.012   7.676   5.766
  218    H3*    U  21           H3*        U  21   4.222   5.518   4.635
  219    H2*    U  21           H2*        U  21   2.416   6.425   5.984
  220   2HO*    U  21          2HO*        U  21   3.883   6.952   7.760
  221    H1*    U  21           H1*        U  21   2.802   8.965   5.269
  222    H3     U  21           H3         U  21  -0.766   7.273   2.887
  223    H5     U  21           H5         U  21   2.599   6.658   0.474
  224    H6     U  21           H6         U  21   4.028   7.296   2.330
  225   1H5*    C  22          1H5*        C  22   3.184   5.289   8.698
  226   2H5*    C  22          2H5*        C  22   3.115   3.573   9.158
  227    H4*    C  22           H4*        C  22   0.945   4.689   9.473
  228    H3*    C  22           H3*        C  22   0.962   2.735   7.163
  229    H2*    C  22           H2*        C  22  -1.455   2.974   7.228
  230   2HO*    C  22          2HO*        C  22  -1.649   3.334   9.544
  231    H1*    C  22           H1*        C  22  -1.291   5.601   7.161
  232   1H4     C  22          1H4         C  22  -1.185   3.583   1.171
  233   2H4     C  22          2H4         C  22   0.584   3.638   1.140
  234    H5     C  22           H5         C  22   1.898   4.049   3.159
  235    H6     C  22           H6         C  22   1.750   4.560   5.505
  236   1H5*    A  23          1H5*        A  23  -1.962  -0.211  10.473
  237   2H5*    A  23          2H5*        A  23  -1.474   0.263   8.853
  238    H4*    A  23           H4*        A  23  -4.076   1.095  10.226
  239    H3*    A  23           H3*        A  23  -3.406  -0.996   8.196
  240    H2*    A  23           H2*        A  23  -5.512  -0.582   7.088
  241   2HO*    A  23          2HO*        A  23  -6.689  -0.019   9.124
  242    H1*    A  23           H1*        A  23  -5.098   1.987   6.862
  243    H8     A  23           H8         A  23  -1.527   1.061   6.998
  244   1H6     A  23          1H6         A  23  -2.089  -0.668   1.096
  245   2H6     A  23          2H6         A  23  -0.971  -0.329   2.432
  246    H2     A  23           H2         A  23  -6.151  -0.475   2.828
  247   1H5*    G  24          1H5*        G  24  -7.324  -1.523   7.243
  248   2H5*    G  24          2H5*        G  24  -8.168  -2.792   8.118
  249    H4*    G  24           H4*        G  24  -8.342  -3.297   5.826
  250    H3*    G  24           H3*        G  24  -7.213  -5.043   7.636
  251    H2*    G  24           H2*        G  24  -5.073  -5.033   6.996
  252   2HO*    G  24          2HO*        G  24  -6.146  -7.077   5.951
  253    H1*    G  24           H1*        G  24  -5.529  -4.507   4.093
  254    H8     G  24           H8         G  24  -4.384  -2.520   7.065
  255    H1     G  24           H1         G  24   0.268  -3.995   2.894
  256   1H2     G  24          1H2         G  24  -0.669  -5.228   1.185
  257   2H2     G  24          2H2         G  24  -2.337  -5.715   1.390
  258   1H5*    U  25          1H5*        U  25 -10.772  -6.147   4.975
  259   2H5*    U  25          2H5*        U  25 -11.341  -7.825   4.864
  260    H4*    U  25           H4*        U  25 -11.690  -6.654   2.733
  261    H3*    U  25           H3*        U  25  -9.584  -8.802   2.675
  262    H2*    U  25           H2*        U  25  -9.213  -8.277   0.376
  263   2HO*    U  25          2HO*        U  25 -11.397  -8.112  -0.178
  264    H1*    U  25           H1*        U  25  -9.376  -5.566   0.589
  265    H3     U  25           H3         U  25  -4.921  -5.452   0.217
  266    H5     U  25           H5         U  25  -5.485  -8.163   3.366
  267    H6     U  25           H6         U  25  -7.866  -7.858   3.136
  268   1H5*    A  26          1H5*        A  26 -10.680 -11.759  -1.291
  269   2H5*    A  26          2H5*        A  26  -9.314 -10.858  -0.657
  270    H4*    A  26           H4*        A  26 -11.068 -10.016  -3.006
  271    H3*    A  26           H3*        A  26  -8.387 -11.352  -2.723
  272    H2*    A  26           H2*        A  26  -7.454 -10.037  -4.471
  273   2HO*    A  26          2HO*        A  26  -9.513 -10.215  -5.692
  274    H1*    A  26           H1*        A  26  -8.420  -7.669  -3.715
  275    H8     A  26           H8         A  26  -7.863  -9.488  -0.495
  276   1H6     A  26          1H6         A  26  -2.085  -7.279  -0.885
  277   2H6     A  26          2H6         A  26  -3.303  -7.986   0.179
  278    H2     A  26           H2         A  26  -3.955  -6.810  -4.835
  279   1H5*    U  27          1H5*        U  27  -8.511 -11.494  -6.686
  280   2H5*    U  27          2H5*        U  27  -8.109 -13.111  -7.286
  281    H4*    U  27           H4*        U  27  -6.481 -11.553  -8.121
  282    H3*    U  27           H3*        U  27  -5.283 -13.287  -5.927
  283    H2*    U  27           H2*        U  27  -3.205 -12.240  -6.556
  284   2HO*    U  27          2HO*        U  27  -3.717 -12.235  -8.812
  285    H1*    U  27           H1*        U  27  -4.170  -9.740  -6.583
  286    H3     U  27           H3         U  27  -1.745 -10.162  -2.753
  287    H5     U  27           H5         U  27  -5.502 -11.753  -1.796
  288    H6     U  27           H6         U  27  -6.128 -11.587  -4.122
  289   1H5*    A  28          1H5*        A  28  -2.779 -13.631  -9.340
  290   2H5*    A  28          2H5*        A  28  -2.242 -15.306  -9.546
  291    H4*    A  28           H4*        A  28  -0.332 -13.808  -9.482
  292    H3*    A  28           H3*        A  28  -0.521 -15.598  -7.029
  293    H2*    A  28           H2*        A  28   1.602 -14.646  -6.424
  294   2HO*    A  28          2HO*        A  28   2.328 -14.615  -8.652
  295    H1*    A  28           H1*        A  28   0.907 -12.103  -6.848
  296    H8     A  28           H8         A  28  -2.279 -13.743  -5.717
  297   1H6     A  28          1H6         A  28  -0.175 -12.700   0.021
  298   2H6     A  28          2H6         A  28  -1.576 -13.121  -0.961
  299    H2     A  28           H2         A  28   3.196 -12.129  -2.750
  300   1H5*    U  29          1H5*        U  29   3.366 -15.879  -8.543
  301   2H5*    U  29          2H5*        U  29   3.989 -17.528  -8.475
  302    H4*    U  29           H4*        U  29   5.441 -15.961  -7.271
  303    H3*    U  29           H3*        U  29   4.083 -17.981  -5.410
  304    H2*    U  29           H2*        U  29   5.500 -17.021  -3.739
  305   2HO*    U  29          2HO*        U  29   7.289 -16.763  -5.169
  306    H1*    U  29           H1*        U  29   4.936 -14.483  -4.313
  307    H3     U  29           H3         U  29   2.646 -15.706  -0.562
  308    H5     U  29           H5         U  29   0.111 -16.737  -3.727
  309    H6     U  29           H6         U  29   1.885 -16.234  -5.275
  310   1H5*    C  30          1H5*        C  30   8.230 -18.043  -4.702
  311   2H5*    C  30          2H5*        C  30   8.821 -19.707  -4.600
  312    H4*    C  30           H4*        C  30   9.478 -18.421  -2.626
  313    H3*    C  30           H3*        C  30   7.478 -20.654  -2.088
  314    H2*    C  30           H2*        C  30   7.758 -20.106   0.221
  315   2HO*    C  30          2HO*        C  30  10.064 -19.720  -0.093
  316    H1*    C  30           H1*        C  30   7.565 -17.461  -0.032
  317   1H4     C  30          1H4         C  30   1.644 -19.169   1.012
  318   2H4     C  30          2H4         C  30   1.312 -19.244  -0.722
  319    H5     C  30           H5         C  30   3.067 -19.088  -2.385
  320    H6     C  30           H6         C  30   5.398 -18.695  -2.716
  321   1H5*    C  31          1H5*        C  31  10.655 -21.164   0.601
  322   2H5*    C  31          2H5*        C  31  11.229 -22.841   0.545
  323    H4*    C  31           H4*        C  31  10.687 -22.332   2.845
  324    H3*    C  31           H3*        C  31   8.549 -24.046   1.510
  325    H2*    C  31           H2*        C  31   7.578 -24.258   3.677
  326   2HO*    C  31          2HO*        C  31   9.742 -24.420   4.682
  327    H1*    C  31           H1*        C  31   7.849 -21.600   4.309
  328   1H4     C  31          1H4         C  31   2.033 -22.176   2.074
  329   2H4     C  31          2H4         C  31   2.601 -21.966   0.415
  330    H5     C  31           H5         C  31   4.940 -21.912  -0.176
  331    H6     C  31           H6         C  31   7.179 -21.922   0.680
  332    H3T    C  31           H3T        C  31  10.605 -25.000   1.666
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -4.328 -21.058   8.874
    2   2H5*    G   1          2H5*        G   1  -3.307 -21.941   7.742
    3    H4*    G   1           H4*        G   1  -2.701 -21.604  10.716
    4    H3*    G   1           H3*        G   1  -1.895 -20.001   8.288
    5    H2*    G   1           H2*        G   1   0.308 -19.727   9.269
    6   2HO*    G   1          2HO*        G   1  -0.528 -19.563  11.451
    7    H1*    G   1           H1*        G   1   0.665 -22.306   9.815
    8    H8     G   1           H8         G   1  -1.576 -22.581   6.856
    9    H1     G   1           H1         G   1   4.337 -20.581   5.335
   10   1H2     G   1          1H2         G   1   5.394 -19.960   7.190
   11   2H2     G   1          2H2         G   1   4.629 -20.117   8.760
   12    H5T    G   1           H5T        G   1  -3.558 -23.780   9.157
   13   1H5*    G   2          1H5*        G   2  -0.350 -17.934  11.538
   14   2H5*    G   2          2H5*        G   2  -0.690 -16.202  11.434
   15    H4*    G   2           H4*        G   2   1.712 -16.637  11.725
   16    H3*    G   2           H3*        G   2   0.916 -15.437   9.061
   17    H2*    G   2           H2*        G   2   3.322 -15.288   8.631
   18   2HO*    G   2          2HO*        G   2   3.759 -14.783  10.895
   19    H1*    G   2           H1*        G   2   3.858 -17.802   9.365
   20    H8     G   2           H8         G   2   0.447 -18.186   7.926
   21    H1     G   2           H1         G   2   4.936 -17.060   3.463
   22   1H2     G   2          1H2         G   2   6.787 -16.361   4.437
   23   2H2     G   2          2H2         G   2   6.910 -16.258   6.189
   24   1H5*    A   3          1H5*        A   3   4.199 -13.266  10.589
   25   2H5*    A   3          2H5*        A   3   3.977 -11.524  10.420
   26    H4*    A   3           H4*        A   3   6.104 -12.268   9.431
   27    H3*    A   3           H3*        A   3   4.054 -11.179   7.468
   28    H2*    A   3           H2*        A   3   5.772 -11.451   5.784
   29   2HO*    A   3          2HO*        A   3   7.472 -10.830   7.320
   30    H1*    A   3           H1*        A   3   6.447 -13.939   6.469
   31    H8     A   3           H8         A   3   2.806 -13.914   7.291
   32   1H6     A   3          1H6         A   3   1.813 -14.750   1.239
   33   2H6     A   3          2H6         A   3   1.088 -14.728   2.850
   34    H2     A   3           H2         A   3   6.067 -13.614   1.776
   35   1H5*    U   4          1H5*        U   4   7.738  -9.388   6.599
   36   2H5*    U   4          2H5*        U   4   7.588  -7.660   6.266
   37    H4*    U   4           H4*        U   4   8.657  -8.867   4.395
   38    H3*    U   4           H3*        U   4   5.923  -7.695   3.780
   39    H2*    U   4           H2*        U   4   6.371  -8.405   1.491
   40   2HO*    U   4          2HO*        U   4   8.641  -7.872   1.655
   41    H1*    U   4           H1*        U   4   7.226 -10.871   2.156
   42    H3     U   4           H3         U   4   3.047 -11.116   0.328
   43    H5     U   4           H5         U   4   2.416 -10.548   4.439
   44    H6     U   4           H6         U   4   4.769 -10.122   4.703
   45   1H5*    A   5          1H5*        A   5   8.554  -6.591   0.714
   46   2H5*    A   5          2H5*        A   5   8.325  -4.922   0.191
   47    H4*    A   5           H4*        A   5   8.164  -6.492  -1.691
   48    H3*    A   5           H3*        A   5   5.558  -5.056  -1.026
   49    H2*    A   5           H2*        A   5   4.676  -6.144  -2.984
   50   2HO*    A   5          2HO*        A   5   6.653  -5.901  -4.189
   51    H1*    A   5           H1*        A   5   5.618  -8.585  -2.399
   52    H8     A   5           H8         A   5   4.901  -7.165   0.987
   53   1H6     A   5          1H6         A   5  -1.029  -8.645  -0.148
   54   2H6     A   5          2H6         A   5   0.113  -8.107   1.090
   55    H2     A   5           H2         A   5   1.209  -8.910  -3.948
   56   1H5*    U   6          1H5*        U   6   6.243  -4.664  -5.240
   57   2H5*    U   6          2H5*        U   6   5.829  -3.013  -5.733
   58    H4*    U   6           H4*        U   6   4.561  -4.750  -6.986
   59    H3*    U   6           H3*        U   6   2.911  -2.865  -5.248
   60    H2*    U   6           H2*        U   6   1.008  -3.924  -6.216
   61   2HO*    U   6          2HO*        U   6   1.829  -4.032  -8.333
   62    H1*    U   6           H1*        U   6   1.942  -6.470  -6.010
   63    H3     U   6           H3         U   6  -1.401  -5.892  -2.970
   64    H5     U   6           H5         U   6   2.061  -4.565  -1.011
   65    H6     U   6           H6         U   6   3.272  -4.768  -3.077
   66   1H5*    A   7          1H5*        A   7  -0.213  -0.453  -8.453
   67   2H5*    A   7          2H5*        A   7  -0.219  -1.108  -6.822
   68    H4*    A   7           H4*        A   7  -1.324  -2.487  -9.317
   69    H3*    A   7           H3*        A   7  -2.410  -1.143  -6.853
   70    H2*    A   7           H2*        A   7  -4.297  -2.627  -6.809
   71   2HO*    A   7          2HO*        A   7  -3.898  -3.071  -9.369
   72    H1*    A   7           H1*        A   7  -2.732  -4.755  -6.798
   73    H8     A   7           H8         A   7  -0.162  -2.529  -5.357
   74   1H6     A   7          1H6         A   7  -3.344  -2.791  -0.042
   75   2H6     A   7          2H6         A   7  -1.795  -2.394  -0.784
   76    H2     A   7           H2         A   7  -5.990  -4.233  -3.261
   77   1H5*    U   8          1H5*        U   8  -6.535   0.378  -9.077
   78   2H5*    U   8          2H5*        U   8  -5.450   0.094  -7.719
   79    H4*    U   8           H4*        U   8  -7.959  -1.531  -8.324
   80    H3*    U   8           H3*        U   8  -7.389   0.860  -6.553
   81    H2*    U   8           H2*        U   8  -8.756  -0.017  -4.839
   82   2HO*    U   8          2HO*        U   8 -10.393  -0.766  -6.288
   83    H1*    U   8           H1*        U   8  -7.864  -2.543  -4.952
   84    H3     U   8           H3         U   8  -6.071  -0.422  -1.301
   85    H5     U   8           H5         U   8  -3.270   0.034  -4.398
   86    H6     U   8           H6         U   8  -4.900  -0.832  -5.954
   87   1H5*    G   9          1H5*        G   9 -11.157   3.545  -5.508
   88   2H5*    G   9          2H5*        G   9  -9.637   3.017  -4.807
   89    H4*    G   9           H4*        G   9 -12.405   1.960  -4.061
   90    H3*    G   9           H3*        G   9 -10.523   4.073  -3.101
   91    H2*    G   9           H2*        G   9 -10.920   3.576  -0.789
   92   2HO*    G   9          2HO*        G   9 -13.229   3.138  -1.235
   93    H1*    G   9           H1*        G   9 -10.616   0.947  -1.006
   94    H8     G   9           H8         G   9  -8.392   1.867  -3.807
   95    H1     G   9           H1         G   9  -5.846   3.337   1.947
   96   1H2     G   9          1H2         G   9  -7.395   3.274   3.483
   97   2H2     G   9          2H2         G   9  -9.060   2.874   3.076
   98   1H5*    A  10          1H5*        A  10 -13.575   5.187  -0.510
   99   2H5*    A  10          2H5*        A  10 -13.903   6.913  -0.765
  100    H4*    A  10           H4*        A  10 -13.178   6.552   1.530
  101    H3*    A  10           H3*        A  10 -10.983   7.832  -0.146
  102    H2*    A  10           H2*        A  10  -9.908   8.263   1.952
  103   2HO*    A  10          2HO*        A  10 -11.868   8.485   3.268
  104    H1*    A  10           H1*        A  10 -10.105   5.711   2.641
  105    H8     A  10           H8         A  10  -9.982   5.471  -1.085
  106   1H6     A  10          1H6         A  10  -3.843   6.333  -0.488
  107   2H6     A  10          2H6         A  10  -5.137   5.975  -1.629
  108    H2     A  10           H2         A  10  -5.723   7.069   3.435
  109   1H5*    U  11          1H5*        U  11 -11.879  12.105   2.118
  110   2H5*    U  11          2H5*        U  11 -10.904  10.881   1.318
  111    H4*    U  11           H4*        U  11 -10.570  11.775   4.214
  112    H3*    U  11           H3*        U  11  -8.969  12.262   1.678
  113    H2*    U  11           H2*        U  11  -7.104  12.710   3.137
  114   2HO*    U  11          2HO*        U  11  -8.366  13.502   4.994
  115    H1*    U  11           H1*        U  11  -7.462  10.335   4.330
  116    H3     U  11           H3         U  11  -4.245  10.014   1.078
  117    H5     U  11           H5         U  11  -7.872   9.286  -0.912
  118    H6     U  11           H6         U  11  -9.036   9.870   1.133
  119   1H5*    A  12          1H5*        A  12  -7.960  16.751   3.435
  120   2H5*    A  12          2H5*        A  12  -7.545  15.203   2.659
  121    H4*    A  12           H4*        A  12  -6.415  16.145   5.326
  122    H3*    A  12           H3*        A  12  -5.179  16.099   2.555
  123    H2*    A  12           H2*        A  12  -3.086  16.256   3.900
  124   2HO*    A  12          2HO*        A  12  -4.498  17.238   5.825
  125    H1*    A  12           H1*        A  12  -3.786  14.096   5.176
  126    H8     A  12           H8         A  12  -5.458  13.581   1.890
  127   1H6     A  12          1H6         A  12   0.277  12.497  -0.330
  128   2H6     A  12          2H6         A  12  -1.415  12.392  -0.759
  129    H2     A  12           H2         A  12   0.666  13.823   3.808
  130   1H5*    C  13          1H5*        C  13  -3.007  18.426   6.285
  131   2H5*    C  13          2H5*        C  13  -3.032  20.207   6.115
  132    H4*    C  13           H4*        C  13  -0.715  19.527   6.155
  133    H3*    C  13           H3*        C  13  -1.427  19.936   3.292
  134    H2*    C  13           H2*        C  13   0.988  19.670   3.099
  135   2HO*    C  13          2HO*        C  13   1.601  20.855   4.887
  136    H1*    C  13           H1*        C  13   1.133  17.532   4.793
  137   1H4     C  13          1H4         C  13   0.739  15.164  -1.033
  138   2H4     C  13          2H4         C  13  -1.018  15.325  -1.067
  139    H5     C  13           H5         C  13  -2.265  16.306   0.849
  140    H6     C  13           H6         C  13  -2.038  17.412   2.946
  141   1H5*    A  14          1H5*        A  14   2.248  23.595   2.254
  142   2H5*    A  14          2H5*        A  14   1.624  22.072   1.595
  143    H4*    A  14           H4*        A  14   4.056  22.342   3.427
  144    H3*    A  14           H3*        A  14   3.578  21.719   0.524
  145    H2*    A  14           H2*        A  14   5.585  20.384   0.544
  146   2HO*    A  14          2HO*        A  14   6.367  21.726   2.668
  147    H1*    A  14           H1*        A  14   4.621  18.892   2.522
  148    H8     A  14           H8         A  14   1.298  19.840   1.326
  149   1H6     A  14          1H6         A  14   2.434  16.566  -3.851
  150   2H6     A  14          2H6         A  14   1.202  17.411  -2.919
  151    H2     A  14           H2         A  14   6.269  17.073  -1.719
  152   1H5*    A  15          1H5*        A  15   9.207  23.734   0.544
  153   2H5*    A  15          2H5*        A  15   7.964  24.546  -0.424
  154    H4*    A  15           H4*        A  15   9.515  23.371  -1.869
  155    H3*    A  15           H3*        A  15   6.793  23.214  -1.966
  156    H2*    A  15           H2*        A  15   6.635  21.137  -0.891
  157   2HO*    A  15          2HO*        A  15   6.709  20.805  -3.687
  158    H1*    A  15           H1*        A  15   8.938  20.374  -2.690
  159    H8     A  15           H8         A  15   7.481  19.741   0.843
  160   1H6     A  15          1H6         A  15   9.983  14.108   0.147
  161   2H6     A  15          2H6         A  15   9.013  15.128   1.204
  162    H2     A  15           H2         A  15  11.029  16.549  -3.380
  163   1H5*    U  16          1H5*        U  16  11.305  23.577  -6.049
  164   2H5*    U  16          2H5*        U  16   9.903  22.595  -6.497
  165    H4*    U  16           H4*        U  16  11.959  21.312  -6.732
  166    H3*    U  16           H3*        U  16  10.173  20.465  -4.460
  167    H2*    U  16           H2*        U  16  11.464  18.493  -4.301
  168   2HO*    U  16          2HO*        U  16  11.720  18.273  -6.708
  169    H1*    U  16           H1*        U  16  13.831  19.832  -4.834
  170    H3     U  16           H3         U  16  14.959  19.144  -0.554
  171    H5     U  16           H5         U  16  10.996  20.507  -0.271
  172    H6     U  16           H6         U  16  10.964  20.742  -2.648
  173   1H5*    U  17          1H5*        U  17   8.909  16.794  -8.838
  174   2H5*    U  17          2H5*        U  17   8.266  17.208  -7.257
  175    H4*    U  17           H4*        U  17  10.552  15.242  -7.440
  176    H3*    U  17           H3*        U  17   8.019  14.811  -8.737
  177    H2*    U  17           H2*        U  17   6.832  13.467  -7.192
  178   2HO*    U  17          2HO*        U  17   9.014  12.204  -7.147
  179    H1*    U  17           H1*        U  17   7.788  14.232  -4.793
  180    H3     U  17           H3         U  17   5.699  18.310  -4.131
  181    H5     U  17           H5         U  17   4.464  16.952  -7.902
  182    H6     U  17           H6         U  17   6.068  15.212  -7.779
  183   1H5*    U  18          1H5*        U  18   7.469  11.414  -8.453
  184   2H5*    U  18          2H5*        U  18   7.759  10.464  -9.901
  185    H4*    U  18           H4*        U  18   5.444  11.940 -10.516
  186    H3*    U  18           H3*        U  18   5.616  11.633  -7.627
  187    H2*    U  18           H2*        U  18   4.072   9.920  -7.219
  188   2HO*    U  18          2HO*        U  18   2.397  10.953  -8.350
  189    H1*    U  18           H1*        U  18   4.333   8.356  -9.378
  190    H3     U  18           H3         U  18   8.451   6.344  -8.803
  191    H5     U  18           H5         U  18   8.039   9.020  -5.610
  192    H6     U  18           H6         U  18   6.084   9.909  -6.636
  193   1H5*    G  19          1H5*        G  19   5.331  12.298  -4.716
  194   2H5*    G  19          2H5*        G  19   3.938  11.434  -5.372
  195    H4*    G  19           H4*        G  19   3.927  13.901  -3.577
  196    H3*    G  19           H3*        G  19   3.080  11.008  -3.163
  197    H2*    G  19           H2*        G  19   1.505  11.865  -1.547
  198   2HO*    G  19          2HO*        G  19   3.021  13.630  -0.895
  199    H1*    G  19           H1*        G  19   0.489  13.612  -3.176
  200    H8     G  19           H8         G  19   1.912  10.750  -5.188
  201    H1     G  19           H1         G  19  -4.032   9.782  -2.974
  202   1H2     G  19          1H2         G  19  -4.565  11.388  -1.586
  203   2H2     G  19          2H2         G  19  -3.518  12.731  -1.228
  204   1H5*    A  20          1H5*        A  20   5.765   8.636   0.096
  205   2H5*    A  20          2H5*        A  20   4.328   9.266  -0.693
  206    H4*    A  20           H4*        A  20   5.402  10.241   1.996
  207    H3*    A  20           H3*        A  20   3.172   8.380   1.177
  208    H2*    A  20           H2*        A  20   1.985   9.037   3.176
  209   2HO*    A  20          2HO*        A  20   3.907   9.537   4.518
  210    H1*    A  20           H1*        A  20   2.123  11.592   2.468
  211    H8     A  20           H8         A  20   2.435  10.051  -0.895
  212   1H6     A  20          1H6         A  20  -3.544   8.548  -0.548
  213   2H6     A  20          2H6         A  20  -2.087   8.499  -1.522
  214    H2     A  20           H2         A  20  -2.331  10.184   3.404
  215   1H5*    U  21          1H5*        U  21   3.745   5.907   5.625
  216   2H5*    U  21          2H5*        U  21   2.913   6.339   4.136
  217    H4*    U  21           H4*        U  21   2.239   7.436   6.910
  218    H3*    U  21           H3*        U  21   0.974   5.394   5.078
  219    H2*    U  21           H2*        U  21  -1.152   5.919   6.156
  220   2HO*    U  21          2HO*        U  21  -0.137   6.618   8.257
  221    H1*    U  21           H1*        U  21  -0.835   8.481   5.587
  222    H3     U  21           H3         U  21  -3.386   6.359   2.353
  223    H5     U  21           H5         U  21   0.565   6.390   0.924
  224    H6     U  21           H6         U  21   1.308   7.169   3.076
  225   1H5*    C  22          1H5*        C  22  -0.614   2.860   9.182
  226   2H5*    C  22          2H5*        C  22  -0.609   3.287   7.473
  227    H4*    C  22           H4*        C  22  -2.743   4.145   9.480
  228    H3*    C  22           H3*        C  22  -2.501   1.855   7.524
  229    H2*    C  22           H2*        C  22  -4.818   2.061   7.008
  230   2HO*    C  22          2HO*        C  22  -5.512   2.429   9.159
  231    H1*    C  22           H1*        C  22  -4.881   4.741   6.749
  232   1H4     C  22          1H4         C  22  -3.522   2.808   0.917
  233   2H4     C  22          2H4         C  22  -1.818   2.948   1.254
  234    H5     C  22           H5         C  22  -0.949   3.448   3.459
  235    H6     C  22           H6         C  22  -1.540   3.962   5.748
  236   1H5*    A  23          1H5*        A  23  -6.019  -1.638   8.919
  237   2H5*    A  23          2H5*        A  23  -5.188  -1.027   7.491
  238    H4*    A  23           H4*        A  23  -7.863  -0.021   8.561
  239    H3*    A  23           H3*        A  23  -6.940  -1.645   6.200
  240    H2*    A  23           H2*        A  23  -8.806  -0.720   4.913
  241   2HO*    A  23          2HO*        A  23 -10.053  -0.208   7.081
  242    H1*    A  23           H1*        A  23  -7.889   1.721   5.318
  243    H8     A  23           H8         A  23  -4.634   0.292   6.058
  244   1H6     A  23          1H6         A  23  -3.900  -0.750   0.004
  245   2H6     A  23          2H6         A  23  -3.096  -0.641   1.567
  246    H2     A  23           H2         A  23  -8.229  -0.286   0.780
  247   1H5*    G  24          1H5*        G  24 -11.581  -0.799   5.795
  248   2H5*    G  24          2H5*        G  24 -12.530  -2.284   5.946
  249    H4*    G  24           H4*        G  24 -12.541  -1.348   3.636
  250    H3*    G  24           H3*        G  24 -11.259  -4.055   4.058
  251    H2*    G  24           H2*        G  24 -11.014  -4.154   1.653
  252   2HO*    G  24          2HO*        G  24 -13.080  -3.203   1.234
  253    H1*    G  24           H1*        G  24 -10.078  -1.629   1.376
  254    H8     G  24           H8         G  24  -8.443  -2.680   4.563
  255    H1     G  24           H1         G  24  -6.144  -5.768  -0.573
  256   1H2     G  24          1H2         G  24  -7.513  -5.416  -2.308
  257   2H2     G  24          2H2         G  24  -8.903  -4.363  -2.154
  258   1H5*    U  25          1H5*        U  25 -14.071  -7.067   0.737
  259   2H5*    U  25          2H5*        U  25 -12.645  -7.413   1.724
  260    H4*    U  25           H4*        U  25 -12.648  -6.012  -0.984
  261    H3*    U  25           H3*        U  25 -12.132  -8.807  -0.039
  262    H2*    U  25           H2*        U  25 -10.118  -9.016  -1.200
  263   2HO*    U  25          2HO*        U  25 -10.801  -7.848  -3.099
  264    H1*    U  25           H1*        U  25  -8.985  -6.735  -0.434
  265    H3     U  25           H3         U  25  -8.171 -10.556   2.310
  266    H5     U  25           H5         U  25 -10.394  -7.718   4.454
  267    H6     U  25           H6         U  25 -10.747  -6.500   2.402
  268   1H5*    A  26          1H5*        A  26 -10.457 -11.190  -3.869
  269   2H5*    A  26          2H5*        A  26  -9.779  -9.941  -2.867
  270    H4*    A  26           H4*        A  26  -9.977  -9.768  -5.889
  271    H3*    A  26           H3*        A  26  -7.723 -10.668  -4.067
  272    H2*    A  26           H2*        A  26  -6.196  -9.690  -5.691
  273   2HO*    A  26          2HO*        A  26  -7.527 -10.271  -7.538
  274    H1*    A  26           H1*        A  26  -7.468  -7.344  -5.788
  275    H8     A  26           H8         A  26  -8.247  -8.556  -2.338
  276   1H6     A  26          1H6         A  26  -2.578  -6.499  -0.775
  277   2H6     A  26          2H6         A  26  -4.131  -7.038  -0.140
  278    H2     A  26           H2         A  26  -2.840  -6.623  -5.189
  279   1H5*    U  27          1H5*        U  27  -6.503 -11.548  -7.939
  280   2H5*    U  27          2H5*        U  27  -5.849 -13.191  -8.062
  281    H4*    U  27           H4*        U  27  -4.243 -11.513  -8.899
  282    H3*    U  27           H3*        U  27  -3.388 -12.976  -6.363
  283    H2*    U  27           H2*        U  27  -1.288 -11.822  -6.660
  284   2HO*    U  27          2HO*        U  27  -1.316 -11.994  -8.965
  285    H1*    U  27           H1*        U  27  -2.368  -9.402  -7.044
  286    H3     U  27           H3         U  27  -0.689  -9.848  -2.779
  287    H5     U  27           H5         U  27  -4.718 -10.961  -2.528
  288    H6     U  27           H6         U  27  -4.832 -10.914  -4.927
  289   1H5*    A  28          1H5*        A  28  -0.354 -13.338  -9.403
  290   2H5*    A  28          2H5*        A  28   0.379 -14.951  -9.391
  291    H4*    A  28           H4*        A  28   2.083 -13.191  -9.222
  292    H3*    A  28           H3*        A  28   1.792 -14.912  -6.729
  293    H2*    A  28           H2*        A  28   3.686 -13.670  -5.887
  294   2HO*    A  28          2HO*        A  28   4.722 -13.578  -7.991
  295    H1*    A  28           H1*        A  28   2.723 -11.252  -6.510
  296    H8     A  28           H8         A  28  -0.381 -13.236  -5.751
  297   1H6     A  28          1H6         A  28   0.791 -12.042   0.195
  298   2H6     A  28          2H6         A  28  -0.377 -12.645  -0.974
  299    H2     A  28           H2         A  28   4.427 -10.984  -2.141
  300   1H5*    U  29          1H5*        U  29   5.839 -14.677  -7.741
  301   2H5*    U  29          2H5*        U  29   6.690 -16.208  -7.522
  302    H4*    U  29           H4*        U  29   7.729 -14.383  -6.224
  303    H3*    U  29           H3*        U  29   6.451 -16.562  -4.507
  304    H2*    U  29           H2*        U  29   7.493 -15.363  -2.671
  305   2HO*    U  29          2HO*        U  29   9.401 -14.823  -3.851
  306    H1*    U  29           H1*        U  29   6.627 -12.944  -3.435
  307    H3     U  29           H3         U  29   4.105 -14.417   0.089
  308    H5     U  29           H5         U  29   2.155 -15.865  -3.323
  309    H6     U  29           H6         U  29   4.033 -15.165  -4.657
  310   1H5*    C  30          1H5*        C  30  10.423 -15.918  -3.294
  311   2H5*    C  30          2H5*        C  30  11.260 -17.421  -2.882
  312    H4*    C  30           H4*        C  30  11.308 -15.809  -1.017
  313    H3*    C  30           H3*        C  30   9.654 -18.319  -0.476
  314    H2*    C  30           H2*        C  30   9.533 -17.451   1.790
  315   2HO*    C  30          2HO*        C  30  11.759 -16.556   1.563
  316    H1*    C  30           H1*        C  30   8.800 -14.973   1.044
  317   1H4     C  30          1H4         C  30   3.307 -17.984   1.541
  318   2H4     C  30          2H4         C  30   3.296 -18.302  -0.190
  319    H5     C  30           H5         C  30   5.254 -17.910  -1.602
  320    H6     C  30           H6         C  30   7.468 -17.003  -1.645
  321   1H5*    C  31          1H5*        C  31  12.192 -17.710   2.755
  322   2H5*    C  31          2H5*        C  31  13.070 -19.195   3.147
  323    H4*    C  31           H4*        C  31  11.955 -18.382   5.156
  324    H3*    C  31           H3*        C  31  10.638 -20.835   3.921
  325    H2*    C  31           H2*        C  31   9.299 -20.915   5.920
  326   2HO*    C  31          2HO*        C  31  11.127 -20.226   7.284
  327    H1*    C  31           H1*        C  31   8.732 -18.244   5.886
  328   1H4     C  31          1H4         C  31   4.034 -21.027   2.772
  329   2H4     C  31          2H4         C  31   4.895 -20.870   1.241
  330    H5     C  31           H5         C  31   7.207 -20.095   1.106
  331    H6     C  31           H6         C  31   9.067 -19.269   2.384
  332    H3T    C  31           H3T        C  31  12.766 -21.134   4.658
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -8.648 -24.821   5.540
    2   2H5*    G   1          2H5*        G   1  -8.634 -23.167   6.189
    3    H4*    G   1           H4*        G   1  -6.994 -24.469   7.391
    4    H3*    G   1           H3*        G   1  -5.770 -22.515   5.423
    5    H2*    G   1           H2*        G   1  -3.635 -23.131   6.375
    6   2HO*    G   1          2HO*        G   1  -4.445 -23.328   8.542
    7    H1*    G   1           H1*        G   1  -4.059 -25.760   6.210
    8    H8     G   1           H8         G   1  -6.021 -24.622   3.273
    9    H1     G   1           H1         G   1   0.312 -24.008   2.398
   10   1H2     G   1          1H2         G   1   1.343 -24.222   4.349
   11   2H2     G   1          2H2         G   1   0.439 -24.565   5.816
   12    H5T    G   1           H5T        G   1  -7.386 -22.527   4.408
   13   1H5*    G   2          1H5*        G   2  -3.923 -21.865   9.104
   14   2H5*    G   2          2H5*        G   2  -3.779 -20.142   9.468
   15    H4*    G   2           H4*        G   2  -1.607 -21.280   9.613
   16    H3*    G   2           H3*        G   2  -1.860 -19.255   7.369
   17    H2*    G   2           H2*        G   2   0.517 -19.684   6.984
   18   2HO*    G   2          2HO*        G   2   0.924 -19.929   9.288
   19    H1*    G   2           H1*        G   2   0.299 -22.342   6.998
   20    H8     G   2           H8         G   2  -2.993 -21.388   5.553
   21    H1     G   2           H1         G   2   1.897 -20.376   1.502
   22   1H2     G   2          1H2         G   2   3.803 -20.486   2.603
   23   2H2     G   2          2H2         G   2   3.837 -20.894   4.315
   24   1H5*    A   3          1H5*        A   3   1.752 -18.573   9.448
   25   2H5*    A   3          2H5*        A   3   2.033 -16.859   9.749
   26    H4*    A   3           H4*        A   3   3.940 -17.900   8.606
   27    H3*    A   3           H3*        A   3   2.434 -15.812   6.986
   28    H2*    A   3           H2*        A   3   4.189 -16.119   5.331
   29   2HO*    A   3          2HO*        A   3   5.826 -16.449   7.010
   30    H1*    A   3           H1*        A   3   4.054 -18.777   5.295
   31    H8     A   3           H8         A   3   0.518 -17.911   6.097
   32   1H6     A   3          1H6         A   3  -0.214 -16.769   0.074
   33   2H6     A   3          2H6         A   3  -1.015 -16.981   1.630
   34    H2     A   3           H2         A   3   4.137 -16.986   0.878
   35   1H5*    U   4          1H5*        U   4   6.539 -15.029   6.782
   36   2H5*    U   4          2H5*        U   4   6.916 -13.313   6.943
   37    H4*    U   4           H4*        U   4   7.833 -14.278   4.850
   38    H3*    U   4           H3*        U   4   5.656 -12.184   4.498
   39    H2*    U   4           H2*        U   4   6.144 -12.388   2.116
   40   2HO*    U   4          2HO*        U   4   8.421 -12.671   2.473
   41    H1*    U   4           H1*        U   4   6.100 -15.069   2.077
   42    H3     U   4           H3         U   4   2.265 -13.387   0.200
   43    H5     U   4           H5         U   4   1.394 -13.892   4.274
   44    H6     U   4           H6         U   4   3.714 -14.317   4.681
   45   1H5*    A   5          1H5*        A   5   8.960 -11.252   2.046
   46   2H5*    A   5          2H5*        A   5   9.273  -9.520   1.959
   47    H4*    A   5           H4*        A   5   8.952 -10.495  -0.274
   48    H3*    A   5           H3*        A   5   6.773  -8.544   0.573
   49    H2*    A   5           H2*        A   5   5.970  -8.803  -1.710
   50   2HO*    A   5          2HO*        A   5   8.136  -8.986  -2.589
   51    H1*    A   5           H1*        A   5   5.991 -11.465  -1.653
   52    H8     A   5           H8         A   5   5.309 -10.627   1.932
   53   1H6     A   5          1H6         A   5  -0.574  -9.774   0.195
   54   2H6     A   5          2H6         A   5   0.523  -9.954   1.568
   55    H2     A   5           H2         A   5   1.910  -9.854  -3.454
   56   1H5*    U   6          1H5*        U   6   8.196  -7.490  -3.261
   57   2H5*    U   6          2H5*        U   6   8.359  -5.734  -3.423
   58    H4*    U   6           H4*        U   6   6.877  -6.748  -5.165
   59    H3*    U   6           H3*        U   6   5.691  -4.733  -3.239
   60    H2*    U   6           H2*        U   6   3.649  -4.931  -4.468
   61   2HO*    U   6          2HO*        U   6   4.591  -4.948  -6.528
   62    H1*    U   6           H1*        U   6   3.668  -7.603  -4.760
   63    H3     U   6           H3         U   6   0.358  -6.533  -1.853
   64    H5     U   6           H5         U   6   3.808  -6.856   0.522
   65    H6     U   6           H6         U   6   5.108  -7.033  -1.477
   66   1H5*    A   7          1H5*        A   7   3.730  -1.161  -6.450
   67   2H5*    A   7          2H5*        A   7   3.399  -1.828  -4.853
   68    H4*    A   7           H4*        A   7   2.237  -2.839  -7.480
   69    H3*    A   7           H3*        A   7   1.342  -0.980  -5.323
   70    H2*    A   7           H2*        A   7  -0.741  -2.045  -4.979
   71   2HO*    A   7          2HO*        A   7  -0.980  -2.277  -7.358
   72    H1*    A   7           H1*        A   7   0.012  -4.611  -5.113
   73    H8     A   7           H8         A   7   3.051  -3.271  -3.479
   74   1H6     A   7          1H6         A   7  -0.324  -2.729   1.697
   75   2H6     A   7          2H6         A   7   1.310  -2.640   1.012
   76    H2     A   7           H2         A   7  -3.069  -3.714  -1.590
   77   1H5*    U   8          1H5*        U   8  -2.245  -0.992  -7.338
   78   2H5*    U   8          2H5*        U   8  -2.753   0.689  -7.520
   79    H4*    U   8           H4*        U   8  -4.382  -0.565  -6.210
   80    H3*    U   8           H3*        U   8  -2.805   1.328  -4.439
   81    H2*    U   8           H2*        U   8  -4.635   0.852  -2.869
   82   2HO*    U   8          2HO*        U   8  -6.135   0.262  -4.869
   83    H1*    U   8           H1*        U   8  -4.199  -1.739  -3.103
   84    H3     U   8           H3         U   8  -2.155  -0.065   0.664
   85    H5     U   8           H5         U   8   0.692   0.278  -2.409
   86    H6     U   8           H6         U   8  -1.018  -0.324  -3.994
   87   1H5*    G   9          1H5*        G   9  -7.958   1.358  -4.261
   88   2H5*    G   9          2H5*        G   9  -8.428   3.026  -4.680
   89    H4*    G   9           H4*        G   9  -9.071   2.449  -2.396
   90    H3*    G   9           H3*        G   9  -6.782   4.469  -2.442
   91    H2*    G   9           H2*        G   9  -7.197   4.584  -0.055
   92   2HO*    G   9          2HO*        G   9  -9.514   4.328  -0.297
   93    H1*    G   9           H1*        G   9  -7.175   1.924   0.296
   94    H8     G   9           H8         G   9  -4.830   2.709  -2.632
   95    H1     G   9           H1         G   9  -2.387   4.047   3.166
   96   1H2     G   9          1H2         G   9  -4.005   4.000   4.667
   97   2H2     G   9          2H2         G   9  -5.639   3.474   4.232
   98   1H5*    A  10          1H5*        A  10  -9.805   5.887   0.181
   99   2H5*    A  10          2H5*        A  10 -10.046   7.618  -0.100
  100    H4*    A  10           H4*        A  10  -9.608   7.137   2.274
  101    H3*    A  10           H3*        A  10  -7.329   8.549   0.873
  102    H2*    A  10           H2*        A  10  -6.513   8.969   3.127
  103   2HO*    A  10          2HO*        A  10  -8.624   9.008   4.208
  104    H1*    A  10           H1*        A  10  -6.610   6.379   3.682
  105    H8     A  10           H8         A  10  -6.098   6.222  -0.014
  106   1H6     A  10          1H6         A  10  -0.166   7.707   1.085
  107   2H6     A  10          2H6         A  10  -1.320   7.119  -0.091
  108    H2     A  10           H2         A  10  -2.453   8.565   4.763
  109   1H5*    U  11          1H5*        U  11  -8.677  12.675   3.465
  110   2H5*    U  11          2H5*        U  11  -7.574  11.619   2.597
  111    H4*    U  11           H4*        U  11  -7.573  12.004   5.623
  112    H3*    U  11           H3*        U  11  -5.880  13.109   3.374
  113    H2*    U  11           H2*        U  11  -4.099  13.370   5.032
  114   2HO*    U  11          2HO*        U  11  -5.941  13.371   6.870
  115    H1*    U  11           H1*        U  11  -4.289  10.797   5.651
  116    H3     U  11           H3         U  11  -1.002  11.497   2.462
  117    H5     U  11           H5         U  11  -4.461  10.391   0.352
  118    H6     U  11           H6         U  11  -5.737  10.617   2.387
  119   1H5*    A  12          1H5*        A  12  -5.731  17.532   5.791
  120   2H5*    A  12          2H5*        A  12  -5.091  16.320   4.672
  121    H4*    A  12           H4*        A  12  -3.756  17.272   7.240
  122    H3*    A  12           H3*        A  12  -3.353  17.778   4.284
  123    H2*    A  12           H2*        A  12  -0.953  17.923   4.719
  124   2HO*    A  12          2HO*        A  12  -1.358  18.951   6.829
  125    H1*    A  12           H1*        A  12  -0.820  15.690   6.087
  126    H8     A  12           H8         A  12  -3.698  14.915   3.848
  127   1H6     A  12          1H6         A  12   0.561  13.643  -0.483
  128   2H6     A  12          2H6         A  12  -1.124  13.450  -0.028
  129    H2     A  12           H2         A  12   2.579  15.727   2.842
  130   1H5*    C  13          1H5*        C  13  -0.780  20.277   5.966
  131   2H5*    C  13          2H5*        C  13  -1.043  21.978   5.523
  132    H4*    C  13           H4*        C  13   1.290  21.400   5.135
  133    H3*    C  13           H3*        C  13  -0.292  21.754   2.603
  134    H2*    C  13           H2*        C  13   1.697  21.218   1.383
  135   2HO*    C  13          2HO*        C  13   2.954  22.462   2.975
  136    H1*    C  13           H1*        C  13   2.501  19.158   2.872
  137   1H4     C  13          1H4         C  13  -0.816  16.287  -1.585
  138   2H4     C  13          2H4         C  13  -2.210  16.228  -0.504
  139    H5     C  13           H5         C  13  -2.302  17.469   1.582
  140    H6     C  13           H6         C  13  -1.060  18.883   3.040
  141   1H5*    A  14          1H5*        A  14  -1.089  25.812   1.038
  142   2H5*    A  14          2H5*        A  14  -1.346  24.277   0.212
  143    H4*    A  14           H4*        A  14   1.252  25.624   0.972
  144    H3*    A  14           H3*        A  14   0.087  24.309  -1.490
  145    H2*    A  14           H2*        A  14   2.398  24.194  -2.273
  146   2HO*    A  14          2HO*        A  14   3.035  26.175  -1.149
  147    H1*    A  14           H1*        A  14   3.136  22.837  -0.153
  148    H8     A  14           H8         A  14  -0.200  21.777   0.332
  149   1H6     A  14          1H6         A  14   0.021  18.455  -4.906
  150   2H6     A  14          2H6         A  14  -0.822  18.721  -3.399
  151    H2     A  14           H2         A  14   3.232  21.574  -5.070
  152   1H5*    A  15          1H5*        A  15  -0.571  27.910  -4.914
  153   2H5*    A  15          2H5*        A  15  -2.129  27.184  -4.507
  154    H4*    A  15           H4*        A  15  -1.737  26.793  -6.799
  155    H3*    A  15           H3*        A  15  -2.327  24.646  -5.192
  156    H2*    A  15           H2*        A  15  -0.201  24.006  -4.760
  157   2HO*    A  15          2HO*        A  15  -1.486  22.373  -6.150
  158    H1*    A  15           H1*        A  15   0.670  24.312  -7.623
  159    H8     A  15           H8         A  15   1.449  24.663  -3.959
  160   1H6     A  15          1H6         A  15   7.405  24.419  -5.660
  161   2H6     A  15          2H6         A  15   6.289  24.576  -4.286
  162    H2     A  15           H2         A  15   4.851  24.160  -9.251
  163   1H5*    U  16          1H5*        U  16  -2.482  24.060 -10.090
  164   2H5*    U  16          2H5*        U  16  -3.448  22.603 -10.392
  165    H4*    U  16           H4*        U  16  -1.637  22.565 -11.956
  166    H3*    U  16           H3*        U  16  -1.067  20.701  -9.635
  167    H2*    U  16           H2*        U  16   0.831  20.072 -10.723
  168   2HO*    U  16          2HO*        U  16  -0.187  19.808 -12.883
  169    H1*    U  16           H1*        U  16   1.484  22.536 -11.855
  170    H3     U  16           H3         U  16   4.952  21.279  -9.248
  171    H5     U  16           H5         U  16   1.706  21.755  -6.586
  172    H6     U  16           H6         U  16   0.322  22.148  -8.382
  173   1H5*    U  17          1H5*        U  17  -1.007  16.076 -11.101
  174   2H5*    U  17          2H5*        U  17  -1.985  16.349  -9.676
  175    H4*    U  17           H4*        U  17   1.025  16.739  -9.631
  176    H3*    U  17           H3*        U  17  -0.205  14.264 -10.254
  177    H2*    U  17           H2*        U  17  -0.606  13.214  -8.236
  178   2HO*    U  17          2HO*        U  17   1.605  12.918  -7.991
  179    H1*    U  17           H1*        U  17  -0.252  15.129  -6.289
  180    H3     U  17           H3         U  17  -4.590  16.520  -5.819
  181    H5     U  17           H5         U  17  -4.612  14.065  -9.219
  182    H6     U  17           H6         U  17  -2.242  13.969  -9.136
  183   1H5*    U  18          1H5*        U  18   4.117  12.033  -8.169
  184   2H5*    U  18          2H5*        U  18   3.678  13.713  -7.889
  185    H4*    U  18           H4*        U  18   6.329  13.043  -9.180
  186    H3*    U  18           H3*        U  18   5.541  12.265  -6.521
  187    H2*    U  18           H2*        U  18   6.529  13.913  -5.154
  188   2HO*    U  18          2HO*        U  18   8.572  13.437  -6.317
  189    H1*    U  18           H1*        U  18   6.578  16.105  -6.748
  190    H3     U  18           H3         U  18   2.406  17.802  -6.128
  191    H5     U  18           H5         U  18   2.259  13.941  -4.482
  192    H6     U  18           H6         U  18   4.404  13.499  -5.367
  193   1H5*    G  19          1H5*        G  19   9.602  12.487  -5.284
  194   2H5*    G  19          2H5*        G  19   9.933  10.940  -4.492
  195    H4*    G  19           H4*        G  19  10.213  12.868  -2.970
  196    H3*    G  19           H3*        G  19   8.005  10.901  -2.175
  197    H2*    G  19           H2*        G  19   7.702  12.199  -0.259
  198   2HO*    G  19          2HO*        G  19   9.943  12.537   0.116
  199    H1*    G  19           H1*        G  19   7.760  14.604  -1.476
  200    H8     G  19           H8         G  19   6.216  11.354  -2.816
  201    H1     G  19           H1         G  19   2.154  16.038  -1.162
  202   1H2     G  19          1H2         G  19   3.354  17.842  -0.575
  203   2H2     G  19          2H2         G  19   5.091  17.792  -0.587
  204   1H5*    A  20          1H5*        A  20   8.972   8.937   2.150
  205   2H5*    A  20          2H5*        A  20   7.589   9.526   1.237
  206    H4*    A  20           H4*        A  20   9.016  11.019   3.486
  207    H3*    A  20           H3*        A  20   6.554   9.328   3.184
  208    H2*    A  20           H2*        A  20   5.336  10.750   4.731
  209   2HO*    A  20          2HO*        A  20   7.248  11.141   6.064
  210    H1*    A  20           H1*        A  20   5.946  13.010   3.483
  211    H8     A  20           H8         A  20   6.277  10.842   0.491
  212   1H6     A  20          1H6         A  20   0.080  10.647   0.254
  213   2H6     A  20          2H6         A  20   1.592  10.394  -0.621
  214    H2     A  20           H2         A  20   1.184  12.042   4.300
  215   1H5*    U  21          1H5*        U  21   6.617   9.734   7.336
  216   2H5*    U  21          2H5*        U  21   6.532   8.138   8.122
  217    H4*    U  21           H4*        U  21   4.622   9.534   8.821
  218    H3*    U  21           H3*        U  21   3.908   7.321   6.892
  219    H2*    U  21           H2*        U  21   1.597   7.807   7.480
  220   2HO*    U  21          2HO*        U  21   2.030   8.585   9.684
  221    H1*    U  21           H1*        U  21   1.937  10.377   6.893
  222    H3     U  21           H3         U  21  -0.061   8.101   3.439
  223    H5     U  21           H5         U  21   4.039   8.035   2.598
  224    H6     U  21           H6         U  21   4.448   8.959   4.776
  225   1H5*    C  22          1H5*        C  22   1.619   4.884  10.651
  226   2H5*    C  22          2H5*        C  22   1.945   5.295   8.978
  227    H4*    C  22           H4*        C  22  -0.571   6.102  10.506
  228    H3*    C  22           H3*        C  22   0.061   3.955   8.474
  229    H2*    C  22           H2*        C  22  -2.266   4.041   7.801
  230   2HO*    C  22          2HO*        C  22  -3.134   4.710   9.910
  231    H1*    C  22           H1*        C  22  -2.114   6.651   7.421
  232   1H4     C  22          1H4         C  22   0.171   4.051   2.139
  233   2H4     C  22          2H4         C  22   1.821   4.411   2.669
  234    H5     C  22           H5         C  22   2.329   5.187   4.938
  235    H6     C  22           H6         C  22   1.330   5.868   7.044
  236   1H5*    A  23          1H5*        A  23  -3.510   1.066  10.890
  237   2H5*    A  23          2H5*        A  23  -2.482   1.470   9.524
  238    H4*    A  23           H4*        A  23  -5.483   2.003   9.677
  239    H3*    A  23           H3*        A  23  -3.783  -0.203   8.542
  240    H2*    A  23           H2*        A  23  -5.208  -0.325   6.582
  241   2HO*    A  23          2HO*        A  23  -7.143   0.168   7.935
  242    H1*    A  23           H1*        A  23  -5.212   2.251   6.080
  243    H8     A  23           H8         A  23  -1.906   2.088   7.692
  244   1H6     A  23          1H6         A  23   0.139  -0.354   2.352
  245   2H6     A  23          2H6         A  23   0.634   0.295   3.918
  246    H2     A  23           H2         A  23  -4.257  -0.612   2.361
  247   1H5*    G  24          1H5*        G  24  -7.053  -1.453   6.784
  248   2H5*    G  24          2H5*        G  24  -7.760  -2.718   7.800
  249    H4*    G  24           H4*        G  24  -7.774  -3.402   5.483
  250    H3*    G  24           H3*        G  24  -6.718  -4.777   7.641
  251    H2*    G  24           H2*        G  24  -4.541  -4.640   7.256
  252   2HO*    G  24          2HO*        G  24  -5.548  -6.737   5.732
  253    H1*    G  24           H1*        G  24  -4.768  -4.683   4.267
  254    H8     G  24           H8         G  24  -3.924  -2.098   6.863
  255    H1     G  24           H1         G  24   1.062  -4.298   3.425
  256   1H2     G  24          1H2         G  24   0.309  -5.989   2.102
  257   2H2     G  24          2H2         G  24  -1.368  -6.475   2.234
  258   1H5*    U  25          1H5*        U  25  -9.546  -3.527   4.325
  259   2H5*    U  25          2H5*        U  25 -10.788  -4.645   3.725
  260    H4*    U  25           H4*        U  25  -9.931  -3.264   1.875
  261    H3*    U  25           H3*        U  25  -9.144  -6.176   1.802
  262    H2*    U  25           H2*        U  25  -7.912  -5.760  -0.200
  263   2HO*    U  25          2HO*        U  25  -9.549  -4.480  -1.164
  264    H1*    U  25           H1*        U  25  -6.927  -3.286   0.511
  265    H3     U  25           H3         U  25  -2.962  -5.274   1.004
  266    H5     U  25           H5         U  25  -5.488  -7.764   3.253
  267    H6     U  25           H6         U  25  -7.333  -6.283   2.706
  268   1H5*    A  26          1H5*        A  26 -10.095  -8.345  -2.340
  269   2H5*    A  26          2H5*        A  26  -8.743  -7.883  -1.309
  270    H4*    A  26           H4*        A  26  -9.323  -6.716  -4.068
  271    H3*    A  26           H3*        A  26  -7.467  -8.907  -3.100
  272    H2*    A  26           H2*        A  26  -5.840  -8.168  -4.690
  273   2HO*    A  26          2HO*        A  26  -7.570  -7.667  -6.284
  274    H1*    A  26           H1*        A  26  -6.023  -5.554  -4.114
  275    H8     A  26           H8         A  26  -6.755  -7.511  -0.985
  276   1H6     A  26          1H6         A  26  -0.622  -7.451  -0.083
  277   2H6     A  26          2H6         A  26  -2.188  -7.807   0.638
  278    H2     A  26           H2         A  26  -1.396  -6.179  -4.251
  279   1H5*    U  27          1H5*        U  27  -6.941  -8.970  -7.165
  280   2H5*    U  27          2H5*        U  27  -6.854 -10.610  -7.804
  281    H4*    U  27           H4*        U  27  -4.820  -9.343  -8.318
  282    H3*    U  27           H3*        U  27  -4.394 -11.621  -6.352
  283    H2*    U  27           H2*        U  27  -2.033 -11.114  -6.644
  284   2HO*    U  27          2HO*        U  27  -2.261 -10.648  -8.903
  285    H1*    U  27           H1*        U  27  -2.311  -8.448  -6.344
  286    H3     U  27           H3         U  27  -0.490 -10.164  -2.507
  287    H5     U  27           H5         U  27  -4.648 -10.550  -2.041
  288    H6     U  27           H6         U  27  -4.932  -9.943  -4.340
  289   1H5*    A  28          1H5*        A  28  -1.637 -12.010  -9.552
  290   2H5*    A  28          2H5*        A  28  -1.399 -13.702 -10.007
  291    H4*    A  28           H4*        A  28   0.731 -12.607  -9.471
  292    H3*    A  28           H3*        A  28  -0.087 -14.794  -7.510
  293    H2*    A  28           H2*        A  28   2.078 -14.411  -6.508
  294   2HO*    A  28          2HO*        A  28   3.071 -14.034  -8.619
  295    H1*    A  28           H1*        A  28   1.879 -11.744  -6.419
  296    H8     A  28           H8         A  28  -1.663 -12.889  -5.948
  297   1H6     A  28          1H6         A  28  -0.172 -13.574   0.033
  298   2H6     A  28          2H6         A  28  -1.472 -13.528  -1.138
  299    H2     A  28           H2         A  28   3.593 -13.132  -2.268
  300   1H5*    U  29          1H5*        U  29   3.884 -15.445  -8.681
  301   2H5*    U  29          2H5*        U  29   4.257 -17.156  -8.905
  302    H4*    U  29           H4*        U  29   5.744 -16.106  -7.245
  303    H3*    U  29           H3*        U  29   3.856 -18.198  -6.071
  304    H2*    U  29           H2*        U  29   5.150 -17.856  -4.045
  305   2HO*    U  29          2HO*        U  29   7.153 -17.598  -5.177
  306    H1*    U  29           H1*        U  29   5.035 -15.178  -4.120
  307    H3     U  29           H3         U  29   2.093 -16.708  -0.966
  308    H5     U  29           H5         U  29  -0.072 -16.730  -4.555
  309    H6     U  29           H6         U  29   1.954 -16.223  -5.747
  310   1H5*    C  30          1H5*        C  30   7.782 -19.047  -4.849
  311   2H5*    C  30          2H5*        C  30   8.135 -20.779  -4.877
  312    H4*    C  30           H4*        C  30   8.546 -19.806  -2.655
  313    H3*    C  30           H3*        C  30   6.216 -21.784  -2.735
  314    H2*    C  30           H2*        C  30   6.243 -21.529  -0.327
  315   2HO*    C  30          2HO*        C  30   8.626 -21.292  -0.363
  316    H1*    C  30           H1*        C  30   6.280 -18.847  -0.368
  317   1H4     C  30          1H4         C  30   0.164 -20.359  -0.585
  318   2H4     C  30          2H4         C  30   0.164 -20.212  -2.341
  319    H5     C  30           H5         C  30   2.206 -19.911  -3.625
  320    H6     C  30           H6         C  30   4.573 -19.624  -3.468
  321   1H5*    C  31          1H5*        C  31   8.702 -22.800   0.457
  322   2H5*    C  31          2H5*        C  31   9.105 -24.523   0.397
  323    H4*    C  31           H4*        C  31   8.207 -23.993   2.601
  324    H3*    C  31           H3*        C  31   6.298 -25.567   0.828
  325    H2*    C  31           H2*        C  31   4.918 -25.786   2.789
  326   2HO*    C  31          2HO*        C  31   6.805 -26.015   4.218
  327    H1*    C  31           H1*        C  31   5.101 -23.153   3.465
  328   1H4     C  31          1H4         C  31   0.012 -23.702  -0.209
  329   2H4     C  31          2H4         C  31   0.973 -23.387  -1.655
  330    H5     C  31           H5         C  31   3.396 -23.209  -1.606
  331    H6     C  31           H6         C  31   5.320 -23.249  -0.190
  332    H3T    C  31           H3T        C  31   8.234 -26.623   1.378
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  -6.457 -20.877   9.149
    2   2H5*    G   1          2H5*        G   1  -5.816 -21.916   7.883
    3    H4*    G   1           H4*        G   1  -4.890 -21.959  10.792
    4    H3*    G   1           H3*        G   1  -3.890 -20.471   8.363
    5    H2*    G   1           H2*        G   1  -1.618 -20.875   9.106
    6   2HO*    G   1          2HO*        G   1  -2.163 -20.632  11.371
    7    H1*    G   1           H1*        G   1  -1.943 -23.485   9.517
    8    H8     G   1           H8         G   1  -4.431 -22.972   6.804
    9    H1     G   1           H1         G   1   1.632 -22.521   4.743
   10   1H2     G   1          1H2         G   1   2.985 -22.297   6.493
   11   2H2     G   1          2H2         G   1   2.360 -22.338   8.127
   12    H5T    G   1           H5T        G   1  -6.432 -23.717   9.235
   13   1H5*    G   2          1H5*        G   2  -1.519 -19.102  11.480
   14   2H5*    G   2          2H5*        G   2  -1.381 -17.340  11.474
   15    H4*    G   2           H4*        G   2   0.827 -18.420  11.454
   16    H3*    G   2           H3*        G   2   0.109 -16.894   8.936
   17    H2*    G   2           H2*        G   2   2.401 -17.367   8.224
   18   2HO*    G   2          2HO*        G   2   3.198 -17.141  10.444
   19    H1*    G   2           H1*        G   2   2.298 -19.973   8.817
   20    H8     G   2           H8         G   2  -1.221 -19.347   7.797
   21    H1     G   2           H1         G   2   2.888 -19.199   2.860
   22   1H2     G   2          1H2         G   2   4.960 -19.064   3.629
   23   2H2     G   2          2H2         G   2   5.290 -19.098   5.353
   24   1H5*    A   3          1H5*        A   3   4.016 -15.787  10.062
   25   2H5*    A   3          2H5*        A   3   4.260 -14.042   9.978
   26    H4*    A   3           H4*        A   3   5.966 -15.261   8.687
   27    H3*    A   3           H3*        A   3   4.063 -13.544   7.049
   28    H2*    A   3           H2*        A   3   5.418 -14.157   5.143
   29   2HO*    A   3          2HO*        A   3   7.403 -14.097   6.458
   30    H1*    A   3           H1*        A   3   5.492 -16.774   5.678
   31    H8     A   3           H8         A   3   2.110 -15.844   6.944
   32   1H6     A   3          1H6         A   3   0.265 -15.943   1.028
   33   2H6     A   3          2H6         A   3  -0.246 -15.814   2.715
   34    H2     A   3           H2         A   3   4.700 -16.106   1.084
   35   1H5*    U   4          1H5*        U   4   7.966 -12.733   5.771
   36   2H5*    U   4          2H5*        U   4   8.253 -11.016   5.486
   37    H4*    U   4           H4*        U   4   8.726 -12.368   3.482
   38    H3*    U   4           H3*        U   4   6.338 -10.499   3.191
   39    H2*    U   4           H2*        U   4   6.381 -11.195   0.858
   40   2HO*    U   4          2HO*        U   4   8.724 -11.299   0.818
   41    H1*    U   4           H1*        U   4   6.565 -13.821   1.406
   42    H3     U   4           H3         U   4   2.317 -12.769   0.090
   43    H5     U   4           H5         U   4   2.339 -12.238   4.253
   44    H6     U   4           H6         U   4   4.717 -12.553   4.244
   45   1H5*    A   5          1H5*        A   5   8.929  -9.983  -0.071
   46   2H5*    A   5          2H5*        A   5   9.159  -8.282  -0.471
   47    H4*    A   5           H4*        A   5   8.469  -9.580  -2.434
   48    H3*    A   5           H3*        A   5   6.457  -7.509  -1.481
   49    H2*    A   5           H2*        A   5   5.110  -8.099  -3.341
   50   2HO*    A   5          2HO*        A   5   6.863  -8.264  -4.820
   51    H1*    A   5           H1*        A   5   5.375 -10.765  -3.099
   52    H8     A   5           H8         A   5   5.354  -9.563   0.453
   53   1H6     A   5          1H6         A   5  -0.831  -9.717  -0.038
   54   2H6     A   5          2H6         A   5   0.530  -9.617   1.078
   55    H2     A   5           H2         A   5   0.876  -9.956  -4.126
   56   1H5*    U   6          1H5*        U   6   5.994  -4.124  -5.263
   57   2H5*    U   6          2H5*        U   6   5.013  -4.795  -3.957
   58    H4*    U   6           H4*        U   6   5.080  -5.751  -6.854
   59    H3*    U   6           H3*        U   6   3.236  -4.159  -5.097
   60    H2*    U   6           H2*        U   6   1.297  -5.209  -6.065
   61   2HO*    U   6          2HO*        U   6   2.295  -5.252  -8.207
   62    H1*    U   6           H1*        U   6   2.204  -7.717  -5.854
   63    H3     U   6           H3         U   6  -0.686  -6.586  -2.440
   64    H5     U   6           H5         U   6   3.202  -6.104  -0.916
   65    H6     U   6           H6         U   6   4.078  -6.412  -3.142
   66   1H5*    A   7          1H5*        A   7   1.051  -3.913  -8.611
   67   2H5*    A   7          2H5*        A   7   0.631  -2.216  -8.917
   68    H4*    A   7           H4*        A   7  -1.372  -3.651  -8.717
   69    H3*    A   7           H3*        A   7  -1.014  -1.519  -6.579
   70    H2*    A   7           H2*        A   7  -3.160  -2.220  -5.745
   71   2HO*    A   7          2HO*        A   7  -4.009  -2.524  -7.908
   72    H1*    A   7           H1*        A   7  -2.721  -4.856  -5.888
   73    H8     A   7           H8         A   7   0.644  -3.551  -4.963
   74   1H6     A   7          1H6         A   7  -1.491  -3.187   0.833
   75   2H6     A   7          2H6         A   7  -0.062  -3.108  -0.196
   76    H2     A   7           H2         A   7  -4.944  -3.922  -1.831
   77   1H5*    U   8          1H5*        U   8  -5.037  -1.317  -7.981
   78   2H5*    U   8          2H5*        U   8  -5.559   0.366  -8.079
   79    H4*    U   8           H4*        U   8  -6.962  -1.035  -6.548
   80    H3*    U   8           H3*        U   8  -5.455   1.305  -5.342
   81    H2*    U   8           H2*        U   8  -6.680   0.776  -3.303
   82   2HO*    U   8          2HO*        U   8  -8.651   0.307  -4.393
   83    H1*    U   8           H1*        U   8  -6.328  -1.895  -3.453
   84    H3     U   8           H3         U   8  -3.743  -0.299  -0.031
   85    H5     U   8           H5         U   8  -1.369   0.101  -3.466
   86    H6     U   8           H6         U   8  -3.280  -0.476  -4.822
   87   1H5*    G   9          1H5*        G   9  -9.712   1.723  -4.170
   88   2H5*    G   9          2H5*        G   9 -10.098   3.453  -4.277
   89    H4*    G   9           H4*        G   9 -10.602   2.546  -2.037
   90    H3*    G   9           H3*        G   9  -8.201   4.386  -2.087
   91    H2*    G   9           H2*        G   9  -8.386   4.354   0.348
   92   2HO*    G   9          2HO*        G   9 -10.744   4.013   0.443
   93    H1*    G   9           H1*        G   9  -8.331   1.710   0.352
   94    H8     G   9           H8         G   9  -6.362   2.588  -2.759
   95    H1     G   9           H1         G   9  -3.262   3.869   2.715
   96   1H2     G   9          1H2         G   9  -4.686   3.758   4.417
   97   2H2     G   9          2H2         G   9  -6.348   3.236   4.171
   98   1H5*    A  10          1H5*        A  10 -11.084   7.729   0.497
   99   2H5*    A  10          2H5*        A  10  -9.544   7.014   0.032
  100    H4*    A  10           H4*        A  10 -10.838   6.682   2.775
  101    H3*    A  10           H3*        A  10  -8.896   8.674   1.625
  102    H2*    A  10           H2*        A  10  -7.620   8.640   3.679
  103   2HO*    A  10          2HO*        A  10  -9.595   8.426   4.981
  104    H1*    A  10           H1*        A  10  -7.504   5.997   3.913
  105    H8     A  10           H8         A  10  -7.686   6.249   0.232
  106   1H6     A  10          1H6         A  10  -1.630   7.554   0.280
  107   2H6     A  10          2H6         A  10  -3.011   7.085  -0.695
  108    H2     A  10           H2         A  10  -3.146   8.067   4.415
  109   1H5*    U  11          1H5*        U  11  -9.415   9.992   5.561
  110   2H5*    U  11          2H5*        U  11  -9.739  11.731   5.562
  111    H4*    U  11           H4*        U  11  -7.739  11.197   6.908
  112    H3*    U  11           H3*        U  11  -7.259  12.733   4.336
  113    H2*    U  11           H2*        U  11  -4.989  12.991   5.160
  114   2HO*    U  11          2HO*        U  11  -5.652  13.318   7.354
  115    H1*    U  11           H1*        U  11  -4.709  10.417   5.936
  116    H3     U  11           H3         U  11  -2.165  11.066   2.199
  117    H5     U  11           H5         U  11  -6.019  10.266   0.750
  118    H6     U  11           H6         U  11  -6.846  10.383   3.014
  119   1H5*    A  12          1H5*        A  12  -5.473  14.841   7.934
  120   2H5*    A  12          2H5*        A  12  -5.768  16.560   7.624
  121    H4*    A  12           H4*        A  12  -3.400  16.232   8.103
  122    H3*    A  12           H3*        A  12  -3.935  16.699   5.168
  123    H2*    A  12           H2*        A  12  -1.524  17.118   5.077
  124   2HO*    A  12          2HO*        A  12  -1.588  17.653   7.607
  125    H1*    A  12           H1*        A  12  -1.050  14.771   6.141
  126    H8     A  12           H8         A  12  -4.361  14.643   4.322
  127   1H6     A  12          1H6         A  12  -0.988  13.083  -0.604
  128   2H6     A  12          2H6         A  12  -2.612  13.080   0.069
  129    H2     A  12           H2         A  12   1.770  14.490   2.558
  130   1H5*    C  13          1H5*        C  13  -0.264  19.113   7.436
  131   2H5*    C  13          2H5*        C  13  -0.606  20.885   7.479
  132    H4*    C  13           H4*        C  13   1.365  20.638   6.146
  133    H3*    C  13           H3*        C  13  -0.853  20.690   4.154
  134    H2*    C  13           H2*        C  13   1.099  20.804   2.674
  135   2HO*    C  13          2HO*        C  13   2.356  22.150   4.023
  136    H1*    C  13           H1*        C  13   2.398  18.770   3.867
  137   1H4     C  13          1H4         C  13  -1.105  16.020  -0.616
  138   2H4     C  13          2H4         C  13  -2.606  16.410   0.204
  139    H5     C  13           H5         C  13  -2.660  17.609   2.334
  140    H6     C  13           H6         C  13  -1.314  18.711   4.019
  141   1H5*    A  14          1H5*        A  14   2.272  23.967   3.557
  142   2H5*    A  14          2H5*        A  14   1.593  25.147   2.420
  143    H4*    A  14           H4*        A  14   3.755  24.126   1.635
  144    H3*    A  14           H3*        A  14   1.369  23.381  -0.037
  145    H2*    A  14           H2*        A  14   3.065  22.610  -1.598
  146   2HO*    A  14          2HO*        A  14   4.769  24.150  -1.018
  147    H1*    A  14           H1*        A  14   4.216  21.143   0.320
  148    H8     A  14           H8         A  14   0.506  21.321   1.051
  149   1H6     A  14          1H6         A  14  -0.020  17.047  -3.467
  150   2H6     A  14          2H6         A  14  -0.913  17.926  -2.231
  151    H2     A  14           H2         A  14   4.183  18.310  -3.265
  152   1H5*    A  15          1H5*        A  15   6.240  25.843  -1.336
  153   2H5*    A  15          2H5*        A  15   5.650  26.893  -2.642
  154    H4*    A  15           H4*        A  15   7.339  25.144  -3.332
  155    H3*    A  15           H3*        A  15   4.631  24.965  -4.668
  156    H2*    A  15           H2*        A  15   5.573  23.319  -5.953
  157   2HO*    A  15          2HO*        A  15   7.662  24.458  -6.210
  158    H1*    A  15           H1*        A  15   6.752  21.953  -3.927
  159    H8     A  15           H8         A  15   3.625  23.594  -3.441
  160   1H6     A  15          1H6         A  15   0.916  18.763  -6.337
  161   2H6     A  15          2H6         A  15   0.603  20.186  -5.374
  162    H2     A  15           H2         A  15   5.377  18.595  -6.788
  163   1H5*    U  16          1H5*        U  16   6.288  25.135  -9.725
  164   2H5*    U  16          2H5*        U  16   4.625  24.722  -9.275
  165    H4*    U  16           H4*        U  16   5.648  22.977 -10.635
  166    H3*    U  16           H3*        U  16   5.192  22.238  -7.759
  167    H2*    U  16           H2*        U  16   5.956  20.071  -8.158
  168   2HO*    U  16          2HO*        U  16   5.178  20.544 -10.804
  169    H1*    U  16           H1*        U  16   7.781  20.734 -10.092
  170    H3     U  16           H3         U  16  11.181  19.830  -7.303
  171    H5     U  16           H5         U  16   8.169  21.342  -4.774
  172    H6     U  16           H6         U  16   6.849  21.759  -6.717
  173   1H5*    U  17          1H5*        U  17   2.397  19.345  -8.888
  174   2H5*    U  17          2H5*        U  17   3.574  19.023 -10.158
  175    H4*    U  17           H4*        U  17   0.770  18.538 -10.946
  176    H3*    U  17           H3*        U  17   1.782  17.320  -8.514
  177    H2*    U  17           H2*        U  17   2.246  15.098  -9.275
  178   2HO*    U  17          2HO*        U  17   0.040  15.367 -10.450
  179    H1*    U  17           H1*        U  17   3.116  15.498 -11.758
  180    H3     U  17           H3         U  17   7.310  17.360 -11.115
  181    H5     U  17           H5         U  17   5.709  16.663  -7.315
  182    H6     U  17           H6         U  17   3.608  16.207  -8.306
  183   1H5*    U  18          1H5*        U  18   0.241  14.042  -8.850
  184   2H5*    U  18          2H5*        U  18  -1.001  13.716  -7.670
  185    H4*    U  18           H4*        U  18   1.471  13.766  -6.256
  186    H3*    U  18           H3*        U  18   1.804  12.786  -8.971
  187    H2*    U  18           H2*        U  18   2.110  10.497  -8.564
  188   2HO*    U  18          2HO*        U  18   3.694  10.794  -6.955
  189    H1*    U  18           H1*        U  18   0.373  10.052  -6.569
  190    H3     U  18           H3         U  18  -3.693  10.165  -8.686
  191    H5     U  18           H5         U  18  -0.926  11.386 -11.576
  192    H6     U  18           H6         U  18   0.763  11.461  -9.907
  193   1H5*    G  19          1H5*        G  19   7.124  12.558  -7.836
  194   2H5*    G  19          2H5*        G  19   7.279  10.967  -7.117
  195    H4*    G  19           H4*        G  19   7.635  12.944  -5.603
  196    H3*    G  19           H3*        G  19   5.576  10.864  -4.665
  197    H2*    G  19           H2*        G  19   5.707  12.029  -2.644
  198   2HO*    G  19          2HO*        G  19   7.984  12.237  -2.633
  199    H1*    G  19           H1*        G  19   5.860  14.529  -3.785
  200    H8     G  19           H8         G  19   3.234  12.283  -5.327
  201    H1     G  19           H1         G  19   1.328  15.742  -0.263
  202   1H2     G  19          1H2         G  19   3.113  16.796   0.605
  203   2H2     G  19          2H2         G  19   4.709  16.525  -0.046
  204   1H5*    A  20          1H5*        A  20   7.510   8.799  -0.669
  205   2H5*    A  20          2H5*        A  20   5.988   9.439  -1.270
  206    H4*    A  20           H4*        A  20   7.904  10.933   0.584
  207    H3*    A  20           H3*        A  20   5.538   9.123   0.857
  208    H2*    A  20           H2*        A  20   4.640  10.400   2.680
  209   2HO*    A  20          2HO*        A  20   6.698  10.881   3.643
  210    H1*    A  20           H1*        A  20   4.816  12.747   1.425
  211    H8     A  20           H8         A  20   4.548  10.716  -1.638
  212   1H6     A  20          1H6         A  20  -1.485   9.986  -0.370
  213   2H6     A  20          2H6         A  20  -0.215   9.817  -1.586
  214    H2     A  20           H2         A  20   0.458  11.466   3.330
  215   1H5*    U  21          1H5*        U  21   5.706   6.918   5.485
  216   2H5*    U  21          2H5*        U  21   4.540   7.088   4.174
  217    H4*    U  21           H4*        U  21   4.753   8.819   6.681
  218    H3*    U  21           H3*        U  21   2.916   6.842   5.357
  219    H2*    U  21           H2*        U  21   0.986   7.824   6.379
  220   2HO*    U  21          2HO*        U  21   2.545   8.844   8.207
  221    H1*    U  21           H1*        U  21   1.588  10.174   5.333
  222    H3     U  21           H3         U  21  -1.036   7.537   2.502
  223    H5     U  21           H5         U  21   2.842   7.663   0.913
  224    H6     U  21           H6         U  21   3.605   8.659   2.948
  225   1H5*    C  22          1H5*        C  22   1.697   4.731   9.698
  226   2H5*    C  22          2H5*        C  22   1.702   5.009   7.967
  227    H4*    C  22           H4*        C  22  -0.543   5.774   9.881
  228    H3*    C  22           H3*        C  22  -0.126   3.699   7.718
  229    H2*    C  22           H2*        C  22  -2.533   3.662   7.422
  230   2HO*    C  22          2HO*        C  22  -3.083   4.244   9.668
  231    H1*    C  22           H1*        C  22  -2.556   6.285   7.044
  232   1H4     C  22          1H4         C  22  -0.834   3.766   1.478
  233   2H4     C  22          2H4         C  22   0.846   4.158   1.812
  234    H5     C  22           H5         C  22   1.586   5.044   3.987
  235    H6     C  22           H6         C  22   0.829   5.739   6.192
  236   1H5*    A  23          1H5*        A  23  -3.108   0.582  10.542
  237   2H5*    A  23          2H5*        A  23  -2.354   1.120   9.049
  238    H4*    A  23           H4*        A  23  -5.299   1.506   9.738
  239    H3*    A  23           H3*        A  23  -3.769  -0.597   8.219
  240    H2*    A  23           H2*        A  23  -5.531  -0.679   6.547
  241   2HO*    A  23          2HO*        A  23  -7.178  -0.291   8.294
  242    H1*    A  23           H1*        A  23  -5.676   1.945   6.192
  243    H8     A  23           H8         A  23  -2.109   1.742   7.138
  244   1H6     A  23          1H6         A  23  -1.114  -0.391   1.381
  245   2H6     A  23          2H6         A  23  -0.323   0.204   2.854
  246    H2     A  23           H2         A  23  -5.425  -0.662   2.198
  247   1H5*    G  24          1H5*        G  24  -7.171  -1.923   7.133
  248   2H5*    G  24          2H5*        G  24  -7.665  -3.301   8.116
  249    H4*    G  24           H4*        G  24  -8.043  -3.764   5.761
  250    H3*    G  24           H3*        G  24  -6.606  -5.277   7.597
  251    H2*    G  24           H2*        G  24  -4.525  -5.163   6.832
  252   2HO*    G  24          2HO*        G  24  -5.903  -7.045   5.351
  253    H1*    G  24           H1*        G  24  -5.219  -4.793   3.965
  254    H8     G  24           H8         G  24  -4.131  -2.367   6.596
  255    H1     G  24           H1         G  24   0.547  -4.315   2.641
  256   1H2     G  24          1H2         G  24  -0.240  -6.028   1.395
  257   2H2     G  24          2H2         G  24  -1.860  -6.621   1.653
  258   1H5*    U  25          1H5*        U  25 -10.295  -7.266   3.664
  259   2H5*    U  25          2H5*        U  25  -8.581  -6.944   3.393
  260    H4*    U  25           H4*        U  25 -10.830  -5.137   2.415
  261    H3*    U  25           H3*        U  25  -9.956  -7.686   1.389
  262    H2*    U  25           H2*        U  25  -8.623  -7.095  -0.440
  263   2HO*    U  25          2HO*        U  25 -10.402  -5.905  -1.373
  264    H1*    U  25           H1*        U  25  -7.747  -4.596   0.168
  265    H3     U  25           H3         U  25  -3.819  -5.674   2.007
  266    H5     U  25           H5         U  25  -5.973  -9.258   2.171
  267    H6     U  25           H6         U  25  -7.943  -8.048   1.503
  268   1H5*    A  26          1H5*        A  26 -10.916  -9.644  -2.246
  269   2H5*    A  26          2H5*        A  26  -9.610  -8.900  -1.321
  270    H4*    A  26           H4*        A  26 -10.324  -8.207  -4.209
  271    H3*    A  26           H3*        A  26  -8.254 -10.065  -2.999
  272    H2*    A  26           H2*        A  26  -6.768  -9.452  -4.771
  273   2HO*    A  26          2HO*        A  26  -8.570  -9.315  -6.343
  274    H1*    A  26           H1*        A  26  -7.135  -6.811  -4.502
  275    H8     A  26           H8         A  26  -7.570  -8.741  -1.271
  276   1H6     A  26          1H6         A  26  -1.539  -7.598  -0.412
  277   2H6     A  26          2H6         A  26  -3.008  -8.243   0.344
  278    H2     A  26           H2         A  26  -2.590  -6.476  -4.559
  279   1H5*    U  27          1H5*        U  27  -7.884 -10.700  -7.023
  280   2H5*    U  27          2H5*        U  27  -7.630 -12.402  -7.407
  281    H4*    U  27           H4*        U  27  -5.779 -11.012  -8.226
  282    H3*    U  27           H3*        U  27  -5.004 -12.889  -5.958
  283    H2*    U  27           H2*        U  27  -2.741 -12.187  -6.462
  284   2HO*    U  27          2HO*        U  27  -3.082 -12.094  -8.751
  285    H1*    U  27           H1*        U  27  -3.314  -9.557  -6.520
  286    H3     U  27           H3         U  27  -1.234 -10.425  -2.566
  287    H5     U  27           H5         U  27  -5.283 -11.318  -1.879
  288    H6     U  27           H6         U  27  -5.686 -11.076  -4.225
  289   1H5*    A  28          1H5*        A  28  -2.433 -13.594  -9.292
  290   2H5*    A  28          2H5*        A  28  -2.109 -15.324  -9.487
  291    H4*    A  28           H4*        A  28  -0.017 -14.072  -9.361
  292    H3*    A  28           H3*        A  28  -0.533 -15.835  -6.927
  293    H2*    A  28           H2*        A  28   1.687 -15.181  -6.239
  294   2HO*    A  28          2HO*        A  28   2.517 -15.211  -8.431
  295    H1*    A  28           H1*        A  28   1.320 -12.560  -6.654
  296    H8     A  28           H8         A  28  -2.090 -13.812  -5.673
  297   1H6     A  28          1H6         A  28  -0.177 -13.128   0.168
  298   2H6     A  28          2H6         A  28  -1.556 -13.402  -0.897
  299    H2     A  28           H2         A  28   3.393 -12.877  -2.471
  300   1H5*    U  29          1H5*        U  29   3.331 -16.593  -8.326
  301   2H5*    U  29          2H5*        U  29   3.763 -18.303  -8.241
  302    H4*    U  29           H4*        U  29   5.353 -16.890  -6.990
  303    H3*    U  29           H3*        U  29   3.690 -18.743  -5.216
  304    H2*    U  29           H2*        U  29   5.180 -17.968  -3.467
  305   2HO*    U  29          2HO*        U  29   7.052 -17.885  -4.818
  306    H1*    U  29           H1*        U  29   4.923 -15.366  -4.074
  307    H3     U  29           H3         U  29   2.429 -16.297  -0.360
  308    H5     U  29           H5         U  29  -0.130 -17.043  -3.593
  309    H6     U  29           H6         U  29   1.734 -16.780  -5.093
  310   1H5*    C  30          1H5*        C  30   7.786 -19.263  -4.417
  311   2H5*    C  30          2H5*        C  30   8.211 -20.956  -4.132
  312    H4*    C  30           H4*        C  30   8.883 -19.514  -2.245
  313    H3*    C  30           H3*        C  30   6.655 -21.499  -1.583
  314    H2*    C  30           H2*        C  30   7.005 -20.742   0.699
  315   2HO*    C  30          2HO*        C  30   9.357 -20.483   0.266
  316    H1*    C  30           H1*        C  30   6.920 -18.129   0.086
  317   1H4     C  30          1H4         C  30   0.884 -19.601   1.118
  318   2H4     C  30          2H4         C  30   0.622 -19.830  -0.606
  319    H5     C  30           H5         C  30   2.465 -19.891  -2.218
  320    H6     C  30           H6         C  30   4.822 -19.592  -2.485
  321   1H5*    C  31          1H5*        C  31   9.631 -21.780   1.325
  322   2H5*    C  31          2H5*        C  31  10.084 -23.467   1.600
  323    H4*    C  31           H4*        C  31   9.493 -22.436   3.735
  324    H3*    C  31           H3*        C  31   7.419 -24.394   2.665
  325    H2*    C  31           H2*        C  31   6.334 -24.163   4.807
  326   2HO*    C  31          2HO*        C  31   8.416 -24.041   5.952
  327    H1*    C  31           H1*        C  31   6.521 -21.441   4.836
  328   1H4     C  31          1H4         C  31   0.945 -22.731   2.212
  329   2H4     C  31          2H4         C  31   1.665 -22.755   0.606
  330    H5     C  31           H5         C  31   4.079 -22.648   0.238
  331    H6     C  31           H6         C  31   6.202 -22.404   1.317
  332    H3T    C  31           H3T        C  31   9.463 -25.270   3.154
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  -8.063 -24.879   5.058
    2   2H5*    G   1          2H5*        G   1  -8.237 -23.206   5.616
    3    H4*    G   1           H4*        G   1  -6.677 -24.308   7.059
    4    H3*    G   1           H3*        G   1  -5.326 -22.395   5.154
    5    H2*    G   1           H2*        G   1  -3.294 -22.814   6.368
    6   2HO*    G   1          2HO*        G   1  -4.371 -22.951   8.426
    7    H1*    G   1           H1*        G   1  -3.514 -25.457   6.300
    8    H8     G   1           H8         G   1  -5.214 -24.613   3.110
    9    H1     G   1           H1         G   1   1.137 -23.616   2.911
   10   1H2     G   1          1H2         G   1   1.927 -23.700   4.958
   11   2H2     G   1          2H2         G   1   0.849 -24.023   6.321
   12    H5T    G   1           H5T        G   1  -6.851 -22.551   3.927
   13   1H5*    G   2          1H5*        G   2  -4.040 -21.319   8.972
   14   2H5*    G   2          2H5*        G   2  -4.103 -19.567   9.188
   15    H4*    G   2           H4*        G   2  -1.891 -20.444   9.710
   16    H3*    G   2           H3*        G   2  -1.983 -18.656   7.268
   17    H2*    G   2           H2*        G   2   0.437 -18.900   7.223
   18   2HO*    G   2          2HO*        G   2   0.547 -18.901   9.560
   19    H1*    G   2           H1*        G   2   0.462 -21.544   7.462
   20    H8     G   2           H8         G   2  -2.687 -21.046   5.548
   21    H1     G   2           H1         G   2   2.583 -19.923   2.030
   22   1H2     G   2          1H2         G   2   4.296 -19.676   3.363
   23   2H2     G   2          2H2         G   2   4.116 -19.899   5.109
   24   1H5*    A   3          1H5*        A   3   1.217 -17.412   9.759
   25   2H5*    A   3          2H5*        A   3   1.269 -15.655   9.922
   26    H4*    A   3           H4*        A   3   3.412 -16.543   9.164
   27    H3*    A   3           H3*        A   3   1.970 -14.814   7.146
   28    H2*    A   3           H2*        A   3   3.975 -15.083   5.771
   29   2HO*    A   3          2HO*        A   3   5.385 -15.040   7.620
   30    H1*    A   3           H1*        A   3   4.120 -17.711   6.002
   31    H8     A   3           H8         A   3   0.430 -17.202   6.173
   32   1H6     A   3          1H6         A   3   0.645 -16.846  -0.002
   33   2H6     A   3          2H6         A   3  -0.368 -17.047   1.418
   34    H2     A   3           H2         A   3   4.749 -16.294   1.484
   35   1H5*    U   4          1H5*        U   4   5.986 -13.532   7.441
   36   2H5*    U   4          2H5*        U   4   6.109 -11.770   7.436
   37    H4*    U   4           H4*        U   4   7.430 -12.771   5.620
   38    H3*    U   4           H3*        U   4   5.070 -11.102   4.698
   39    H2*    U   4           H2*        U   4   5.964 -11.446   2.463
   40   2HO*    U   4          2HO*        U   4   8.154 -11.357   3.207
   41    H1*    U   4           H1*        U   4   6.201 -14.089   2.705
   42    H3     U   4           H3         U   4   2.452 -13.009   0.275
   43    H5     U   4           H5         U   4   1.142 -13.252   4.238
   44    H6     U   4           H6         U   4   3.431 -13.377   4.941
   45   1H5*    A   5          1H5*        A   5   8.521  -9.812   2.606
   46   2H5*    A   5          2H5*        A   5   8.581  -8.047   2.532
   47    H4*    A   5           H4*        A   5   8.773  -9.037   0.303
   48    H3*    A   5           H3*        A   5   6.250  -7.442   0.779
   49    H2*    A   5           H2*        A   5   5.756  -7.845  -1.573
   50   2HO*    A   5          2HO*        A   5   7.991  -7.619  -2.192
   51    H1*    A   5           H1*        A   5   6.212 -10.471  -1.498
   52    H8     A   5           H8         A   5   4.941  -9.824   1.958
   53   1H6     A   5          1H6         A   5  -0.714 -10.142  -0.551
   54   2H6     A   5          2H6         A   5   0.225 -10.184   0.939
   55    H2     A   5           H2         A   5   2.143  -9.521  -3.827
   56   1H5*    U   6          1H5*        U   6   7.764  -5.978  -3.052
   57   2H5*    U   6          2H5*        U   6   7.524  -4.220  -3.017
   58    H4*    U   6           H4*        U   6   6.351  -5.309  -4.908
   59    H3*    U   6           H3*        U   6   4.510  -4.142  -2.824
   60    H2*    U   6           H2*        U   6   2.757  -4.474  -4.477
   61   2HO*    U   6          2HO*        U   6   4.152  -4.227  -6.398
   62    H1*    U   6           H1*        U   6   3.415  -7.025  -4.755
   63    H3     U   6           H3         U   6  -0.215  -6.606  -2.033
   64    H5     U   6           H5         U   6   3.081  -6.391   0.550
   65    H6     U   6           H6         U   6   4.512  -6.282  -1.387
   66   1H5*    A   7          1H5*        A   7   3.380  -0.416  -6.095
   67   2H5*    A   7          2H5*        A   7   2.976  -1.500  -4.772
   68    H4*    A   7           H4*        A   7   1.778  -1.582  -7.580
   69    H3*    A   7           H3*        A   7   0.763  -0.542  -4.930
   70    H2*    A   7           H2*        A   7  -1.440  -1.335  -5.501
   71   2HO*    A   7          2HO*        A   7  -1.066  -0.791  -7.820
   72    H1*    A   7           H1*        A   7  -0.670  -3.803  -6.221
   73    H8     A   7           H8         A   7   1.921  -2.881  -3.708
   74   1H6     A   7          1H6         A   7  -2.318  -4.297   0.581
   75   2H6     A   7          2H6         A   7  -0.617  -3.968   0.270
   76    H2     A   7           H2         A   7  -4.414  -3.908  -3.266
   77   1H5*    U   8          1H5*        U   8  -2.434   0.364  -7.427
   78   2H5*    U   8          2H5*        U   8  -2.800   2.086  -7.259
   79    H4*    U   8           H4*        U   8  -4.772   0.640  -6.852
   80    H3*    U   8           H3*        U   8  -3.714   2.174  -4.489
   81    H2*    U   8           H2*        U   8  -5.793   1.582  -3.358
   82   2HO*    U   8          2HO*        U   8  -7.104   1.425  -5.377
   83    H1*    U   8           H1*        U   8  -5.390  -0.984  -3.821
   84    H3     U   8           H3         U   8  -3.817   0.483   0.389
   85    H5     U   8           H5         U   8  -0.510   0.116  -2.163
   86    H6     U   8           H6         U   8  -1.998  -0.166  -3.993
   87   1H5*    G   9          1H5*        G   9  -7.814   5.317  -5.031
   88   2H5*    G   9          2H5*        G   9  -6.396   4.704  -4.209
   89    H4*    G   9           H4*        G   9  -9.299   4.025  -3.523
   90    H3*    G   9           H3*        G   9  -7.116   5.724  -2.341
   91    H2*    G   9           H2*        G   9  -7.895   5.286  -0.106
   92   2HO*    G   9          2HO*        G   9 -10.254   4.664  -1.147
   93    H1*    G   9           H1*        G   9  -7.783   2.696  -0.457
   94    H8     G   9           H8         G   9  -5.255   3.485  -3.025
   95    H1     G   9           H1         G   9  -3.115   4.700   2.905
   96   1H2     G   9          1H2         G   9  -4.808   4.765   4.296
   97   2H2     G   9          2H2         G   9  -6.433   4.388   3.709
   98   1H5*    A  10          1H5*        A  10 -10.357   9.074  -0.535
   99   2H5*    A  10          2H5*        A  10  -8.788   8.314  -0.759
  100    H4*    A  10           H4*        A  10 -10.501   8.132   1.757
  101    H3*    A  10           H3*        A  10  -8.153   9.817   0.902
  102    H2*    A  10           H2*        A  10  -7.183   9.665   3.085
  103   2HO*    A  10          2HO*        A  10  -9.384   9.747   4.048
  104    H1*    A  10           H1*        A  10  -7.445   7.049   3.384
  105    H8     A  10           H8         A  10  -7.140   7.220  -0.299
  106   1H6     A  10          1H6         A  10  -1.015   7.745   0.665
  107   2H6     A  10          2H6         A  10  -2.267   7.452  -0.551
  108    H2     A  10           H2         A  10  -3.011   8.462   4.471
  109   1H5*    U  11          1H5*        U  11  -9.030  11.339   4.722
  110   2H5*    U  11          2H5*        U  11  -9.095  13.103   4.608
  111    H4*    U  11           H4*        U  11  -7.420  12.352   6.249
  112    H3*    U  11           H3*        U  11  -6.362  13.749   3.784
  113    H2*    U  11           H2*        U  11  -4.224  13.700   4.922
  114   2HO*    U  11          2HO*        U  11  -5.109  14.178   6.965
  115    H1*    U  11           H1*        U  11  -4.362  11.156   5.725
  116    H3     U  11           H3         U  11  -1.249  11.426   2.402
  117    H5     U  11           H5         U  11  -4.917  10.935   0.407
  118    H6     U  11           H6         U  11  -6.058  11.263   2.511
  119   1H5*    A  12          1H5*        A  12  -4.950  15.741   7.621
  120   2H5*    A  12          2H5*        A  12  -5.012  17.479   7.265
  121    H4*    A  12           H4*        A  12  -2.802  16.756   8.150
  122    H3*    A  12           H3*        A  12  -2.977  17.960   5.396
  123    H2*    A  12           H2*        A  12  -0.566  17.685   5.216
  124   2HO*    A  12          2HO*        A  12  -0.429  18.316   7.531
  125    H1*    A  12           H1*        A  12  -0.369  15.302   6.266
  126    H8     A  12           H8         A  12  -3.487  15.300   4.124
  127   1H6     A  12          1H6         A  12   0.375  13.442  -0.363
  128   2H6     A  12          2H6         A  12  -1.315  13.648   0.106
  129    H2     A  12           H2         A  12   2.806  14.632   3.091
  130   1H5*    C  13          1H5*        C  13   0.552  19.723   7.017
  131   2H5*    C  13          2H5*        C  13   0.449  21.493   6.733
  132    H4*    C  13           H4*        C  13   2.484  20.644   5.721
  133    H3*    C  13           H3*        C  13   0.416  21.399   3.685
  134    H2*    C  13           H2*        C  13   2.038  20.701   2.041
  135   2HO*    C  13          2HO*        C  13   3.752  21.694   3.329
  136    H1*    C  13           H1*        C  13   2.928  18.484   3.237
  137   1H4     C  13          1H4         C  13  -1.410  16.245  -0.621
  138   2H4     C  13          2H4         C  13  -2.718  16.584   0.531
  139    H5     C  13           H5         C  13  -2.366  17.957   2.480
  140    H6     C  13           H6         C  13  -0.680  19.085   3.781
  141   1H5*    A  14          1H5*        A  14   4.115  22.983   2.011
  142   2H5*    A  14          2H5*        A  14   3.674  24.484   1.176
  143    H4*    A  14           H4*        A  14   4.497  22.728  -0.414
  144    H3*    A  14           H3*        A  14   1.754  23.726  -0.838
  145    H2*    A  14           H2*        A  14   1.691  22.129  -2.676
  146   2HO*    A  14          2HO*        A  14   3.749  22.362  -3.447
  147    H1*    A  14           H1*        A  14   2.691  20.047  -1.490
  148    H8     A  14           H8         A  14   0.623  21.759   1.156
  149   1H6     A  14          1H6         A  14  -4.066  18.675  -1.470
  150   2H6     A  14          2H6         A  14  -3.609  19.730  -0.101
  151    H2     A  14           H2         A  14  -0.616  18.249  -4.065
  152   1H5*    A  15          1H5*        A  15   4.896  23.290  -4.177
  153   2H5*    A  15          2H5*        A  15   4.672  24.512  -5.420
  154    H4*    A  15           H4*        A  15   4.743  22.013  -6.153
  155    H3*    A  15           H3*        A  15   3.630  24.132  -7.457
  156    H2*    A  15           H2*        A  15   1.657  23.991  -6.151
  157   2HO*    A  15          2HO*        A  15   1.565  23.651  -8.768
  158    H1*    A  15           H1*        A  15   1.516  21.042  -6.945
  159    H8     A  15           H8         A  15   0.874  23.419  -3.992
  160   1H6     A  15          1H6         A  15  -4.710  20.756  -3.906
  161   2H6     A  15          2H6         A  15  -3.706  22.056  -3.224
  162    H2     A  15           H2         A  15  -2.307  18.722  -6.894
  163   1H5*    U  16          1H5*        U  16   2.401  19.613  -9.165
  164   2H5*    U  16          2H5*        U  16   2.666  19.883 -10.896
  165    H4*    U  16           H4*        U  16   0.763  18.445 -10.667
  166    H3*    U  16           H3*        U  16   0.084  21.330 -11.342
  167    H2*    U  16           H2*        U  16  -2.024  21.071 -11.291
  168   2HO*    U  16          2HO*        U  16  -1.590  18.456 -12.280
  169    H1*    U  16           H1*        U  16  -2.149  18.711  -9.669
  170    H3     U  16           H3         U  16  -5.136  21.716  -7.861
  171    H5     U  16           H5         U  16  -1.420  23.650  -7.667
  172    H6     U  16           H6         U  16  -0.433  21.812  -8.732
  173   1H5*    U  17          1H5*        U  17   2.947  16.463 -13.577
  174   2H5*    U  17          2H5*        U  17   1.679  16.144 -12.425
  175    H4*    U  17           H4*        U  17   4.262  17.516 -11.571
  176    H3*    U  17           H3*        U  17   3.843  14.716 -12.215
  177    H2*    U  17           H2*        U  17   4.008  13.754 -10.013
  178   2HO*    U  17          2HO*        U  17   5.854  15.242  -9.514
  179    H1*    U  17           H1*        U  17   2.554  15.519  -8.645
  180    H3     U  17           H3         U  17  -1.698  15.374 -10.708
  181    H5     U  17           H5         U  17   0.677  12.596 -12.732
  182    H6     U  17           H6         U  17   2.572  13.313 -11.452
  183   1H5*    U  18          1H5*        U  18   7.366  12.157  -9.805
  184   2H5*    U  18          2H5*        U  18   6.077  13.123  -9.150
  185    H4*    U  18           H4*        U  18   8.981  13.809  -8.557
  186    H3*    U  18           H3*        U  18   7.513  11.511  -7.559
  187    H2*    U  18           H2*        U  18   7.119  12.170  -5.319
  188   2HO*    U  18          2HO*        U  18   9.349  12.708  -4.987
  189    H1*    U  18           H1*        U  18   6.863  14.842  -5.523
  190    H3     U  18           H3         U  18   2.395  15.143  -6.179
  191    H5     U  18           H5         U  18   3.374  11.356  -7.718
  192    H6     U  18           H6         U  18   5.631  11.785  -7.245
  193   1H5*    G  19          1H5*        G  19   9.396   9.208  -3.739
  194   2H5*    G  19          2H5*        G  19   7.956  10.130  -4.210
  195    H4*    G  19           H4*        G  19  10.086  11.143  -2.286
  196    H3*    G  19           H3*        G  19   7.430   9.784  -1.730
  197    H2*    G  19           H2*        G  19   7.208  11.230   0.188
  198   2HO*    G  19          2HO*        G  19   9.527  11.116   0.604
  199    H1*    G  19           H1*        G  19   7.800  13.482  -1.146
  200    H8     G  19           H8         G  19   6.129  10.872  -3.319
  201    H1     G  19           H1         G  19   2.168  14.866  -0.206
  202   1H2     G  19          1H2         G  19   3.415  16.249   1.017
  203   2H2     G  19          2H2         G  19   5.128  15.900   1.216
  204   1H5*    A  20          1H5*        A  20   9.426  10.062   2.016
  205   2H5*    A  20          2H5*        A  20   9.236   8.512   2.856
  206    H4*    A  20           H4*        A  20   8.488  10.432   4.209
  207    H3*    A  20           H3*        A  20   6.363   8.417   3.443
  208    H2*    A  20           H2*        A  20   4.883   9.719   4.880
  209   2HO*    A  20          2HO*        A  20   6.642  10.101   6.400
  210    H1*    A  20           H1*        A  20   5.518  12.095   3.881
  211    H8     A  20           H8         A  20   5.890   9.912   0.874
  212   1H6     A  20          1H6         A  20  -0.282  10.394   0.330
  213   2H6     A  20          2H6         A  20   1.232   9.913  -0.461
  214    H2     A  20           H2         A  20   0.791  11.739   4.365
  215   1H5*    U  21          1H5*        U  21   5.960   9.147   7.689
  216   2H5*    U  21          2H5*        U  21   5.669   7.579   8.461
  217    H4*    U  21           H4*        U  21   3.828   9.170   8.892
  218    H3*    U  21           H3*        U  21   3.102   6.884   7.064
  219    H2*    U  21           H2*        U  21   0.797   7.552   7.458
  220   2HO*    U  21          2HO*        U  21   1.126   8.397   9.667
  221    H1*    U  21           H1*        U  21   1.333  10.049   6.825
  222    H3     U  21           H3         U  21  -0.754   8.177   3.261
  223    H5     U  21           H5         U  21   3.265   7.189   2.705
  224    H6     U  21           H6         U  21   3.751   8.056   4.917
  225   1H5*    C  22          1H5*        C  22   0.531   4.803  10.914
  226   2H5*    C  22          2H5*        C  22   0.959   5.066   9.239
  227    H4*    C  22           H4*        C  22  -1.535   6.153  10.629
  228    H3*    C  22           H3*        C  22  -1.023   3.930   8.649
  229    H2*    C  22           H2*        C  22  -3.281   4.202   7.850
  230   2HO*    C  22          2HO*        C  22  -4.184   4.950   9.955
  231    H1*    C  22           H1*        C  22  -2.949   6.764   7.468
  232   1H4     C  22          1H4         C  22  -0.637   4.404   2.164
  233   2H4     C  22          2H4         C  22   1.000   4.499   2.794
  234    H5     C  22           H5         C  22   1.474   4.935   5.132
  235    H6     C  22           H6         C  22   0.454   5.590   7.257
  236   1H5*    A  23          1H5*        A  23  -4.978   1.424  11.050
  237   2H5*    A  23          2H5*        A  23  -3.889   1.681   9.697
  238    H4*    A  23           H4*        A  23  -6.784   2.648   9.850
  239    H3*    A  23           H3*        A  23  -5.437   0.267   8.619
  240    H2*    A  23           H2*        A  23  -6.820   0.464   6.638
  241   2HO*    A  23          2HO*        A  23  -8.635   1.139   8.109
  242    H1*    A  23           H1*        A  23  -6.480   3.095   6.278
  243    H8     A  23           H8         A  23  -3.234   2.232   7.859
  244   1H6     A  23          1H6         A  23  -1.546   0.310   2.175
  245   2H6     A  23          2H6         A  23  -0.930   0.716   3.799
  246    H2     A  23           H2         A  23  -5.864   0.625   2.222
  247   1H5*    G  24          1H5*        G  24  -8.860  -0.671   7.162
  248   2H5*    G  24          2H5*        G  24  -9.380  -2.295   7.629
  249    H4*    G  24           H4*        G  24  -9.118  -2.012   5.176
  250    H3*    G  24           H3*        G  24  -7.423  -4.045   6.597
  251    H2*    G  24           H2*        G  24  -6.479  -4.655   4.470
  252   2HO*    G  24          2HO*        G  24  -8.448  -4.307   3.244
  253    H1*    G  24           H1*        G  24  -5.867  -2.168   3.683
  254    H8     G  24           H8         G  24  -5.330  -1.053   6.930
  255    H1     G  24           H1         G  24  -1.267  -5.915   5.926
  256   1H2     G  24          1H2         G  24  -1.906  -7.055   4.098
  257   2H2     G  24          2H2         G  24  -3.257  -6.449   3.151
  258   1H5*    U  25          1H5*        U  25 -11.068  -4.771   3.418
  259   2H5*    U  25          2H5*        U  25 -11.288  -6.522   3.222
  260    H4*    U  25           H4*        U  25 -11.475  -5.255   1.072
  261    H3*    U  25           H3*        U  25  -9.300  -7.317   1.299
  262    H2*    U  25           H2*        U  25  -8.605  -6.732  -0.923
  263   2HO*    U  25          2HO*        U  25 -10.653  -6.616  -1.800
  264    H1*    U  25           H1*        U  25  -8.816  -4.054  -0.671
  265    H3     U  25           H3         U  25  -4.371  -4.118  -0.388
  266    H5     U  25           H5         U  25  -5.472  -6.709   2.703
  267    H6     U  25           H6         U  25  -7.765  -6.377   2.080
  268   1H5*    A  26          1H5*        A  26  -9.744 -10.257  -2.941
  269   2H5*    A  26          2H5*        A  26  -8.452  -9.570  -1.974
  270    H4*    A  26           H4*        A  26  -9.607  -8.378  -4.530
  271    H3*    A  26           H3*        A  26  -7.124  -9.902  -3.789
  272    H2*    A  26           H2*        A  26  -5.774  -8.567  -5.249
  273   2HO*    A  26          2HO*        A  26  -7.580  -8.465  -6.831
  274    H1*    A  26           H1*        A  26  -6.663  -6.215  -4.395
  275    H8     A  26           H8         A  26  -7.173  -8.186  -1.287
  276   1H6     A  26          1H6         A  26  -1.094  -7.585  -0.288
  277   2H6     A  26          2H6         A  26  -2.649  -8.023   0.405
  278    H2     A  26           H2         A  26  -1.835  -6.577  -4.500
  279   1H5*    U  27          1H5*        U  27  -6.499  -9.855  -7.822
  280   2H5*    U  27          2H5*        U  27  -6.165 -11.487  -8.433
  281    H4*    U  27           H4*        U  27  -4.312 -10.004  -8.935
  282    H3*    U  27           H3*        U  27  -3.609 -12.098  -6.858
  283    H2*    U  27           H2*        U  27  -1.369 -11.211  -6.977
  284   2HO*    U  27          2HO*        U  27  -1.507 -10.857  -9.259
  285    H1*    U  27           H1*        U  27  -2.058  -8.642  -6.742
  286    H3     U  27           H3         U  27  -0.454 -10.246  -2.762
  287    H5     U  27           H5         U  27  -4.585 -10.913  -2.614
  288    H6     U  27           H6         U  27  -4.715 -10.268  -4.933
  289   1H5*    A  28          1H5*        A  28  -0.518 -12.282  -9.757
  290   2H5*    A  28          2H5*        A  28  -0.091 -13.960 -10.117
  291    H4*    A  28           H4*        A  28   1.868 -12.699  -9.469
  292    H3*    A  28           H3*        A  28   1.102 -14.794  -7.412
  293    H2*    A  28           H2*        A  28   3.141 -14.147  -6.291
  294   2HO*    A  28          2HO*        A  28   4.227 -13.828  -8.390
  295    H1*    A  28           H1*        A  28   2.682 -11.512  -6.376
  296    H8     A  28           H8         A  28  -0.775 -12.927  -6.162
  297   1H6     A  28          1H6         A  28   0.327 -13.504  -0.094
  298   2H6     A  28          2H6         A  28  -0.894 -13.458  -1.351
  299    H2     A  28           H2         A  28   4.190 -12.814  -2.058
  300   1H5*    U  29          1H5*        U  29   5.209 -15.215  -8.163
  301   2H5*    U  29          2H5*        U  29   5.696 -16.910  -8.253
  302    H4*    U  29           H4*        U  29   6.985 -15.678  -6.578
  303    H3*    U  29           H3*        U  29   5.186 -17.826  -5.396
  304    H2*    U  29           H2*        U  29   6.260 -17.252  -3.293
  305   2HO*    U  29          2HO*        U  29   8.308 -16.844  -4.393
  306    H1*    U  29           H1*        U  29   5.883 -14.619  -3.514
  307    H3     U  29           H3         U  29   2.784 -16.449  -0.656
  308    H5     U  29           H5         U  29   0.994 -16.572  -4.437
  309    H6     U  29           H6         U  29   3.077 -15.911  -5.405
  310   1H5*    C  30          1H5*        C  30   8.975 -18.263  -3.700
  311   2H5*    C  30          2H5*        C  30   9.471 -19.953  -3.596
  312    H4*    C  30           H4*        C  30   9.554 -18.842  -1.419
  313    H3*    C  30           H3*        C  30   7.440 -21.029  -1.564
  314    H2*    C  30           H2*        C  30   7.168 -20.600   0.815
  315   2HO*    C  30          2HO*        C  30   9.521 -20.076   0.936
  316    H1*    C  30           H1*        C  30   6.902 -17.954   0.553
  317   1H4     C  30          1H4         C  30   1.114 -20.183  -0.260
  318   2H4     C  30          2H4         C  30   1.252 -20.024  -2.023
  319    H5     C  30           H5         C  30   3.391 -19.603  -3.089
  320    H6     C  30           H6         C  30   5.678 -19.042  -2.667
  321   1H5*    C  31          1H5*        C  31   9.567 -21.563   1.955
  322   2H5*    C  31          2H5*        C  31  10.138 -23.230   2.083
  323    H4*    C  31           H4*        C  31   8.923 -22.644   4.102
  324    H3*    C  31           H3*        C  31   7.409 -24.553   2.278
  325    H2*    C  31           H2*        C  31   5.816 -24.771   4.045
  326   2HO*    C  31          2HO*        C  31   7.555 -24.655   5.700
  327    H1*    C  31           H1*        C  31   5.628 -22.098   4.507
  328   1H4     C  31          1H4         C  31   1.155 -23.429   0.366
  329   2H4     C  31          2H4         C  31   2.222 -23.049  -0.999
  330    H5     C  31           H5         C  31   4.589 -22.675  -0.717
  331    H6     C  31           H6         C  31   6.331 -22.410   0.911
  332    H3T    C  31           H3T        C  31   9.349 -25.362   3.127
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  -7.746 -24.298   3.281
    2   2H5*    G   1          2H5*        G   1  -7.801 -22.691   4.035
    3    H4*    G   1           H4*        G   1  -6.343 -24.101   5.350
    4    H3*    G   1           H3*        G   1  -4.875 -22.036   3.693
    5    H2*    G   1           H2*        G   1  -2.868 -22.737   4.849
    6   2HO*    G   1          2HO*        G   1  -3.935 -23.052   6.898
    7    H1*    G   1           H1*        G   1  -3.305 -25.366   4.477
    8    H8     G   1           H8         G   1  -4.820 -23.955   1.379
    9    H1     G   1           H1         G   1   1.584 -23.583   1.406
   10   1H2     G   1          1H2         G   1   2.345 -24.022   3.453
   11   2H2     G   1          2H2         G   1   1.251 -24.416   4.766
   12    H5T    G   1           H5T        G   1  -6.329 -21.955   2.486
   13   1H5*    G   2          1H5*        G   2  -3.573 -21.483   7.631
   14   2H5*    G   2          2H5*        G   2  -3.512 -19.766   8.056
   15    H4*    G   2           H4*        G   2  -1.370 -20.882   8.493
   16    H3*    G   2           H3*        G   2  -1.284 -18.836   6.255
   17    H2*    G   2           H2*        G   2   1.120 -19.240   6.246
   18   2HO*    G   2          2HO*        G   2   1.169 -19.503   8.597
   19    H1*    G   2           H1*        G   2   0.905 -21.922   6.213
   20    H8     G   2           H8         G   2  -2.118 -20.963   4.263
   21    H1     G   2           H1         G   2   3.343 -19.777   1.099
   22   1H2     G   2          1H2         G   2   5.060 -19.935   2.498
   23   2H2     G   2          2H2         G   2   4.837 -20.394   4.183
   24   1H5*    A   3          1H5*        A   3   2.013 -18.125   8.763
   25   2H5*    A   3          2H5*        A   3   2.138 -16.415   9.199
   26    H4*    A   3           H4*        A   3   4.265 -17.257   8.312
   27    H3*    A   3           H3*        A   3   2.840 -15.216   6.583
   28    H2*    A   3           H2*        A   3   4.825 -15.272   5.176
   29   2HO*    A   3          2HO*        A   3   6.235 -15.535   7.087
   30    H1*    A   3           H1*        A   3   4.974 -17.955   5.060
   31    H8     A   3           H8         A   3   1.285 -17.494   5.293
   32   1H6     A   3          1H6         A   3   1.403 -16.150  -0.761
   33   2H6     A   3          2H6         A   3   0.404 -16.611   0.601
   34    H2     A   3           H2         A   3   5.572 -15.899   0.795
   35   1H5*    U   4          1H5*        U   4   6.820 -14.012   6.868
   36   2H5*    U   4          2H5*        U   4   6.990 -12.282   7.200
   37    H4*    U   4           H4*        U   4   8.220 -12.945   5.165
   38    H3*    U   4           H3*        U   4   5.844 -11.115   4.684
   39    H2*    U   4           H2*        U   4   6.649 -11.041   2.385
   40   2HO*    U   4          2HO*        U   4   8.897 -11.064   3.037
   41    H1*    U   4           H1*        U   4   6.975 -13.711   2.166
   42    H3     U   4           H3         U   4   3.185 -12.318  -0.048
   43    H5     U   4           H5         U   4   1.939 -13.344   3.830
   44    H6     U   4           H6         U   4   4.247 -13.527   4.477
   45   1H5*    A   5          1H5*        A   5   9.300  -9.474   2.818
   46   2H5*    A   5          2H5*        A   5   9.363  -7.711   2.961
   47    H4*    A   5           H4*        A   5   9.524  -8.426   0.615
   48    H3*    A   5           H3*        A   5   6.967  -6.942   1.306
   49    H2*    A   5           H2*        A   5   6.506  -7.034  -1.083
   50   2HO*    A   5          2HO*        A   5   8.772  -6.736  -1.655
   51    H1*    A   5           H1*        A   5   7.041  -9.659  -1.321
   52    H8     A   5           H8         A   5   5.672  -9.391   2.169
   53   1H6     A   5          1H6         A   5   0.065  -9.445  -0.459
   54   2H6     A   5          2H6         A   5   0.960  -9.597   1.050
   55    H2     A   5           H2         A   5   3.060  -8.668  -3.645
   56   1H5*    U   6          1H5*        U   6   8.640  -5.163  -2.170
   57   2H5*    U   6          2H5*        U   6   8.453  -3.401  -2.133
   58    H4*    U   6           H4*        U   6   7.434  -4.475  -4.149
   59    H3*    U   6           H3*        U   6   5.587  -2.963  -2.268
   60    H2*    U   6           H2*        U   6   3.846  -3.386  -3.853
   61   2HO*    U   6          2HO*        U   6   5.094  -3.016  -5.726
   62    H1*    U   6           H1*        U   6   4.467  -5.996  -4.294
   63    H3     U   6           H3         U   6   0.638  -5.696  -1.834
   64    H5     U   6           H5         U   6   3.746  -5.734   0.979
   65    H6     U   6           H6         U   6   5.314  -5.500  -0.829
   66   1H5*    A   7          1H5*        A   7   3.386   0.618  -5.045
   67   2H5*    A   7          2H5*        A   7   3.024  -0.470  -3.707
   68    H4*    A   7           H4*        A   7   2.330  -0.978  -6.644
   69    H3*    A   7           H3*        A   7   0.904  -0.074  -4.160
   70    H2*    A   7           H2*        A   7  -1.103  -1.203  -4.786
   71   2HO*    A   7          2HO*        A   7  -0.795  -1.037  -7.175
   72    H1*    A   7           H1*        A   7   0.167  -3.506  -5.087
   73    H8     A   7           H8         A   7   2.609  -2.193  -2.705
   74   1H6     A   7          1H6         A   7  -1.681  -2.711   1.739
   75   2H6     A   7          2H6         A   7   0.029  -2.496   1.401
   76    H2     A   7           H2         A   7  -3.742  -3.021  -2.165
   77   1H5*    U   8          1H5*        U   8  -2.508   2.449  -7.015
   78   2H5*    U   8          2H5*        U   8  -1.702   1.905  -5.545
   79    H4*    U   8           H4*        U   8  -4.151   0.593  -6.809
   80    H3*    U   8           H3*        U   8  -3.606   2.292  -4.370
   81    H2*    U   8           H2*        U   8  -5.527   1.245  -3.306
   82   2HO*    U   8          2HO*        U   8  -6.645   0.795  -5.448
   83    H1*    U   8           H1*        U   8  -4.488  -1.166  -3.748
   84    H3     U   8           H3         U   8  -3.343   0.484   0.446
   85    H5     U   8           H5         U   8  -0.059   1.164  -2.079
   86    H6     U   8           H6         U   8  -1.447   0.588  -3.957
   87   1H5*    G   9          1H5*        G   9  -8.200   4.453  -5.147
   88   2H5*    G   9          2H5*        G   9  -6.801   4.038  -4.152
   89    H4*    G   9           H4*        G   9  -9.624   2.930  -3.817
   90    H3*    G   9           H3*        G   9  -7.981   5.082  -2.509
   91    H2*    G   9           H2*        G   9  -8.769   4.445  -0.319
   92   2HO*    G   9          2HO*        G   9 -10.950   4.017  -1.157
   93    H1*    G   9           H1*        G   9  -8.403   1.799  -0.616
   94    H8     G   9           H8         G   9  -5.664   3.115  -2.778
   95    H1     G   9           H1         G   9  -4.445   3.916   3.465
   96   1H2     G   9          1H2         G   9  -6.320   3.653   4.629
   97   2H2     G   9          2H2         G   9  -7.824   3.184   3.858
   98   1H5*    A  10          1H5*        A  10 -11.422   5.649  -0.244
   99   2H5*    A  10          2H5*        A  10 -11.844   7.374  -0.320
  100    H4*    A  10           H4*        A  10 -11.454   6.721   2.008
  101    H3*    A  10           H3*        A  10  -9.200   8.380   0.847
  102    H2*    A  10           H2*        A  10  -8.443   8.605   3.143
  103   2HO*    A  10          2HO*        A  10 -10.579   8.458   4.173
  104    H1*    A  10           H1*        A  10  -8.416   5.971   3.429
  105    H8     A  10           H8         A  10  -7.941   6.291  -0.260
  106   1H6     A  10          1H6         A  10  -2.040   7.724   0.907
  107   2H6     A  10          2H6         A  10  -3.203   7.304  -0.347
  108    H2     A  10           H2         A  10  -4.257   7.889   4.733
  109   1H5*    U  11          1H5*        U  11 -10.882  12.129   3.901
  110   2H5*    U  11          2H5*        U  11  -9.681  11.275   2.925
  111    H4*    U  11           H4*        U  11  -9.775  11.241   5.974
  112    H3*    U  11           H3*        U  11  -8.249  12.924   3.982
  113    H2*    U  11           H2*        U  11  -6.352  12.866   5.502
  114   2HO*    U  11          2HO*        U  11  -7.713  13.002   7.409
  115    H1*    U  11           H1*        U  11  -6.467  10.214   5.951
  116    H3     U  11           H3         U  11  -3.064  11.156   3.000
  117    H5     U  11           H5         U  11  -6.448  10.412   0.632
  118    H6     U  11           H6         U  11  -7.795  10.399   2.640
  119   1H5*    A  12          1H5*        A  12  -7.538  14.551   7.979
  120   2H5*    A  12          2H5*        A  12  -7.741  16.313   7.881
  121    H4*    A  12           H4*        A  12  -5.556  15.705   8.885
  122    H3*    A  12           H3*        A  12  -5.611  17.138   6.229
  123    H2*    A  12           H2*        A  12  -3.183  17.140   6.276
  124   2HO*    A  12          2HO*        A  12  -3.220  17.574   8.617
  125    H1*    A  12           H1*        A  12  -2.863  14.650   7.136
  126    H8     A  12           H8         A  12  -5.768  14.539   4.713
  127   1H6     A  12          1H6         A  12  -1.398  13.720   0.375
  128   2H6     A  12          2H6         A  12  -3.120  13.676   0.700
  129    H2     A  12           H2         A  12   0.605  14.764   4.197
  130   1H5*    C  13          1H5*        C  13  -2.501  19.046   8.466
  131   2H5*    C  13          2H5*        C  13  -2.678  20.820   8.311
  132    H4*    C  13           H4*        C  13  -0.458  20.165   7.511
  133    H3*    C  13           H3*        C  13  -2.333  21.008   5.325
  134    H2*    C  13           H2*        C  13  -0.516  20.619   3.817
  135   2HO*    C  13          2HO*        C  13   1.118  21.560   5.084
  136    H1*    C  13           H1*        C  13   0.396  18.321   4.910
  137   1H4     C  13          1H4         C  13  -4.890  16.602   1.336
  138   2H4     C  13          2H4         C  13  -3.479  16.337   0.325
  139    H5     C  13           H5         C  13  -4.748  17.723   3.517
  140    H6     C  13           H6         C  13  -3.249  18.698   5.095
  141   1H5*    A  14          1H5*        A  14   0.577  24.591   2.740
  142   2H5*    A  14          2H5*        A  14  -0.764  23.469   2.475
  143    H4*    A  14           H4*        A  14   2.198  22.868   2.117
  144    H3*    A  14           H3*        A  14  -0.257  23.024   0.416
  145    H2*    A  14           H2*        A  14   0.517  21.200  -0.958
  146   2HO*    A  14          2HO*        A  14   2.842  21.521  -0.712
  147    H1*    A  14           H1*        A  14   0.852  19.606   1.054
  148    H8     A  14           H8         A  14  -1.704  21.687   2.770
  149   1H6     A  14          1H6         A  14  -5.946  19.041  -0.886
  150   2H6     A  14          2H6         A  14  -5.695  20.077   0.514
  151    H2     A  14           H2         A  14  -1.946  17.933  -2.420
  152   1H5*    A  15          1H5*        A  15   4.777  21.668  -0.790
  153   2H5*    A  15          2H5*        A  15   5.287  22.659  -2.171
  154    H4*    A  15           H4*        A  15   5.215  20.209  -2.690
  155    H3*    A  15           H3*        A  15   3.337  22.040  -4.184
  156    H2*    A  15           H2*        A  15   2.579  20.175  -5.385
  157   2HO*    A  15          2HO*        A  15   4.518  19.054  -5.790
  158    H1*    A  15           H1*        A  15   2.452  18.387  -3.347
  159    H8     A  15           H8         A  15   1.486  22.026  -2.890
  160   1H6     A  15          1H6         A  15  -4.100  20.284  -4.990
  161   2H6     A  15          2H6         A  15  -3.208  21.628  -4.286
  162    H2     A  15           H2         A  15  -1.350  16.860  -5.273
  163   1H5*    U  16          1H5*        U  16   5.881  19.076  -6.618
  164   2H5*    U  16          2H5*        U  16   6.143  19.737  -8.240
  165    H4*    U  16           H4*        U  16   5.203  17.378  -8.220
  166    H3*    U  16           H3*        U  16   3.698  19.645  -9.534
  167    H2*    U  16           H2*        U  16   1.986  18.197 -10.098
  168   2HO*    U  16          2HO*        U  16   3.347  16.569 -11.046
  169    H1*    U  16           H1*        U  16   2.239  16.393  -7.953
  170    H3     U  16           H3         U  16  -2.082  17.759  -7.962
  171    H5     U  16           H5         U  16   0.068  21.299  -7.373
  172    H6     U  16           H6         U  16   2.118  20.037  -7.548
  173   1H5*    U  17          1H5*        U  17   5.239  15.688 -11.448
  174   2H5*    U  17          2H5*        U  17   5.771  16.048 -13.082
  175    H4*    U  17           H4*        U  17   3.388  14.987 -13.720
  176    H3*    U  17           H3*        U  17   3.696  14.363 -10.924
  177    H2*    U  17           H2*        U  17   4.259  12.090 -10.923
  178   2HO*    U  17          2HO*        U  17   2.423  11.512 -12.237
  179    H1*    U  17           H1*        U  17   5.628  11.806 -13.182
  180    H3     U  17           H3         U  17   9.745  13.533 -12.256
  181    H5     U  17           H5         U  17   7.350  14.624  -8.994
  182    H6     U  17           H6         U  17   5.448  13.754 -10.146
  183   1H5*    U  18          1H5*        U  18   3.506  13.446  -9.260
  184   2H5*    U  18          2H5*        U  18   2.735  11.875  -9.349
  185    H4*    U  18           H4*        U  18   2.274  13.768  -7.014
  186    H3*    U  18           H3*        U  18   4.619  12.257  -7.840
  187    H2*    U  18           H2*        U  18   4.732  10.596  -6.152
  188   2HO*    U  18          2HO*        U  18   4.304  12.045  -4.428
  189    H1*    U  18           H1*        U  18   2.119   9.962  -6.018
  190    H3     U  18           H3         U  18   1.161   7.939 -10.041
  191    H5     U  18           H5         U  18   5.099   9.319 -10.408
  192    H6     U  18           H6         U  18   4.866  10.449  -8.334
  193   1H5*    G  19          1H5*        G  19   8.215  13.302  -4.197
  194   2H5*    G  19          2H5*        G  19   7.864  11.606  -3.816
  195    H4*    G  19           H4*        G  19   8.278  13.125  -1.831
  196    H3*    G  19           H3*        G  19   5.515  11.891  -1.960
  197    H2*    G  19           H2*        G  19   5.326  12.684   0.341
  198   2HO*    G  19          2HO*        G  19   7.618  12.553   0.913
  199    H1*    G  19           H1*        G  19   5.919  15.148  -0.475
  200    H8     G  19           H8         G  19   4.375  13.379  -3.472
  201    H1     G  19           H1         G  19   0.171  15.400   0.943
  202   1H2     G  19          1H2         G  19   1.264  16.167   2.697
  203   2H2     G  19          2H2         G  19   3.012  16.060   2.820
  204   1H5*    A  20          1H5*        A  20   7.228   9.099   2.123
  205   2H5*    A  20          2H5*        A  20   5.934   9.868   1.199
  206    H4*    A  20           H4*        A  20   7.014  10.865   3.880
  207    H3*    A  20           H3*        A  20   4.547   9.361   3.017
  208    H2*    A  20           H2*        A  20   3.378  10.355   4.914
  209   2HO*    A  20          2HO*        A  20   5.460  10.648   6.217
  210    H1*    A  20           H1*        A  20   3.957  12.776   3.998
  211    H8     A  20           H8         A  20   4.361  11.069   0.761
  212   1H6     A  20          1H6         A  20  -1.794  10.533   0.427
  213   2H6     A  20          2H6         A  20  -0.283  10.456  -0.474
  214    H2     A  20           H2         A  20  -0.758  11.539   4.615
  215   1H5*    U  21          1H5*        U  21   4.577   6.965   7.600
  216   2H5*    U  21          2H5*        U  21   3.902   7.398   6.025
  217    H4*    U  21           H4*        U  21   3.096   8.617   8.708
  218    H3*    U  21           H3*        U  21   1.781   6.730   6.739
  219    H2*    U  21           H2*        U  21  -0.357   7.533   7.609
  220   2HO*    U  21          2HO*        U  21   0.831   8.251   9.774
  221    H1*    U  21           H1*        U  21   0.321  10.006   6.980
  222    H3     U  21           H3         U  21  -1.926   7.864   3.512
  223    H5     U  21           H5         U  21   2.164   7.744   2.574
  224    H6     U  21           H6         U  21   2.652   8.521   4.801
  225   1H5*    C  22          1H5*        C  22  -0.943   7.597  10.727
  226   2H5*    C  22          2H5*        C  22  -0.977   6.140  11.740
  227    H4*    C  22           H4*        C  22  -3.212   6.624  10.867
  228    H3*    C  22           H3*        C  22  -1.922   4.131   9.685
  229    H2*    C  22           H2*        C  22  -4.030   3.739   8.645
  230   2HO*    C  22          2HO*        C  22  -5.307   4.325  10.448
  231    H1*    C  22           H1*        C  22  -4.456   6.326   7.861
  232   1H4     C  22          1H4         C  22  -1.655   3.799   2.800
  233   2H4     C  22          2H4         C  22  -0.063   4.078   3.488
  234    H5     C  22           H5         C  22   0.256   4.903   5.769
  235    H6     C  22           H6         C  22  -0.881   5.656   7.756
  236   1H5*    A  23          1H5*        A  23  -5.097   0.366  10.879
  237   2H5*    A  23          2H5*        A  23  -4.062   0.948   9.570
  238    H4*    A  23           H4*        A  23  -7.042   1.546   9.849
  239    H3*    A  23           H3*        A  23  -5.389  -0.406   8.291
  240    H2*    A  23           H2*        A  23  -6.864  -0.197   6.391
  241   2HO*    A  23          2HO*        A  23  -8.846   0.183   7.700
  242    H1*    A  23           H1*        A  23  -6.668   2.442   6.336
  243    H8     A  23           H8         A  23  -3.419   1.978   7.989
  244   1H6     A  23          1H6         A  23  -1.160   0.239   2.480
  245   2H6     A  23          2H6         A  23  -0.752   0.754   4.120
  246    H2     A  23           H2         A  23  -5.575  -0.125   2.315
  247   1H5*    G  24          1H5*        G  24  -8.329  -1.415   5.715
  248   2H5*    G  24          2H5*        G  24  -9.343  -2.745   6.288
  249    H4*    G  24           H4*        G  24  -8.455  -3.456   4.228
  250    H3*    G  24           H3*        G  24  -8.026  -4.816   6.616
  251    H2*    G  24           H2*        G  24  -5.812  -4.417   6.944
  252   2HO*    G  24          2HO*        G  24  -6.096  -6.526   5.144
  253    H1*    G  24           H1*        G  24  -5.080  -4.293   4.054
  254    H8     G  24           H8         G  24  -5.461  -1.923   6.999
  255    H1     G  24           H1         G  24   0.570  -2.815   4.990
  256   1H2     G  24          1H2         G  24   0.558  -4.396   3.351
  257   2H2     G  24          2H2         G  24  -0.962  -5.064   2.790
  258   1H5*    U  25          1H5*        U  25  -9.481  -7.013   1.691
  259   2H5*    U  25          2H5*        U  25  -7.913  -6.215   1.927
  260    H4*    U  25           H4*        U  25 -10.275  -5.007   0.410
  261    H3*    U  25           H3*        U  25  -8.166  -6.898  -0.323
  262    H2*    U  25           H2*        U  25  -7.013  -5.556  -1.936
  263   2HO*    U  25          2HO*        U  25  -9.086  -4.906  -2.883
  264    H1*    U  25           H1*        U  25  -7.113  -3.177  -0.753
  265    H3     U  25           H3         U  25  -3.744  -3.501   2.293
  266    H5     U  25           H5         U  25  -4.335  -7.413   0.912
  267    H6     U  25           H6         U  25  -6.308  -6.679  -0.194
  268   1H5*    A  26          1H5*        A  26  -9.375  -5.997  -4.602
  269   2H5*    A  26          2H5*        A  26  -9.323  -7.622  -5.310
  270    H4*    A  26           H4*        A  26  -7.857  -6.069  -6.522
  271    H3*    A  26           H3*        A  26  -6.354  -8.243  -5.018
  272    H2*    A  26           H2*        A  26  -4.406  -7.392  -6.179
  273   2HO*    A  26          2HO*        A  26  -5.623  -6.908  -8.147
  274    H1*    A  26           H1*        A  26  -4.876  -4.827  -5.503
  275    H8     A  26           H8         A  26  -6.308  -7.141  -2.862
  276   1H6     A  26          1H6         A  26  -0.657  -6.996  -0.336
  277   2H6     A  26          2H6         A  26  -2.326  -7.496  -0.105
  278    H2     A  26           H2         A  26  -0.415  -5.219  -4.394
  279   1H5*    U  27          1H5*        U  27  -4.846  -8.126  -8.897
  280   2H5*    U  27          2H5*        U  27  -4.519  -9.743  -9.539
  281    H4*    U  27           H4*        U  27  -2.507  -8.307  -9.591
  282    H3*    U  27           H3*        U  27  -2.334 -10.648  -7.661
  283    H2*    U  27           H2*        U  27  -0.008  -9.964  -7.399
  284   2HO*    U  27          2HO*        U  27   0.258  -9.354  -9.627
  285    H1*    U  27           H1*        U  27  -0.588  -7.350  -7.039
  286    H3     U  27           H3         U  27   0.472  -9.275  -3.017
  287    H5     U  27           H5         U  27  -3.659  -9.889  -3.489
  288    H6     U  27           H6         U  27  -3.480  -9.098  -5.739
  289   1H5*    A  28          1H5*        A  28   1.060 -10.677 -10.250
  290   2H5*    A  28          2H5*        A  28   1.525 -12.324 -10.706
  291    H4*    A  28           H4*        A  28   3.417 -11.114  -9.716
  292    H3*    A  28           H3*        A  28   2.367 -13.386  -7.990
  293    H2*    A  28           H2*        A  28   4.314 -12.929  -6.600
  294   2HO*    A  28          2HO*        A  28   5.683 -12.403  -8.436
  295    H1*    A  28           H1*        A  28   3.847 -10.285  -6.463
  296    H8     A  28           H8         A  28   0.395 -11.742  -6.809
  297   1H6     A  28          1H6         A  28   0.678 -12.842  -0.722
  298   2H6     A  28          2H6         A  28  -0.379 -12.733  -2.124
  299    H2     A  28           H2         A  28   4.784 -11.914  -2.136
  300   1H5*    U  29          1H5*        U  29   6.517 -13.826  -8.415
  301   2H5*    U  29          2H5*        U  29   7.001 -15.518  -8.620
  302    H4*    U  29           H4*        U  29   8.144 -14.468  -6.699
  303    H3*    U  29           H3*        U  29   6.159 -16.652  -5.946
  304    H2*    U  29           H2*        U  29   7.077 -16.373  -3.705
  305   2HO*    U  29          2HO*        U  29   9.249 -15.962  -4.516
  306    H1*    U  29           H1*        U  29   6.832 -13.691  -3.710
  307    H3     U  29           H3         U  29   3.454 -15.575  -1.271
  308    H5     U  29           H5         U  29   1.992 -15.401  -5.202
  309    H6     U  29           H6         U  29   4.187 -14.758  -5.932
  310   1H5*    C  30          1H5*        C  30   9.834 -17.461  -4.077
  311   2H5*    C  30          2H5*        C  30  10.272 -19.175  -4.185
  312    H4*    C  30           H4*        C  30  10.295 -18.374  -1.849
  313    H3*    C  30           H3*        C  30   8.113 -20.409  -2.473
  314    H2*    C  30           H2*        C  30   7.726 -20.384  -0.072
  315   2HO*    C  30          2HO*        C  30  10.076 -20.047   0.327
  316    H1*    C  30           H1*        C  30   7.614 -17.694   0.093
  317   1H4     C  30          1H4         C  30   1.733 -19.515  -1.370
  318   2H4     C  30          2H4         C  30   2.014 -19.111  -3.063
  319    H5     C  30           H5         C  30   4.243 -18.533  -3.912
  320    H6     C  30           H6         C  30   6.532 -18.170  -3.287
  321   1H5*    C  31          1H5*        C  31  10.062 -21.632   0.996
  322   2H5*    C  31          2H5*        C  31  10.570 -23.326   0.859
  323    H4*    C  31           H4*        C  31   9.298 -23.035   2.925
  324    H3*    C  31           H3*        C  31   7.811 -24.528   0.727
  325    H2*    C  31           H2*        C  31   6.152 -25.012   2.416
  326   2HO*    C  31          2HO*        C  31   7.795 -25.249   4.121
  327    H1*    C  31           H1*        C  31   6.045 -22.441   3.310
  328   1H4     C  31          1H4         C  31   1.638 -22.870  -1.181
  329   2H4     C  31          2H4         C  31   2.778 -22.294  -2.392
  330    H5     C  31           H5         C  31   5.169 -22.007  -1.922
  331    H6     C  31           H6         C  31   6.849 -22.118  -0.214
  332    H3T    C  31           H3T        C  31   9.697 -25.545   1.506