*HEADER    RNA                                     24-JAN-05   1YNE              
*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 APOB 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   08-FEB-05 1YNE    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, 934, 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, 937, 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, 883, 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, 871, 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, 874, 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, 820, 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, 808, 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, 820, 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, 811, 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, 680, 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, 629, 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'   3.7 
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 382, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 12    ADE   H8    12    ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 380, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 12    ADE   H8    12    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 367, 361, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &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    URA   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'   11    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 349, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H1'   13    URA  1H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 364, 391, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12    ADE   H1'   13    URA   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   H8    13    URA   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    URA   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    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 397, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 12    ADE   H2    12    ADE   H1'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 364, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12    ADE   H2    12    ADE  1H2'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 382, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 12    ADE   H2    20    ADE   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 617, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 12    ADE   H2    20    ADE   H8    6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 376, 620, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 13    URA   H1'   14    ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 427, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 13    URA   H1'   14    ADE   H8    4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 430, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    URA   H1'   12    ADE  1H2'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 382, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    URA   H1'   14    ADE  1H5'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 421, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    URA   H5    12    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 402, 367, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    URA   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    URA   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    URA   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    URA   H6    13    URA   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    URA   H6    13    URA  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 412, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 13    URA   H6    13    URA   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 410, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 13    URA   H6    13    URA   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    URA   H6    13    URA  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 391, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    URA   H6    13    URA  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 392, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 13    URA   H6    14    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 400, 430, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 13    URA   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    URA   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= 430, 427, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H8    14    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 445, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H8    14    ADE   H3'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 443, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H8    14    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 424, 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= 430, 421, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H8    14    ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 422, 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= 439, 460, 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= 439, 472, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 14    ADE   H8    13    URA   H1'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 397, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 14    ADE   H8    13    URA  1H2'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 412, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 14    ADE   H8    13    URA   H3'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 430, 410, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 14    ADE   H1'   15    ADE  1H5'   5.0   
 &rst
  ixpk= 0, nxpk= 0, iat= 427, 454, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 15    ADE   H8    15    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 460, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 15    ADE   H8    15    ADE  1H2'   3.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 478, 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= 463, 476, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 457, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE  1H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 454, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    15    ADE  2H5'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 455, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H8    14    ADE  1H2'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 463, 445, 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= 463, 443, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 15    ADE   H2    16    URA   H1'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 493, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 16    URA   H5    15    ADE   H8    6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 463, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 16    URA   H5    15    ADE   H1'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 460, 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= 496, 493, 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= 496, 508, 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= 496, 506, 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= 496, 490, 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= 496, 487, 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= 496, 488, 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= 498, 508, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 16    URA   H5    16    URA   H3'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 498, 506, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 17    URA   H6    17    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 526, 523, 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= 526, 538, 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= 526, 536, 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= 526, 520, 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= 526, 517, 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= 526, 518, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H6    16    URA   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 526, 493, 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= 528, 538, 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= 528, 536, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 17    URA   H5    17    URA  1H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 528, 517, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 17    URA   H5    17    URA  2H5'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 528, 518, 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= 556, 553, 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= 556, 568, 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= 556, 566, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H6    18    URA   H4'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 550, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H6    18    URA  1H5'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 547, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 18    URA   H6    18    URA  2H5'   5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 548, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 18    URA   H6    17    URA   H1'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 556, 523, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H5    18    URA  1H2'   4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 558, 568, 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= 558, 566, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 18    URA   H5    18    URA  1H5'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 558, 547, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 18    URA   H5    18    URA  2H5'   5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 558, 548, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 19    GUA   H8    18    URA  1H2'   3.7
 &rst
  ixpk= 0, nxpk= 0, iat= 586, 568, 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= 586, 566, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 19    GUA   H8    19    GUA   H3'   3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 586, 600, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 19    GUA   H8    19    GUA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 586, 583, r1= 1.30, r2= 1.80, r3= 3.70, r4= 4.20,  &end
#
# 20    ADE   H8    20    ADE   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 620, 617, 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= 620, 635, 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= 620, 633, 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= 620, 614, 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= 620, 611, 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= 620, 612, 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= 617, 650, 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= 620, 583, 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= 620, 602, 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= 620, 600, 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= 629, 617, 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= 629, 650, 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= 629, 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= 650, 683, 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= 650, 635, 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= 655, 650, 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= 655, 665, 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= 655, 663, 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= 653, 665, 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= 653, 663, 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= 653, 647, 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= 653, 644, 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= 653, 645, 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= 653, 635, 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= 653, 633, 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= 653, 614, 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= 653, 617, 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= 653, 620, 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= 655, 617, 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= 655, 635, 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= 655, 633, 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= 655, 620, 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= 655, 685, 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= 680, 665, 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= 685, 696, 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= 685, 694, 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= 685, 650, 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= 685, 665, 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= 685, 663, 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= 685, 653, 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= 683, 680, 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= 683, 696, 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= 683, 694, 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= 683, 677, 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= 683, 674, 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= 683, 675, 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= 683, 665, 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= 683, 663, 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= 683, 647, 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= 714, 680, 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= 714, 711, 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= 714, 729, 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= 714, 727, 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= 714, 708, 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= 714, 705, 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= 714, 706, 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= 711, 696, 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= 711, 738, 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= 714, 683, 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= 714, 696, 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= 714, 694, 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= 723, 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= 723, 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= 723, 747, 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= 723, 744, 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= 747, 711, 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= 747, 744, 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= 747, 763, 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= 747, 761, 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= 747, 738, 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= 747, 739, 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= 747, 714, 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= 778, 808, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 25    URA   H5    25    URA   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 783, 778, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 25    URA   H5    25    URA  1H2'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 783, 793, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 25    URA   H5    25    URA   H3'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 783, 791, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 25    URA   H6    25    URA   H1'   3.7  
 &rst
  ixpk= 0, nxpk= 0, iat= 781, 778, 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= 781, 793, 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= 781, 791, 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= 781, 775, 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= 781, 772, 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= 781, 773, 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= 781, 744, r1= 1.30, r2= 1.80, r3= 5.00, r4= 5.50,  &end
#
# 25    URA   H6    26    ADE   H8    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 781, 811, 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= 808, 844, 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= 808, 841, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  &end
#
# 26    ADE   H1'   25    URA  1H2'   4.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 808, 793, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H2    26    ADE   H1'   6.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 820, 808, 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= 820, 826, 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= 820, 841, 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= 820, 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= 820, 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= 820, 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= 820, 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= 811, 808, 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= 811, 826, 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= 811, 824, 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= 811, 805, 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= 811, 802, 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= 811, 803, 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= 811, 778, r1= 1.30, r2= 1.80, r3= 4.50, r4= 5.00,  &end
#
# 26    ADE   H8    25    URA  1H2'   2.5  
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 793, r1= 1.30, r2= 1.80, r3= 2.50, r4= 3.00,  &end
#
# 26    ADE   H8    25    URA   H3'   3.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 791, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26    ADE   H8    27    URA   H6    5.0  
 &rst
  ixpk= 0, nxpk= 0, iat= 811, 844, 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= 841, 874, 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= 841, 871, 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= 841, 826, 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= 846, 811, 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= 846, 841, 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= 846, 856, 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= 846, 854, 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= 846, 808, 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= 846, 826, 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= 846, 824, 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= 844, 841, 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= 844, 856, 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= 844, 854, 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= 844, 838, 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= 844, 835, 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= 844, 836, 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= 844, 826, 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= 844, 824, 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= 844, 805, 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= 844, 811, 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= 874, 841, 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= 874, 871, 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= 874, 889, 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= 874, 887, 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= 874, 868, 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= 874, 865, 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= 874, 866, 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= 871, 904, 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= 871, 856, 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= 874, 856, 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= 874, 854, 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= 874, 838, 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= 874, 907, 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= 874, 909, 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= 883, 871, 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= 883, 889, 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= 883, 904, 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= 883, 919, 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= 883, 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= 883, 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= 883, 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= 871, 907, 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= 904, 889, 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= 909, 904, 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= 909, 919, 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= 909, 917, 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= 909, 874, 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= 909, 871, 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= 909, 939, 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= 909, 889, 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= 909, 887, 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= 907, 904, 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= 907, 919, 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= 907, 917, 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= 907, 901, 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= 907, 898, 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= 907, 899, 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= 907, 889, 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= 907, 887, 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= 907, 868, 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= 907, 937, 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= 934, 965, 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= 934, 919, 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= 937, 934, 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= 937, 950, 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= 937, 948, 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= 937, 931, 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= 937, 928, 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= 937, 929, 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= 937, 968, 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= 937, 904, 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= 937, 919, 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= 937, 917, 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= 937, 901, 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= 939, 904, 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= 939, 919, 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= 939, 917, 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= 965, 934, 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= 965, 950, 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= 970, 979, 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= 970, 934, 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= 970, 950, 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= 970, 948, 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= 968, 934, 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= 968, 950, 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= 968, 948, 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= 968, 965, 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= 968, 981, 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= 968, 979, 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= 968, 962, 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= 968, 959, 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= 968, 960, 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, 973, 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, 965, 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, 977, 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, 934, 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, 942, 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, 946, 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, 913, 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= 913,  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= 913,  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= 911,  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= 913, 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= 913,  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, 883, 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, 879, 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, 879, 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, 850, 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= 850, 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= 850, 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= 848, 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= 850, 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, 820, 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, 816, 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, 816, 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, 723, 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, 719, 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, 719, 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, 692, 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, 688, 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, 659, 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, 680, 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= 659, 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= 657, 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= 659, 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= 659, 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, 629, 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, 625, 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, 625, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
# 985 atoms read from pdb file ../RNAU6666new.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 URA DELTA:  (13 RU C5')-(13 RU C4')-(13 RU C3')-(13 RU O3')  65.0 180.0
 &rst     iat =   390,   393,   409,   415,
   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 =   420,   423,   442,   448,
   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 =   453,   456,   475,   481,
   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 =   486,   489,   505,   511,
   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 =   516,   519,   535,   541,
   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 =   546,   549,   565,   571,
   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 =   576,   579,   599,   605,
   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 =   610,   613,   632,   638,
   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 =   643,   646,   662,   668,
   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 =   673,   676,   693,   699,
   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 =   704,   707,   726,   732,
   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')  65.0 105.0
 &rst     iat =   737,   740,   760,   766,
   r1 =  64.0, r2 =  65.0, r3 = 105.0, r4 = 106.0,
 &end

# 25 URA DELTA:  (25 RU C5')-(25 RU C4')-(25 RU C3')-(25 RU O3')  65.0 180.0
 &rst     iat =   771,   774,   790,   796,
   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 =   801,   804,   823,   829,
   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 =   834,   837,   853,   859,
   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 =   864,   867,   886,   892,
   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 =   897,   900,   916,   922,
   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 =   927,   930,   947,   953,
   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 =   958,   961,   978,   984,
   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 =   250.0, rk3 =   250.0, &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 =   829,   830,   833,   834,
   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 =   859,   860,   863,   864,
   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 =   892,   893,   896,   897,
   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 =   922,   923,   926,   927,
   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 =   953,   954,   957,   958,
   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 =   830,   833,   834,   837,
   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 =   860,   863,   864,   867,
   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 =   893,   896,   897,   900,
   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 =   923,   926,   927,   930,
   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 =   954,   957,   958,   961,
   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 =   833,   834,   837,   853,
   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 =   863,   864,   867,   886,
   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 =   896,   897,   900,   916,
   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 =   926,   927,   930,   947,
   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 =   957,   958,   961,   978,
   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 =   837,   853,   859,   860,
   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 =   867,   886,   892,   893,
   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 =   900,   916,   922,   923,
   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 =   930,   947,   953,   954,
   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 =   853,   859,   860,   863,
   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 =   886,   892,   893,   896,
   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 =   916,   922,   923,   926,
   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 =   947,   953,   954,   957,
   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

# 29 URA CHI:  (29 RU O4')-(29 RU C1')-(29 RU N1)-(29 RU C2) 180.0 220.0
 &rst     iat =   902,   903,   905,   914,
   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 =   932,   933,   935,   945,
   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 =   963,   964,   966,   976,
   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=411,395,398,397, &end
#
#  chirality for residue 13 atoms:  C3' C1' H2'1 O2'
 &rst iat=409,396,412,413, &end
#
#  chirality for residue 13 atoms:  O3' C2' C4' H3'
 &rst iat=415,411,393,410, &end
#
#  chirality for residue 13 atoms:  C3' C5' O4' H4'
 &rst iat=409,390,395,394, &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=444,425,428,427, &end
#
#  chirality for residue 14 atoms:  C3' C1' H2'1 O2'
 &rst iat=442,426,445,446, &end
#
#  chirality for residue 14 atoms:  O3' C2' C4' H3'
 &rst iat=448,444,423,443, &end
#
#  chirality for residue 14 atoms:  C3' C5' O4' H4'
 &rst iat=442,420,425,424, &end
#
#  chirality for residue 14 atoms:  C4' O5' H5'1 H5'2
 &rst iat=423,419,421,422, &end
#
#  chirality for residue 15 atoms:  C2' O4' N9 H1'
 &rst iat=477,458,461,460, &end
#
#  chirality for residue 15 atoms:  C3' C1' H2'1 O2'
 &rst iat=475,459,478,479, &end
#
#  chirality for residue 15 atoms:  O3' C2' C4' H3'
 &rst iat=481,477,456,476, &end
#
#  chirality for residue 15 atoms:  C3' C5' O4' H4'
 &rst iat=475,453,458,457, &end
#
#  chirality for residue 15 atoms:  C4' O5' H5'1 H5'2
 &rst iat=456,452,454,455, &end
#
#  chirality for residue 16 atoms:  C2' O4' N1 H1'
 &rst iat=507,491,494,493, &end
#
#  chirality for residue 16 atoms:  C3' C1' H2'1 O2'
 &rst iat=505,492,508,509, &end
#
#  chirality for residue 16 atoms:  O3' C2' C4' H3'
 &rst iat=511,507,489,506, &end
#
#  chirality for residue 16 atoms:  C3' C5' O4' H4'
 &rst iat=505,486,491,490, &end
#
#  chirality for residue 16 atoms:  C4' O5' H5'1 H5'2
 &rst iat=489,485,487,488, &end
#
#  chirality for residue 17 atoms:  C2' O4' N1 H1'
 &rst iat=537,521,524,523, &end
#
#  chirality for residue 17 atoms:  C3' C1' H2'1 O2'
 &rst iat=535,522,538,539, &end
#
#  chirality for residue 17 atoms:  O3' C2' C4' H3'
 &rst iat=541,537,519,536, &end
#
#  chirality for residue 17 atoms:  C3' C5' O4' H4'
 &rst iat=535,516,521,520, &end
#
#  chirality for residue 17 atoms:  C4' O5' H5'1 H5'2
 &rst iat=519,515,517,518, &end
#
#  chirality for residue 18 atoms:  C2' O4' N1 H1'
 &rst iat=567,551,554,553, &end
#
#  chirality for residue 18 atoms:  C3' C1' H2'1 O2'
 &rst iat=565,552,568,569, &end
#
#  chirality for residue 18 atoms:  O3' C2' C4' H3'
 &rst iat=571,567,549,566, &end
#
#  chirality for residue 18 atoms:  C3' C5' O4' H4'
 &rst iat=565,546,551,550, &end
#
#  chirality for residue 18 atoms:  C4' O5' H5'1 H5'2
 &rst iat=549,545,547,548, &end
#
#  chirality for residue 19 atoms:  C2' O4' N9 H1'
 &rst iat=601,581,584,583, &end
#
#  chirality for residue 19 atoms:  C3' C1' H2'1 O2'
 &rst iat=599,582,602,603, &end
#
#  chirality for residue 19 atoms:  O3' C2' C4' H3'
 &rst iat=605,601,579,600, &end
#
#  chirality for residue 19 atoms:  C3' C5' O4' H4'
 &rst iat=599,576,581,580, &end
#
#  chirality for residue 19 atoms:  C4' O5' H5'1 H5'2
 &rst iat=579,575,577,578, &end
#
#  chirality for residue 20 atoms:  C2' O4' N9 H1'
 &rst iat=634,615,618,617, &end
#
#  chirality for residue 20 atoms:  C3' C1' H2'1 O2'
 &rst iat=632,616,635,636, &end
#
#  chirality for residue 20 atoms:  O3' C2' C4' H3'
 &rst iat=638,634,613,633, &end
#
#  chirality for residue 20 atoms:  C3' C5' O4' H4'
 &rst iat=632,610,615,614, &end
#
#  chirality for residue 20 atoms:  C4' O5' H5'1 H5'2
 &rst iat=613,609,611,612, &end
#
#  chirality for residue 21 atoms:  C2' O4' N1 H1'
 &rst iat=664,648,651,650, &end
#
#  chirality for residue 21 atoms:  C3' C1' H2'1 O2'
 &rst iat=662,649,665,666, &end
#
#  chirality for residue 21 atoms:  O3' C2' C4' H3'
 &rst iat=668,664,646,663, &end
#
#  chirality for residue 21 atoms:  C3' C5' O4' H4'
 &rst iat=662,643,648,647, &end
#
#  chirality for residue 21 atoms:  C4' O5' H5'1 H5'2
 &rst iat=646,642,644,645, &end
#
#  chirality for residue 22 atoms:  C2' O4' N1 H1'
 &rst iat=695,678,681,680, &end
#
#  chirality for residue 22 atoms:  C3' C1' H2'1 O2'
 &rst iat=693,679,696,697, &end
#
#  chirality for residue 22 atoms:  O3' C2' C4' H3'
 &rst iat=699,695,676,694, &end
#
#  chirality for residue 22 atoms:  C3' C5' O4' H4'
 &rst iat=693,673,678,677, &end
#
#  chirality for residue 22 atoms:  C4' O5' H5'1 H5'2
 &rst iat=676,672,674,675, &end
#
#  chirality for residue 23 atoms:  C2' O4' N9 H1'
 &rst iat=728,709,712,711, &end
#
#  chirality for residue 23 atoms:  C3' C1' H2'1 O2'
 &rst iat=726,710,729,730, &end
#
#  chirality for residue 23 atoms:  O3' C2' C4' H3'
 &rst iat=732,728,707,727, &end
#
#  chirality for residue 23 atoms:  C3' C5' O4' H4'
 &rst iat=726,704,709,708, &end
#
#  chirality for residue 23 atoms:  C4' O5' H5'1 H5'2
 &rst iat=707,703,705,706, &end
#
#  chirality for residue 24 atoms:  C2' O4' N9 H1'
 &rst iat=762,742,745,744, &end
#
#  chirality for residue 24 atoms:  C3' C1' H2'1 O2'
 &rst iat=760,743,763,764, &end
#
#  chirality for residue 24 atoms:  O3' C2' C4' H3'
 &rst iat=766,762,740,761, &end
#
#  chirality for residue 24 atoms:  C3' C5' O4' H4'
 &rst iat=760,737,742,741, &end
#
#  chirality for residue 24 atoms:  C4' O5' H5'1 H5'2
 &rst iat=740,736,738,739, &end
#
#  chirality for residue 25 atoms:  C2' O4' N1 H1'
 &rst iat=792,776,779,778, &end
#
#  chirality for residue 25 atoms:  C3' C1' H2'1 O2'
 &rst iat=790,777,793,794, &end
#
#  chirality for residue 25 atoms:  O3' C2' C4' H3'
 &rst iat=796,792,774,791, &end
#
#  chirality for residue 25 atoms:  C3' C5' O4' H4'
 &rst iat=790,771,776,775, &end
#
#  chirality for residue 25 atoms:  C4' O5' H5'1 H5'2
 &rst iat=774,770,772,773, &end
#
#  chirality for residue 26 atoms:  C2' O4' N9 H1'
 &rst iat=825,806,809,808, &end
#
#  chirality for residue 26 atoms:  C3' C1' H2'1 O2'
 &rst iat=823,807,826,827, &end
#
#  chirality for residue 26 atoms:  O3' C2' C4' H3'
 &rst iat=829,825,804,824, &end
#
#  chirality for residue 26 atoms:  C3' C5' O4' H4'
 &rst iat=823,801,806,805, &end
#
#  chirality for residue 26 atoms:  C4' O5' H5'1 H5'2
 &rst iat=804,800,802,803, &end
#
#  chirality for residue 27 atoms:  C2' O4' N1 H1'
 &rst iat=855,839,842,841, &end
#
#  chirality for residue 27 atoms:  C3' C1' H2'1 O2'
 &rst iat=853,840,856,857, &end
#
#  chirality for residue 27 atoms:  O3' C2' C4' H3'
 &rst iat=859,855,837,854, &end
#
#  chirality for residue 27 atoms:  C3' C5' O4' H4'
 &rst iat=853,834,839,838, &end
#
#  chirality for residue 27 atoms:  C4' O5' H5'1 H5'2
 &rst iat=837,833,835,836, &end
#
#  chirality for residue 28 atoms:  C2' O4' N9 H1'
 &rst iat=888,869,872,871, &end
#
#  chirality for residue 28 atoms:  C3' C1' H2'1 O2'
 &rst iat=886,870,889,890, &end
#
#  chirality for residue 28 atoms:  O3' C2' C4' H3'
 &rst iat=892,888,867,887, &end
#
#  chirality for residue 28 atoms:  C3' C5' O4' H4'
 &rst iat=886,864,869,868, &end
#
#  chirality for residue 28 atoms:  C4' O5' H5'1 H5'2
 &rst iat=867,863,865,866, &end
#
#  chirality for residue 29 atoms:  C2' O4' N1 H1'
 &rst iat=918,902,905,904, &end
#
#  chirality for residue 29 atoms:  C3' C1' H2'1 O2'
 &rst iat=916,903,919,920, &end
#
#  chirality for residue 29 atoms:  O3' C2' C4' H3'
 &rst iat=922,918,900,917, &end
#
#  chirality for residue 29 atoms:  C3' C5' O4' H4'
 &rst iat=916,897,902,901, &end
#
#  chirality for residue 29 atoms:  C4' O5' H5'1 H5'2
 &rst iat=900,896,898,899, &end
#
#  chirality for residue 30 atoms:  C2' O4' N1 H1'
 &rst iat=949,932,935,934, &end
#
#  chirality for residue 30 atoms:  C3' C1' H2'1 O2'
 &rst iat=947,933,950,951, &end
#
#  chirality for residue 30 atoms:  O3' C2' C4' H3'
 &rst iat=953,949,930,948, &end
#
#  chirality for residue 30 atoms:  C3' C5' O4' H4'
 &rst iat=947,927,932,931, &end
#
#  chirality for residue 30 atoms:  C4' O5' H5'1 H5'2
 &rst iat=930,926,928,929, &end
#
#  chirality for residue 31 atoms:  C2' O4' N1 H1'
 &rst iat=980,963,966,965, &end
#
#  chirality for residue 31 atoms:  C3' C1' H2'1 O2'
 &rst iat=978,964,981,982, &end
#
#  chirality for residue 31 atoms:  O3' C2' C4' H3'
 &rst iat=984,980,961,979, &end
#
#  chirality for residue 31 atoms:  C3' C5' O4' H4'
 &rst iat=978,958,963,962, &end
#
#  chirality for residue 31 atoms:  C4' O5' H5'1 H5'2
 &rst iat=961,957,959,960, &end

 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H5*    G   1          1H5*        G   1  -4.887 -24.184   8.042
    2   2H5*    G   1          2H5*        G   1  -5.323 -22.473   8.229
    3    H4*    G   1           H4*        G   1  -3.571 -22.989   9.814
    4    H3*    G   1           H3*        G   1  -2.636 -21.333   7.458
    5    H2*    G   1           H2*        G   1  -0.524 -21.128   8.632
    6   2HO*    G   1          2HO*        G   1  -1.509 -20.999  10.752
    7    H1*    G   1           H1*        G   1  -0.303 -23.757   9.134
    8    H8     G   1           H8         G   1  -2.161 -23.902   5.925
    9    H1     G   1           H1         G   1   3.857 -21.819   5.163
   10   1H2     G   1          1H2         G   1   4.709 -21.261   7.144
   11   2H2     G   1          2H2         G   1   3.788 -21.466   8.623
   12    H5T    G   1           H5T        G   1  -4.073 -21.993   6.412
   13   1H5*    G   2          1H5*        G   2  -1.388 -19.307  10.877
   14   2H5*    G   2          2H5*        G   2  -1.739 -17.574  10.768
   15    H4*    G   2           H4*        G   2   0.626 -17.987  11.304
   16    H3*    G   2           H3*        G   2   0.105 -16.750   8.595
   17    H2*    G   2           H2*        G   2   2.534 -16.566   8.406
   18   2HO*    G   2          2HO*        G   2   2.746 -16.083  10.721
   19    H1*    G   2           H1*        G   2   3.028 -19.097   9.176
   20    H8     G   2           H8         G   2  -0.211 -19.534   7.390
   21    H1     G   2           H1         G   2   4.646 -18.197   3.411
   22   1H2     G   2          1H2         G   2   6.379 -17.449   4.566
   23   2H2     G   2          2H2         G   2   6.348 -17.367   6.321
   24   1H5*    A   3          1H5*        A   3   3.208 -14.548  10.488
   25   2H5*    A   3          2H5*        A   3   2.959 -12.801  10.335
   26    H4*    A   3           H4*        A   3   5.194 -13.474   9.544
   27    H3*    A   3           H3*        A   3   3.312 -12.385   7.433
   28    H2*    A   3           H2*        A   3   5.169 -12.570   5.886
   29   2HO*    A   3          2HO*        A   3   6.738 -11.930   7.547
   30    H1*    A   3           H1*        A   3   5.871 -15.065   6.602
   31    H8     A   3           H8         A   3   2.162 -15.156   7.069
   32   1H6     A   3          1H6         A   3   1.779 -15.942   0.935
   33   2H6     A   3          2H6         A   3   0.901 -15.990   2.457
   34    H2     A   3           H2         A   3   5.912 -14.617   1.898
   35   1H5*    U   4          1H5*        U   4   7.033 -10.504   6.954
   36   2H5*    U   4          2H5*        U   4   6.888  -8.772   6.617
   37    H4*    U   4           H4*        U   4   8.161  -9.974   4.855
   38    H3*    U   4           H3*        U   4   5.511  -8.784   3.986
   39    H2*    U   4           H2*        U   4   6.177  -9.459   1.737
   40   2HO*    U   4          2HO*        U   4   8.432  -8.935   2.109
   41    H1*    U   4           H1*        U   4   6.960 -11.949   2.468
   42    H3     U   4           H3         U   4   2.985 -12.097   0.196
   43    H5     U   4           H5         U   4   1.950 -11.659   4.244
   44    H6     U   4           H6         U   4   4.267 -11.252   4.746
   45   1H5*    A   5          1H5*        A   5   8.494  -7.590   1.211
   46   2H5*    A   5          2H5*        A   5   8.276  -5.907   0.702
   47    H4*    A   5           H4*        A   5   8.349  -7.441  -1.227
   48    H3*    A   5           H3*        A   5   5.676  -6.075  -0.770
   49    H2*    A   5           H2*        A   5   4.972  -7.121  -2.831
   50   2HO*    A   5          2HO*        A   5   7.018  -6.835  -3.904
   51    H1*    A   5           H1*        A   5   5.932  -9.574  -2.219
   52    H8     A   5           H8         A   5   4.840  -8.189   1.099
   53   1H6     A   5          1H6         A   5  -0.911  -9.788  -0.587
   54   2H6     A   5          2H6         A   5   0.111  -9.302   0.761
   55    H2     A   5           H2         A   5   1.685  -9.979  -4.179
   56   1H5*    U   6          1H5*        U   6   6.655  -5.542  -4.927
   57   2H5*    U   6          2H5*        U   6   6.152  -3.914  -5.421
   58    H4*    U   6           H4*        U   6   5.069  -5.691  -6.784
   59    H3*    U   6           H3*        U   6   3.185  -4.216  -4.940
   60    H2*    U   6           H2*        U   6   1.433  -5.244  -6.310
   61   2HO*    U   6          2HO*        U   6   2.666  -5.356  -8.333
   62    H1*    U   6           H1*        U   6   2.542  -7.662  -5.926
   63    H3     U   6           H3         U   6  -1.118  -7.056  -3.289
   64    H5     U   6           H5         U   6   2.106  -5.585  -1.030
   65    H6     U   6           H6         U   6   3.516  -5.825  -2.970
   66   1H5*    A   7          1H5*        A   7   1.319  -1.922  -9.090
   67   2H5*    A   7          2H5*        A   7   1.182  -2.584  -7.455
   68    H4*    A   7           H4*        A   7  -0.155  -3.740  -9.946
   69    H3*    A   7           H3*        A   7  -1.079  -1.903  -7.738
   70    H2*    A   7           H2*        A   7  -3.216  -3.036  -7.686
   71   2HO*    A   7          2HO*        A   7  -3.134  -3.314 -10.081
   72    H1*    A   7           H1*        A   7  -2.223  -5.521  -7.640
   73    H8     A   7           H8         A   7   0.454  -3.598  -5.865
   74   1H6     A   7          1H6         A   7  -3.303  -3.736  -0.924
   75   2H6     A   7          2H6         A   7  -1.676  -3.351  -1.462
   76    H2     A   7           H2         A   7  -5.586  -5.162  -4.420
   77   1H5*    U   8          1H5*        U   8  -4.549  -2.216  -9.699
   78   2H5*    U   8          2H5*        U   8  -5.129  -0.615 -10.189
   79    H4*    U   8           H4*        U   8  -6.813  -1.832  -8.850
   80    H3*    U   8           H3*        U   8  -5.653   0.726  -7.729
   81    H2*    U   8           H2*        U   8  -7.097   0.509  -5.847
   82   2HO*    U   8          2HO*        U   8  -8.932  -0.138  -7.092
   83    H1*    U   8           H1*        U   8  -6.764  -2.155  -5.469
   84    H3     U   8           H3         U   8  -4.503   0.111  -2.170
   85    H5     U   8           H5         U   8  -1.736  -0.645  -5.238
   86    H6     U   8           H6         U   8  -3.576  -1.293  -6.651
   87   1H5*    G   9          1H5*        G   9  -8.829   4.210  -7.270
   88   2H5*    G   9          2H5*        G   9  -7.464   3.426  -6.460
   89    H4*    G   9           H4*        G   9 -10.395   3.171  -5.642
   90    H3*    G   9           H3*        G   9  -8.099   4.925  -4.802
   91    H2*    G   9           H2*        G   9  -8.781   4.715  -2.483
   92   2HO*    G   9          2HO*        G   9 -11.088   4.718  -3.143
   93    H1*    G   9           H1*        G   9  -8.976   2.066  -2.495
   94    H8     G   9           H8         G   9  -6.380   2.404  -5.156
   95    H1     G   9           H1         G   9  -4.136   3.755   0.722
   96   1H2     G   9          1H2         G   9  -7.403   3.477   1.740
   97   2H2     G   9          2H2         G   9  -5.747   3.780   2.163
   98   1H5*    A  10          1H5*        A  10 -11.114   6.187  -2.390
   99   2H5*    A  10          2H5*        A  10 -11.235   7.953  -2.309
  100    H4*    A  10           H4*        A  10 -10.848   6.901  -0.084
  101    H3*    A  10           H3*        A  10  -8.534   8.537  -1.135
  102    H2*    A  10           H2*        A  10  -7.718   8.414   1.169
  103   2HO*    A  10          2HO*        A  10  -9.827   8.289   2.240
  104    H1*    A  10           H1*        A  10  -7.906   5.757   1.117
  105    H8     A  10           H8         A  10  -7.380   6.403  -2.486
  106   1H6     A  10          1H6         A  10  -1.428   7.642  -1.183
  107   2H6     A  10          2H6         A  10  -2.576   7.335  -2.470
  108    H2     A  10           H2         A  10  -3.680   7.522   2.632
  109   1H5*    U  11          1H5*        U  11  -9.945  11.893   2.533
  110   2H5*    U  11          2H5*        U  11  -8.828  11.135   1.391
  111    H4*    U  11           H4*        U  11  -8.878  10.522   4.379
  112    H3*    U  11           H3*        U  11  -7.368  12.551   2.740
  113    H2*    U  11           H2*        U  11  -5.402  12.136   4.098
  114   2HO*    U  11          2HO*        U  11  -6.653  11.882   6.069
  115    H1*    U  11           H1*        U  11  -5.579   9.445   4.012
  116    H3     U  11           H3         U  11  -2.291  10.935   1.130
  117    H5     U  11           H5         U  11  -5.771  10.453  -1.173
  118    H6     U  11           H6         U  11  -7.031  10.204   0.875
  119   1H5*    A  12          1H5*        A  12  -6.420  13.183   6.893
  120   2H5*    A  12          2H5*        A  12  -6.466  14.921   7.252
  121    H4*    A  12           H4*        A  12  -4.276  13.861   7.865
  122    H3*    A  12           H3*        A  12  -4.381  16.019   5.755
  123    H2*    A  12           H2*        A  12  -2.017  15.832   5.544
  124   2HO*    A  12          2HO*        A  12  -1.609  15.770   7.823
  125    H1*    A  12           H1*        A  12  -1.789  13.168   5.884
  126    H8     A  12           H8         A  12  -4.531  13.826   3.430
  127   1H6     A  12          1H6         A  12   0.037  14.112  -0.782
  128   2H6     A  12          2H6         A  12  -1.685  13.890  -0.564
  129    H2     A  12           H2         A  12   1.817  14.553   3.279
  130   1H5*    U  13          1H5*        U  13  -1.105  16.617   8.780
  131   2H5*    U  13          2H5*        U  13  -1.084  18.326   9.215
  132    H4*    U  13           H4*        U  13   1.163  17.429   8.496
  133    H3*    U  13           H3*        U  13  -0.197  19.826   7.799
  134    H2*    U  13           H2*        U  13  -0.279  19.599   5.572
  135   2HO*    U  13          2HO*        U  13   2.558  19.870   5.829
  136    H1*    U  13           H1*        U  13   2.050  17.806   5.374
  137    H3     U  13           H3         U  13   0.816  17.229   1.050
  138    H5     U  13           H5         U  13  -2.859  17.309   3.087
  139    H6     U  13           H6         U  13  -1.646  17.669   5.139
  140   1H5*    A  14          1H5*        A  14   4.108  21.899   7.746
  141   2H5*    A  14          2H5*        A  14   2.557  21.800   6.911
  142    H4*    A  14           H4*        A  14   5.271  22.135   5.610
  143    H3*    A  14           H3*        A  14   3.766  24.048   6.913
  144    H2*    A  14           H2*        A  14   1.831  23.926   5.678
  145   2HO*    A  14          2HO*        A  14   3.567  25.676   4.460
  146    H1*    A  14           H1*        A  14   3.117  23.362   3.065
  147    H8     A  14           H8         A  14   0.652  22.178   5.719
  148   1H6     A  14          1H6         A  14  -3.009  20.692   0.927
  149   2H6     A  14          2H6         A  14  -2.950  20.873   2.675
  150    H2     A  14           H2         A  14   0.911  21.995  -0.659
  151   1H5*    A  15          1H5*        A  15   8.055  24.386   3.084
  152   2H5*    A  15          2H5*        A  15   6.347  24.850   3.031
  153    H4*    A  15           H4*        A  15   7.192  21.999   2.443
  154    H3*    A  15           H3*        A  15   8.323  23.924   0.980
  155    H2*    A  15           H2*        A  15   6.322  25.248   0.910
  156   2HO*    A  15          2HO*        A  15   7.299  24.413  -1.354
  157    H1*    A  15           H1*        A  15   4.865  22.807  -0.120
  158    H8     A  15           H8         A  15   4.241  25.288   2.723
  159   1H6     A  15          1H6         A  15  -0.811  26.915  -0.498
  160   2H6     A  15          2H6         A  15   0.121  27.232   0.960
  161    H2     A  15           H2         A  15   1.346  23.810  -2.784
  162   1H5*    U  16          1H5*        U  16   5.402  21.165  -1.200
  163   2H5*    U  16          2H5*        U  16   6.491  20.163  -2.160
  164    H4*    U  16           H4*        U  16   4.341  20.042  -3.163
  165    H3*    U  16           H3*        U  16   6.596  21.160  -4.556
  166    H2*    U  16           H2*        U  16   5.705  23.024  -5.378
  167   2HO*    U  16          2HO*        U  16   4.350  20.980  -6.668
  168    H1*    U  16           H1*        U  16   2.833  22.394  -4.953
  169    H3     U  16           H3         U  16   2.346  26.947  -4.703
  170    H5     U  16           H5         U  16   6.140  26.214  -3.010
  171    H6     U  16           H6         U  16   5.800  23.913  -3.369
  172   1H5*    U  17          1H5*        U  17   2.780  18.864  -4.029
  173   2H5*    U  17          2H5*        U  17   3.809  17.997  -2.903
  174    H4*    U  17           H4*        U  17   2.390  16.289  -2.723
  175    H3*    U  17           H3*        U  17   2.867  15.950  -5.489
  176    H2*    U  17           H2*        U  17   0.952  16.431  -6.579
  177   2HO*    U  17          2HO*        U  17  -0.333  14.972  -4.500
  178    H1*    U  17           H1*        U  17  -0.811  17.299  -4.673
  179    H3     U  17           H3         U  17  -0.731  21.648  -6.032
  180    H5     U  17           H5         U  17   2.881  20.056  -7.472
  181    H6     U  17           H6         U  17   2.400  18.036  -6.320
  182   1H5*    U  18          1H5*        U  18   1.610  11.209  -3.744
  183   2H5*    U  18          2H5*        U  18   1.594  12.075  -5.242
  184    H4*    U  18           H4*        U  18  -0.425  10.030  -4.250
  185    H3*    U  18           H3*        U  18   1.778  10.261  -6.148
  186    H2*    U  18           H2*        U  18   0.766  10.293  -8.095
  187   2HO*    U  18          2HO*        U  18  -0.128   8.019  -7.165
  188    H1*    U  18           H1*        U  18  -1.974  10.610  -7.517
  189    H3     U  18           H3         U  18  -0.821  13.464 -10.901
  190    H5     U  18           H5         U  18   1.524  14.673  -7.614
  191    H6     U  18           H6         U  18   0.488  13.019  -6.345
  192   1H5*    G  19          1H5*        G  19   4.452   6.944  -5.058
  193   2H5*    G  19          2H5*        G  19   3.956   6.916  -3.354
  194    H4*    G  19           H4*        G  19   6.245   7.680  -3.446
  195    H3*    G  19           H3*        G  19   4.072   9.613  -2.789
  196    H2*    G  19           H2*        G  19   5.392  11.481  -2.648
  197   2HO*    G  19          2HO*        G  19   7.164  10.357  -1.406
  198    H1*    G  19           H1*        G  19   7.222  10.768  -4.553
  199    H8     G  19           H8         G  19   3.723  10.152  -5.799
  200    H1     G  19           H1         G  19   5.746  16.197  -6.465
  201   1H2     G  19          1H2         G  19   7.564  16.513  -5.302
  202   2H2     G  19          2H2         G  19   8.342  15.214  -4.402
  203   1H5*    A  20          1H5*        A  20   8.502  10.583   1.111
  204   2H5*    A  20          2H5*        A  20   8.173   8.882   1.503
  205    H4*    A  20           H4*        A  20   7.361  10.505   3.226
  206    H3*    A  20           H3*        A  20   5.207   8.998   1.753
  207    H2*    A  20           H2*        A  20   3.726   9.786   3.510
  208   2HO*    A  20          2HO*        A  20   5.352   9.881   5.231
  209    H1*    A  20           H1*        A  20   4.452  12.305   3.015
  210    H8     A  20           H8         A  20   5.079  10.954  -0.362
  211   1H6     A  20          1H6         A  20  -1.052  10.397  -1.125
  212   2H6     A  20          2H6         A  20   0.515  10.285  -1.913
  213    H2     A  20           H2         A  20  -0.272  11.190   3.171
  214   1H5*    U  21          1H5*        U  21   4.818   6.249   6.132
  215   2H5*    U  21          2H5*        U  21   4.284   6.837   4.554
  216    H4*    U  21           H4*        U  21   3.258   7.866   7.233
  217    H3*    U  21           H3*        U  21   2.222   5.803   5.266
  218    H2*    U  21           H2*        U  21  -0.017   6.558   5.727
  219   2HO*    U  21          2HO*        U  21   0.559   6.946   8.021
  220    H1*    U  21           H1*        U  21   0.523   9.166   5.402
  221    H3     U  21           H3         U  21  -1.356   7.288   1.605
  222    H5     U  21           H5         U  21   2.797   7.297   0.990
  223    H6     U  21           H6         U  21   3.090   7.957   3.289
  224   1H5*    C  22          1H5*        C  22  -0.482   5.450   8.487
  225   2H5*    C  22          2H5*        C  22  -0.503   3.747   8.993
  226    H4*    C  22           H4*        C  22  -2.779   4.520   8.553
  227    H3*    C  22           H3*        C  22  -1.675   2.515   6.565
  228    H2*    C  22           H2*        C  22  -3.920   2.482   5.634
  229   2HO*    C  22          2HO*        C  22  -4.949   2.584   7.719
  230    H1*    C  22           H1*        C  22  -4.239   5.167   5.618
  231   1H4     C  22          1H4         C  22  -1.792   3.824  -0.064
  232   2H4     C  22          2H4         C  22  -0.189   4.191   0.534
  233    H5     C  22           H5         C  22   0.285   4.549   2.914
  234    H6     C  22           H6         C  22  -0.703   4.780   5.098
  235   1H5*    A  23          1H5*        A  23  -5.332   0.700   8.416
  236   2H5*    A  23          2H5*        A  23  -5.060  -1.055   8.520
  237    H4*    A  23           H4*        A  23  -7.126  -0.451   7.252
  238    H3*    A  23           H3*        A  23  -4.948  -1.831   5.645
  239    H2*    A  23           H2*        A  23  -6.612  -1.851   3.859
  240   2HO*    A  23          2HO*        A  23  -8.422  -2.224   5.242
  241    H1*    A  23           H1*        A  23  -7.219   0.757   4.089
  242    H8     A  23           H8         A  23  -3.658   0.730   5.088
  243   1H6     A  23          1H6         A  23  -2.284   0.456  -0.952
  244   2H6     A  23          2H6         A  23  -1.675   0.879   0.644
  245    H2     A  23           H2         A  23  -6.514  -0.881  -0.389
  246   1H5*    G  24          1H5*        G  24  -9.454  -3.624   5.134
  247   2H5*    G  24          2H5*        G  24  -9.011  -5.258   4.647
  248    H4*    G  24           H4*        G  24 -10.478  -4.696   3.035
  249    H3*    G  24           H3*        G  24  -7.730  -4.677   2.219
  250    H2*    G  24           H2*        G  24  -7.720  -2.618   1.381
  251   2HO*    G  24          2HO*        G  24  -9.260  -3.901  -0.649
  252    H1*    G  24           H1*        G  24 -10.653  -2.672   0.749
  253    H8     G  24           H8         G  24  -8.153  -0.905   2.950
  254    H1     G  24           H1         G  24 -11.105   3.054  -1.129
  255   1H2     G  24          1H2         G  24 -12.402   1.889  -2.485
  256   2H2     G  24          2H2         G  24 -12.585   0.150  -2.326
  257   1H5*    U  25          1H5*        U  25 -12.860  -7.043  -0.154
  258   2H5*    U  25          2H5*        U  25 -12.135  -8.660  -0.071
  259    H4*    U  25           H4*        U  25 -13.045  -8.248  -2.307
  260    H3*    U  25           H3*        U  25 -10.058  -8.530  -2.015
  261    H2*    U  25           H2*        U  25  -9.850  -8.241  -4.407
  262   2HO*    U  25          2HO*        U  25 -11.770  -9.634  -4.710
  263    H1*    U  25           H1*        U  25 -11.770  -6.346  -4.697
  264    H3     U  25           H3         U  25  -8.727  -3.143  -5.183
  265    H5     U  25           H5         U  25  -7.257  -5.292  -1.896
  266    H6     U  25           H6         U  25  -9.209  -6.710  -2.010
  267   1H5*    A  26          1H5*        A  26 -10.778 -10.601  -5.576
  268   2H5*    A  26          2H5*        A  26  -9.969 -12.171  -5.484
  269    H4*    A  26           H4*        A  26  -9.214 -10.794  -7.425
  270    H3*    A  26           H3*        A  26  -7.226 -11.561  -5.292
  271    H2*    A  26           H2*        A  26  -5.515 -10.593  -6.750
  272   2HO*    A  26          2HO*        A  26  -6.559 -11.330  -8.714
  273    H1*    A  26           H1*        A  26  -6.843  -8.296  -7.178
  274    H8     A  26           H8         A  26  -8.062  -9.022  -3.783
  275   1H6     A  26          1H6         A  26  -2.493  -7.381  -1.600
  276   2H6     A  26          2H6         A  26  -4.158  -7.747  -1.178
  277    H2     A  26           H2         A  26  -2.166  -7.868  -6.004
  278   1H5*    U  27          1H5*        U  27  -5.578 -12.557  -9.012
  279   2H5*    U  27          2H5*        U  27  -4.881 -14.190  -9.039
  280    H4*    U  27           H4*        U  27  -3.233 -12.467  -9.725
  281    H3*    U  27           H3*        U  27  -2.653 -13.933  -7.132
  282    H2*    U  27           H2*        U  27  -0.545 -12.731  -7.136
  283   2HO*    U  27          2HO*        U  27  -0.259 -12.871  -9.439
  284    H1*    U  27           H1*        U  27  -1.620 -10.326  -7.681
  285    H3     U  27           H3         U  27  -0.397 -10.730  -3.256
  286    H5     U  27           H5         U  27  -4.465 -11.739  -3.434
  287    H6     U  27           H6         U  27  -4.301 -11.774  -5.831
  288   1H5*    A  28          1H5*        A  28   0.752 -14.229  -9.838
  289   2H5*    A  28          2H5*        A  28   1.461 -15.853  -9.771
  290    H4*    A  28           H4*        A  28   3.160 -14.112  -9.385
  291    H3*    A  28           H3*        A  28   2.562 -15.895  -7.002
  292    H2*    A  28           H2*        A  28   4.350 -14.708  -5.875
  293   2HO*    A  28          2HO*        A  28   5.643 -14.582  -7.844
  294    H1*    A  28           H1*        A  28   3.519 -12.243  -6.577
  295    H8     A  28           H8         A  28   0.298 -14.160  -6.242
  296   1H6     A  28          1H6         A  28   0.718 -13.047  -0.174
  297   2H6     A  28          2H6         A  28  -0.328 -13.582  -1.481
  298    H2     A  28           H2         A  28   4.666 -12.121  -2.015
  299   1H5*    U  29          1H5*        U  29   6.721 -15.661  -7.573
  300   2H5*    U  29          2H5*        U  29   7.554 -17.195  -7.270
  301    H4*    U  29           H4*        U  29   8.410 -15.354  -5.843
  302    H3*    U  29           H3*        U  29   7.000 -17.594  -4.344
  303    H2*    U  29           H2*        U  29   7.806 -16.435  -2.353
  304   2HO*    U  29          2HO*        U  29   9.833 -15.808  -3.281
  305    H1*    U  29           H1*        U  29   6.986 -14.001  -3.169
  306    H3     U  29           H3         U  29   4.139 -15.576   0.039
  307    H5     U  29           H5         U  29   2.586 -16.988  -3.595
  308    H6     U  29           H6         U  29   4.589 -16.227  -4.697
  309   1H5*    C  30          1H5*        C  30  10.800 -16.901  -2.683
  310   2H5*    C  30          2H5*        C  30  11.621 -18.392  -2.191
  311    H4*    C  30           H4*        C  30  11.400 -16.783  -0.316
  312    H3*    C  30           H3*        C  30   9.798 -19.356  -0.008
  313    H2*    C  30           H2*        C  30   9.346 -18.532   2.238
  314   2HO*    C  30          2HO*        C  30  11.549 -17.556   2.327
  315    H1*    C  30           H1*        C  30   8.656 -16.044   1.423
  316   1H4     C  30          1H4         C  30   3.217 -19.251   1.281
  317   2H4     C  30          2H4         C  30   3.425 -19.576  -0.436
  318    H5     C  30           H5         C  30   5.533 -19.092  -1.616
  319    H6     C  30           H6         C  30   7.713 -18.098  -1.388
  320   1H5*    C  31          1H5*        C  31  11.886 -18.695   3.519
  321   2H5*    C  31          2H5*        C  31  12.748 -20.159   4.034
  322    H4*    C  31           H4*        C  31  11.353 -19.376   5.872
  323    H3*    C  31           H3*        C  31  10.287 -21.866   4.487
  324    H2*    C  31           H2*        C  31   8.705 -21.984   6.304
  325   2HO*    C  31          2HO*        C  31  10.300 -21.250   7.900
  326    H1*    C  31           H1*        C  31   8.080 -19.324   6.184
  327   1H4     C  31          1H4         C  31   3.857 -22.281   2.548
  328   2H4     C  31          2H4         C  31   4.888 -22.108   1.137
  329    H5     C  31           H5         C  31   7.188 -21.237   1.280
  330    H6     C  31           H6         C  31   8.855 -20.345   2.778
  331    H3T    C  31           H3T        C  31  12.317 -22.095   5.499
  Start of MODEL    2
    1   1H5*    G   1          1H5*        G   1  -6.730 -21.150   9.458
    2   2H5*    G   1          2H5*        G   1  -6.353 -22.152   8.061
    3    H4*    G   1           H4*        G   1  -5.032 -22.441  10.799
    4    H3*    G   1           H3*        G   1  -4.241 -20.881   8.334
    5    H2*    G   1           H2*        G   1  -1.933 -21.454   8.820
    6   2HO*    G   1          2HO*        G   1  -2.206 -21.295  11.126
    7    H1*    G   1           H1*        G   1  -2.394 -24.057   9.134
    8    H8     G   1           H8         G   1  -5.058 -23.051   6.719
    9    H1     G   1           H1         G   1   0.792 -23.352   4.077
   10   1H2     G   1          1H2         G   1   2.309 -23.474   5.692
   11   2H2     G   1          2H2         G   1   1.822 -23.525   7.381
   12    H5T    G   1           H5T        G   1  -6.905 -23.989   9.383
   13   1H5*    G   2          1H5*        G   2  -1.529 -19.731  11.310
   14   2H5*    G   2          2H5*        G   2  -1.311 -17.976  11.322
   15    H4*    G   2           H4*        G   2   0.835 -19.143  11.118
   16    H3*    G   2           H3*        G   2   0.027 -17.523   8.676
   17    H2*    G   2           H2*        G   2   2.201 -18.095   7.798
   18   2HO*    G   2          2HO*        G   2   3.213 -17.906   9.892
   19    H1*    G   2           H1*        G   2   2.055 -20.708   8.369
   20    H8     G   2           H8         G   2  -1.501 -19.886   7.610
   21    H1     G   2           H1         G   2   2.241 -19.887   2.388
   22   1H2     G   2          1H2         G   2   4.361 -19.895   3.011
   23   2H2     G   2          2H2         G   2   4.809 -19.989   4.718
   24   1H5*    A   3          1H5*        A   3   4.073 -16.487   9.644
   25   2H5*    A   3          2H5*        A   3   4.254 -14.727   9.612
   26    H4*    A   3           H4*        A   3   5.938 -15.820   8.205
   27    H3*    A   3           H3*        A   3   3.888 -14.155   6.728
   28    H2*    A   3           H2*        A   3   5.227 -14.625   4.740
   29   2HO*    A   3          2HO*        A   3   7.241 -14.507   5.914
   30    H1*    A   3           H1*        A   3   5.406 -17.249   5.158
   31    H8     A   3           H8         A   3   2.040 -16.540   6.601
   32   1H6     A   3          1H6         A   3  -0.062 -16.499   0.777
   33   2H6     A   3          2H6         A   3  -0.470 -16.599   2.471
   34    H2     A   3           H2         A   3   4.366 -16.132   0.619
   35   1H5*    U   4          1H5*        U   4   7.747 -13.071   5.371
   36   2H5*    U   4          2H5*        U   4   7.931 -11.326   5.155
   37    H4*    U   4           H4*        U   4   8.439 -12.604   3.084
   38    H3*    U   4           H3*        U   4   6.043 -10.731   2.947
   39    H2*    U   4           H2*        U   4   5.976 -11.324   0.589
   40   2HO*    U   4          2HO*        U   4   8.313 -11.453   0.455
   41    H1*    U   4           H1*        U   4   6.120 -13.960   0.992
   42    H3     U   4           H3         U   4   1.833 -12.574   0.046
   43    H5     U   4           H5         U   4   2.113 -12.651   4.232
   44    H6     U   4           H6         U   4   4.466 -12.987   4.018
   45   1H5*    A   5          1H5*        A   5   8.391 -10.137  -0.460
   46   2H5*    A   5          2H5*        A   5   8.643  -8.424  -0.780
   47    H4*    A   5           H4*        A   5   7.777  -9.586  -2.754
   48    H3*    A   5           H3*        A   5   5.897  -7.499  -1.565
   49    H2*    A   5           H2*        A   5   4.431  -7.940  -3.336
   50   2HO*    A   5          2HO*        A   5   6.053  -8.083  -4.951
   51    H1*    A   5           H1*        A   5   4.579 -10.623  -3.259
   52    H8     A   5           H8         A   5   4.920  -9.647   0.338
   53   1H6     A   5          1H6         A   5  -1.275  -9.246   0.369
   54   2H6     A   5          2H6         A   5   0.169  -9.291   1.372
   55    H2     A   5           H2         A   5   0.051  -9.482  -3.841
   56   1H5*    U   6          1H5*        U   6   5.329  -4.038  -5.251
   57   2H5*    U   6          2H5*        U   6   4.412  -4.663  -3.880
   58    H4*    U   6           H4*        U   6   4.245  -5.633  -6.769
   59    H3*    U   6           H3*        U   6   2.593  -3.950  -4.917
   60    H2*    U   6           H2*        U   6   0.553  -4.899  -5.795
   61   2HO*    U   6          2HO*        U   6   1.467  -4.994  -7.974
   62    H1*    U   6           H1*        U   6   1.333  -7.442  -5.600
   63    H3     U   6           H3         U   6  -1.316  -6.177  -2.024
   64    H5     U   6           H5         U   6   2.678  -5.950  -0.718
   65    H6     U   6           H6         U   6   3.417  -6.242  -2.989
   66   1H5*    A   7          1H5*        A   7   0.264  -3.641  -8.329
   67   2H5*    A   7          2H5*        A   7  -0.063  -1.937  -8.685
   68    H4*    A   7           H4*        A   7  -2.145  -3.198  -8.376
   69    H3*    A   7           H3*        A   7  -1.576  -1.066  -6.277
   70    H2*    A   7           H2*        A   7  -3.652  -1.600  -5.304
   71   2HO*    A   7          2HO*        A   7  -4.804  -1.803  -7.249
   72    H1*    A   7           H1*        A   7  -3.434  -4.270  -5.408
   73    H8     A   7           H8         A   7   0.077  -3.159  -4.803
   74   1H6     A   7          1H6         A   7  -1.510  -2.745   1.161
   75   2H6     A   7          2H6         A   7  -0.162  -2.729   0.020
   76    H2     A   7           H2         A   7  -5.201  -3.260  -1.168
   77   1H5*    U   8          1H5*        U   8  -5.669   2.040  -6.639
   78   2H5*    U   8          2H5*        U   8  -4.474   1.602  -5.428
   79    H4*    U   8           H4*        U   8  -7.191   0.284  -5.849
   80    H3*    U   8           H3*        U   8  -5.928   2.220  -3.945
   81    H2*    U   8           H2*        U   8  -7.057   1.238  -2.058
   82   2HO*    U   8          2HO*        U   8  -8.991   0.834  -3.367
   83    H1*    U   8           H1*        U   8  -6.424  -1.283  -2.634
   84    H3     U   8           H3         U   8  -3.495   0.408   0.510
   85    H5     U   8           H5         U   8  -1.557   0.649  -3.203
   86    H6     U   8           H6         U   8  -3.641   0.135  -4.297
   87   1H5*    G   9          1H5*        G   9  -9.756   2.107  -2.278
   88   2H5*    G   9          2H5*        G   9 -10.383   3.761  -2.217
   89    H4*    G   9           H4*        G   9 -10.426   2.753  -0.004
   90    H3*    G   9           H3*        G   9  -8.431   5.048  -0.299
   91    H2*    G   9           H2*        G   9  -8.006   4.822   2.001
   92   2HO*    G   9          2HO*        G   9 -10.175   4.529   2.632
   93    H1*    G   9           H1*        G   9  -7.876   2.148   2.086
   94    H8     G   9           H8         G   9  -6.395   3.041  -1.268
   95    H1     G   9           H1         G   9  -2.372   3.981   3.661
   96   1H2     G   9          1H2         G   9  -3.480   3.885   5.562
   97   2H2     G   9          2H2         G   9  -5.195   3.469   5.582
   98   1H5*    A  10          1H5*        A  10 -10.010   8.505   3.060
   99   2H5*    A  10          2H5*        A  10  -8.501   7.951   2.370
  100    H4*    A  10           H4*        A  10  -9.673   7.093   5.050
  101    H3*    A  10           H3*        A  10  -7.690   9.048   3.996
  102    H2*    A  10           H2*        A  10  -6.021   8.587   5.577
  103   2HO*    A  10          2HO*        A  10  -7.498   8.462   7.373
  104    H1*    A  10           H1*        A  10  -6.195   5.927   5.537
  105    H8     A  10           H8         A  10  -7.084   6.657   2.010
  106   1H6     A  10          1H6         A  10  -0.958   7.259   1.077
  107   2H6     A  10          2H6         A  10  -2.545   7.139   0.306
  108    H2     A  10           H2         A  10  -1.665   7.320   5.426
  109   1H5*    U  11          1H5*        U  11  -6.621  12.616   7.232
  110   2H5*    U  11          2H5*        U  11  -5.982  11.879   5.769
  111    H4*    U  11           H4*        U  11  -5.157  11.219   8.634
  112    H3*    U  11           H3*        U  11  -4.118  12.848   6.348
  113    H2*    U  11           H2*        U  11  -1.850  12.193   6.771
  114   2HO*    U  11          2HO*        U  11  -2.232  12.219   9.113
  115    H1*    U  11           H1*        U  11  -2.342   9.598   6.977
  116    H3     U  11           H3         U  11  -0.763  10.648   2.790
  117    H5     U  11           H5         U  11  -4.937  10.375   2.469
  118    H6     U  11           H6         U  11  -5.071  10.270   4.877
  119   1H5*    A  12          1H5*        A  12  -1.080  13.782   9.027
  120   2H5*    A  12          2H5*        A  12  -0.988  15.552   9.158
  121    H4*    A  12           H4*        A  12   1.154  14.644   8.371
  122    H3*    A  12           H3*        A  12  -0.453  16.276   6.403
  123    H2*    A  12           H2*        A  12   1.291  15.967   4.845
  124   2HO*    A  12          2HO*        A  12   2.970  16.367   6.404
  125    H1*    A  12           H1*        A  12   1.864  13.420   5.333
  126    H8     A  12           H8         A  12  -1.822  13.893   5.401
  127   1H6     A  12          1H6         A  12  -1.465  13.342  -0.787
  128   2H6     A  12          2H6         A  12  -2.558  13.405   0.591
  129    H2     A  12           H2         A  12   2.625  13.759   0.795
  130   1H5*    U  13          1H5*        U  13   3.821  17.827   6.347
  131   2H5*    U  13          2H5*        U  13   3.655  19.587   6.200
  132    H4*    U  13           H4*        U  13   5.078  18.623   4.405
  133    H3*    U  13           H3*        U  13   2.480  19.929   3.582
  134    H2*    U  13           H2*        U  13   3.174  19.527   1.308
  135   2HO*    U  13          2HO*        U  13   5.339  20.076   1.570
  136    H1*    U  13           H1*        U  13   4.110  17.063   1.654
  137    H3     U  13           H3         U  13   0.396  16.623  -0.829
  138    H5     U  13           H5         U  13  -1.017  17.004   3.115
  139    H6     U  13           H6         U  13   1.201  17.587   3.783
  140   1H5*    A  14          1H5*        A  14   6.135  21.282   1.268
  141   2H5*    A  14          2H5*        A  14   6.007  23.018   1.037
  142    H4*    A  14           H4*        A  14   6.494  21.665  -1.063
  143    H3*    A  14           H3*        A  14   4.806  23.871  -0.673
  144    H2*    A  14           H2*        A  14   2.879  22.939  -1.090
  145   2HO*    A  14          2HO*        A  14   3.327  24.190  -3.038
  146    H1*    A  14           H1*        A  14   3.911  20.892  -2.906
  147    H8     A  14           H8         A  14   2.321  21.083   0.459
  148   1H6     A  14          1H6         A  14  -2.640  18.515  -2.380
  149   2H6     A  14          2H6         A  14  -1.986  18.968  -0.807
  150    H2     A  14           H2         A  14   0.461  19.353  -5.422
  151   1H5*    A  15          1H5*        A  15   6.604  23.902  -5.938
  152   2H5*    A  15          2H5*        A  15   5.983  25.568  -6.018
  153    H4*    A  15           H4*        A  15   5.350  24.681  -8.004
  154    H3*    A  15           H3*        A  15   3.195  25.443  -6.565
  155    H2*    A  15           H2*        A  15   3.139  23.294  -5.390
  156   2HO*    A  15          2HO*        A  15   1.183  23.048  -7.448
  157    H1*    A  15           H1*        A  15   3.108  21.950  -8.048
  158    H8     A  15           H8         A  15   4.429  21.813  -4.511
  159   1H6     A  15          1H6         A  15   4.429  15.602  -5.543
  160   2H6     A  15          2H6         A  15   4.735  16.827  -4.310
  161    H2     A  15           H2         A  15   3.229  17.658  -9.248
  162   1H5*    U  16          1H5*        U  16   3.720  23.561 -10.890
  163   2H5*    U  16          2H5*        U  16   3.715  24.657 -12.283
  164    H4*    U  16           H4*        U  16   1.300  23.876 -12.694
  165    H3*    U  16           H3*        U  16   1.923  22.400 -10.259
  166    H2*    U  16           H2*        U  16   1.820  20.160 -11.119
  167   2HO*    U  16          2HO*        U  16  -0.212  20.847 -12.196
  168    H1*    U  16           H1*        U  16   2.839  20.376 -13.494
  169    H3     U  16           H3         U  16   7.371  21.128 -12.800
  170    H5     U  16           H5         U  16   5.618  20.737  -9.028
  171    H6     U  16           H6         U  16   3.449  20.890 -10.059
  172   1H5*    U  17          1H5*        U  17  -0.463  19.616  -8.280
  173   2H5*    U  17          2H5*        U  17   0.982  19.735  -9.294
  174    H4*    U  17           H4*        U  17   0.507  17.418  -8.905
  175    H3*    U  17           H3*        U  17   0.381  18.444 -11.618
  176    H2*    U  17           H2*        U  17  -1.148  16.932 -12.552
  177   2HO*    U  17          2HO*        U  17   0.085  15.163 -11.972
  178    H1*    U  17           H1*        U  17  -2.665  16.164 -10.432
  179    H3     U  17           H3         U  17  -5.984  19.251 -10.998
  180    H5     U  17           H5         U  17  -2.587  21.061 -12.672
  181    H6     U  17           H6         U  17  -1.341  19.180 -12.141
  182   1H5*    U  18          1H5*        U  18   3.169  13.179 -11.494
  183   2H5*    U  18          2H5*        U  18   1.653  14.000 -11.226
  184    H4*    U  18           H4*        U  18   4.148  14.660  -9.614
  185    H3*    U  18           H3*        U  18   2.307  12.300  -9.176
  186    H2*    U  18           H2*        U  18   1.976  12.767  -6.994
  187   2HO*    U  18          2HO*        U  18   4.294  13.197  -6.617
  188    H1*    U  18           H1*        U  18   1.885  15.492  -7.054
  189    H3     U  18           H3         U  18  -2.591  15.095  -6.737
  190    H5     U  18           H5         U  18  -1.589  12.454  -9.854
  191    H6     U  18           H6         U  18   0.620  13.131  -9.656
  192   1H5*    G  19          1H5*        G  19   6.498  12.669  -7.226
  193   2H5*    G  19          2H5*        G  19   6.992  11.054  -6.669
  194    H4*    G  19           H4*        G  19   7.508  12.790  -5.030
  195    H3*    G  19           H3*        G  19   5.381  10.773  -4.207
  196    H2*    G  19           H2*        G  19   5.010  11.773  -2.212
  197   2HO*    G  19          2HO*        G  19   7.380  12.308  -1.860
  198    H1*    G  19           H1*        G  19   4.924  14.241  -3.075
  199    H8     G  19           H8         G  19   3.567  11.120  -4.897
  200    H1     G  19           H1         G  19  -0.673  15.656  -3.492
  201   1H2     G  19          1H2         G  19   0.411  17.471  -2.850
  202   2H2     G  19          2H2         G  19   2.124  17.408  -2.470
  203   1H5*    A  20          1H5*        A  20   8.989   9.136  -0.909
  204   2H5*    A  20          2H5*        A  20   7.282   9.418  -1.229
  205    H4*    A  20           H4*        A  20   8.943  10.654   1.009
  206    H3*    A  20           H3*        A  20   6.842   8.477   0.872
  207    H2*    A  20           H2*        A  20   5.890   9.273   2.925
  208   2HO*    A  20          2HO*        A  20   8.056   9.743   3.791
  209    H1*    A  20           H1*        A  20   5.822  11.851   2.270
  210    H8     A  20           H8         A  20   5.428  10.218  -1.101
  211   1H6     A  20          1H6         A  20  -0.577   9.661   0.435
  212   2H6     A  20          2H6         A  20   0.615   9.494  -0.856
  213    H2     A  20           H2         A  20   1.638  10.827   4.068
  214   1H5*    U  21          1H5*        U  21   8.111   8.413   4.889
  215   2H5*    U  21          2H5*        U  21   8.241   6.745   5.462
  216    H4*    U  21           H4*        U  21   6.642   8.122   6.770
  217    H3*    U  21           H3*        U  21   5.418   5.729   5.318
  218    H2*    U  21           H2*        U  21   3.427   6.307   6.527
  219   2HO*    U  21          2HO*        U  21   4.619   6.894   8.445
  220    H1*    U  21           H1*        U  21   3.521   8.933   6.019
  221    H3     U  21           H3         U  21   0.266   7.111   3.384
  222    H5     U  21           H5         U  21   3.801   6.769   1.147
  223    H6     U  21           H6         U  21   5.056   7.464   3.083
  224   1H5*    C  22          1H5*        C  22   4.221   5.578   9.385
  225   2H5*    C  22          2H5*        C  22   4.313   3.908   9.954
  226    H4*    C  22           H4*        C  22   2.062   4.864  10.249
  227    H3*    C  22           H3*        C  22   2.269   2.541   8.295
  228    H2*    C  22           H2*        C  22  -0.101   2.654   8.169
  229   2HO*    C  22          2HO*        C  22  -0.432   2.966  10.392
  230    H1*    C  22           H1*        C  22  -0.321   5.347   8.029
  231   1H4     C  22          1H4         C  22  -0.325   3.468   2.007
  232   2H4     C  22          2H4         C  22   1.429   3.486   1.960
  233    H5     C  22           H5         C  22   2.789   3.926   3.916
  234    H6     C  22           H6         C  22   2.760   4.463   6.249
  235   1H5*    A  23          1H5*        A  23  -0.741  -1.094  10.427
  236   2H5*    A  23          2H5*        A  23  -0.304  -0.495   8.828
  237    H4*    A  23           H4*        A  23  -2.746   0.332  10.459
  238    H3*    A  23           H3*        A  23  -2.214  -1.294   8.029
  239    H2*    A  23           H2*        A  23  -4.296  -0.535   7.019
  240   2HO*    A  23          2HO*        A  23  -5.507  -0.345   8.971
  241    H1*    A  23           H1*        A  23  -3.643   2.007   7.317
  242    H8     A  23           H8         A  23  -0.137   0.873   7.350
  243   1H6     A  23          1H6         A  23  -0.651   0.343   1.183
  244   2H6     A  23          2H6         A  23   0.495   0.453   2.546
  245    H2     A  23           H2         A  23  -4.698   0.357   2.858
  246   1H5*    G  24          1H5*        G  24  -5.897  -2.218   6.426
  247   2H5*    G  24          2H5*        G  24  -6.447  -3.774   7.033
  248    H4*    G  24           H4*        G  24  -6.101  -3.929   4.667
  249    H3*    G  24           H3*        G  24  -4.354  -5.526   6.442
  250    H2*    G  24           H2*        G  24  -2.710  -5.974   4.876
  251   2HO*    G  24          2HO*        G  24  -4.645  -6.622   3.452
  252    H1*    G  24           H1*        G  24  -2.966  -3.802   3.123
  253    H8     G  24           H8         G  24  -2.660  -2.359   6.502
  254    H1     G  24           H1         G  24   2.855  -4.961   4.498
  255   1H2     G  24          1H2         G  24   0.902  -6.064   1.840
  256   2H2     G  24          2H2         G  24   2.497  -6.041   2.562
  257   1H5*    U  25          1H5*        U  25  -9.253  -4.735   6.382
  258   2H5*    U  25          2H5*        U  25  -9.745  -6.379   5.953
  259    H4*    U  25           H4*        U  25 -11.338  -4.845   5.068
  260    H3*    U  25           H3*        U  25  -9.936  -6.701   3.428
  261    H2*    U  25           H2*        U  25  -9.293  -5.391   1.659
  262   2HO*    U  25          2HO*        U  25 -11.500  -5.631   0.960
  263    H1*    U  25           H1*        U  25 -10.438  -2.905   2.230
  264    H3     U  25           H3         U  25  -6.729  -0.454   1.674
  265    H5     U  25           H5         U  25  -5.287  -4.339   2.117
  266    H6     U  25           H6         U  25  -7.516  -5.092   2.678
  267   1H5*    A  26          1H5*        A  26 -10.962  -9.095   0.499
  268   2H5*    A  26          2H5*        A  26  -9.873  -7.871   1.143
  269    H4*    A  26           H4*        A  26 -11.267  -7.565  -1.544
  270    H3*    A  26           H3*        A  26  -8.732  -9.037  -0.844
  271    H2*    A  26           H2*        A  26  -7.750  -8.192  -2.908
  272   2HO*    A  26          2HO*        A  26  -9.799  -8.369  -4.047
  273    H1*    A  26           H1*        A  26  -8.436  -5.657  -2.508
  274    H8     A  26           H8         A  26  -8.139  -6.737   1.017
  275   1H6     A  26          1H6         A  26  -1.971  -6.423   0.317
  276   2H6     A  26          2H6         A  26  -3.300  -6.503   1.475
  277    H2     A  26           H2         A  26  -3.801  -6.298  -3.704
  278   1H5*    U  27          1H5*        U  27  -9.273  -9.794  -4.916
  279   2H5*    U  27          2H5*        U  27  -9.104 -11.520  -5.295
  280    H4*    U  27           H4*        U  27  -7.552 -10.126  -6.627
  281    H3*    U  27           H3*        U  27  -6.251 -12.028  -4.638
  282    H2*    U  27           H2*        U  27  -4.152 -11.271  -5.554
  283   2HO*    U  27          2HO*        U  27  -4.996 -11.189  -7.713
  284    H1*    U  27           H1*        U  27  -4.718  -8.651  -5.487
  285    H3     U  27           H3         U  27  -1.859  -9.881  -2.081
  286    H5     U  27           H5         U  27  -5.713 -10.115  -0.463
  287    H6     U  27           H6         U  27  -6.606  -9.794  -2.665
  288   1H5*    A  28          1H5*        A  28  -4.278 -12.692  -8.481
  289   2H5*    A  28          2H5*        A  28  -4.085 -14.440  -8.700
  290    H4*    A  28           H4*        A  28  -1.947 -13.274  -8.935
  291    H3*    A  28           H3*        A  28  -2.118 -15.090  -6.506
  292    H2*    A  28           H2*        A  28   0.219 -14.535  -6.182
  293   2HO*    A  28          2HO*        A  28   0.644 -14.536  -8.492
  294    H1*    A  28           H1*        A  28  -0.081 -11.897  -6.476
  295    H8     A  28           H8         A  28  -3.341 -12.908  -4.930
  296   1H6     A  28          1H6         A  28  -0.339 -12.721   0.490
  297   2H6     A  28          2H6         A  28  -1.891 -12.770  -0.304
  298    H2     A  28           H2         A  28   2.705 -12.814  -2.742
  299   1H5*    U  29          1H5*        U  29   1.476 -15.970  -8.551
  300   2H5*    U  29          2H5*        U  29   1.823 -17.705  -8.582
  301    H4*    U  29           H4*        U  29   3.662 -16.411  -7.569
  302    H3*    U  29           H3*        U  29   2.222 -18.268  -5.626
  303    H2*    U  29           H2*        U  29   3.995 -17.621  -4.085
  304   2HO*    U  29          2HO*        U  29   5.580 -17.505  -5.842
  305    H1*    U  29           H1*        U  29   3.706 -14.989  -4.500
  306    H3     U  29           H3         U  29   1.690 -16.281  -0.591
  307    H5     U  29           H5         U  29  -1.281 -16.653  -3.520
  308    H6     U  29           H6         U  29   0.378 -16.210  -5.189
  309   1H5*    C  30          1H5*        C  30   6.324 -18.904  -5.206
  310   2H5*    C  30          2H5*        C  30   6.723 -20.625  -5.136
  311    H4*    C  30           H4*        C  30   7.627 -19.385  -3.201
  312    H3*    C  30           H3*        C  30   5.475 -21.447  -2.515
  313    H2*    C  30           H2*        C  30   5.993 -20.915  -0.224
  314   2HO*    C  30          2HO*        C  30   8.295 -20.586  -0.826
  315    H1*    C  30           H1*        C  30   5.878 -18.248  -0.534
  316   1H4     C  30          1H4         C  30  -0.025 -19.987   0.771
  317   2H4     C  30          2H4         C  30  -0.452 -19.911  -0.945
  318    H5     C  30           H5         C  30   1.229 -19.630  -2.683
  319    H6     C  30           H6         C  30   3.560 -19.263  -3.083
  320   1H5*    C  31          1H5*        C  31   8.544 -21.969   0.191
  321   2H5*    C  31          2H5*        C  31   9.058 -23.657   0.212
  322    H4*    C  31           H4*        C  31   8.541 -22.964   2.482
  323    H3*    C  31           H3*        C  31   6.439 -24.803   1.266
  324    H2*    C  31           H2*        C  31   5.512 -24.910   3.486
  325   2HO*    C  31          2HO*        C  31   7.668 -24.893   4.493
  326    H1*    C  31           H1*        C  31   5.663 -22.218   3.893
  327   1H4     C  31          1H4         C  31  -0.075 -23.313   1.600
  328   2H4     C  31          2H4         C  31   0.493 -23.093  -0.059
  329    H5     C  31           H5         C  31   2.851 -22.791  -0.607
  330    H6     C  31           H6         C  31   5.061 -22.606   0.304
  331    H3T    C  31           H3T        C  31   8.518 -25.708   1.483
  Start of MODEL    3
    1   1H5*    G   1          1H5*        G   1  -5.380 -24.720   8.417
    2   2H5*    G   1          2H5*        G   1  -5.461 -23.028   8.956
    3    H4*    G   1           H4*        G   1  -3.405 -23.992   9.783
    4    H3*    G   1           H3*        G   1  -3.001 -22.069   7.475
    5    H2*    G   1           H2*        G   1  -0.627 -22.304   7.893
    6   2HO*    G   1          2HO*        G   1  -0.851 -22.422  10.201
    7    H1*    G   1           H1*        G   1  -0.678 -24.975   7.962
    8    H8     G   1           H8         G   1  -3.438 -24.364   5.560
    9    H1     G   1           H1         G   1   2.309 -22.901   3.114
   10   1H2     G   1          1H2         G   1   3.802 -22.806   4.756
   11   2H2     G   1          2H2         G   1   3.352 -23.164   6.412
   12    H5T    G   1           H5T        G   1  -4.777 -22.382   6.896
   13   1H5*    G   2          1H5*        G   2  -0.457 -20.842  10.555
   14   2H5*    G   2          2H5*        G   2  -0.496 -19.088  10.773
   15    H4*    G   2           H4*        G   2   1.797 -19.918  10.452
   16    H3*    G   2           H3*        G   2   0.734 -18.143   8.233
   17    H2*    G   2           H2*        G   2   2.993 -18.277   7.309
   18   2HO*    G   2          2HO*        G   2   3.961 -18.279   9.458
   19    H1*    G   2           H1*        G   2   3.173 -20.935   7.503
   20    H8     G   2           H8         G   2  -0.469 -20.566   6.876
   21    H1     G   2           H1         G   2   3.084 -19.181   1.704
   22   1H2     G   2          1H2         G   2   5.186 -18.892   2.315
   23   2H2     G   2          2H2         G   2   5.689 -19.131   3.975
   24   1H5*    A   3          1H5*        A   3   4.612 -16.804   9.323
   25   2H5*    A   3          2H5*        A   3   4.683 -15.048   9.482
   26    H4*    A   3           H4*        A   3   6.414 -15.890   7.948
   27    H3*    A   3           H3*        A   3   4.258 -14.158   6.680
   28    H2*    A   3           H2*        A   3   5.566 -14.337   4.642
   29   2HO*    A   3          2HO*        A   3   7.600 -14.282   5.860
   30    H1*    A   3           H1*        A   3   5.884 -16.983   4.759
   31    H8     A   3           H8         A   3   2.529 -16.605   6.348
   32   1H6     A   3          1H6         A   3   0.265 -16.125   0.606
   33   2H6     A   3          2H6         A   3  -0.110 -16.334   2.320
   34    H2     A   3           H2         A   3   4.684 -15.670   0.379
   35   1H5*    U   4          1H5*        U   4   7.955 -12.751   5.329
   36   2H5*    U   4          2H5*        U   4   8.043 -10.987   5.321
   37    H4*    U   4           H4*        U   4   8.505 -11.937   3.097
   38    H3*    U   4           H3*        U   4   5.927 -10.314   3.248
   39    H2*    U   4           H2*        U   4   5.868 -10.618   0.850
   40   2HO*    U   4          2HO*        U   4   8.183 -10.430   0.634
   41    H1*    U   4           H1*        U   4   6.371 -13.261   0.921
   42    H3     U   4           H3         U   4   1.941 -12.591   0.041
   43    H5     U   4           H5         U   4   2.216 -12.786   4.221
   44    H6     U   4           H6         U   4   4.612 -12.708   4.030
   45   1H5*    A   5          1H5*        A   5   8.300  -8.926   0.002
   46   2H5*    A   5          2H5*        A   5   8.281  -7.160  -0.073
   47    H4*    A   5           H4*        A   5   7.643  -8.144  -2.221
   48    H3*    A   5           H3*        A   5   5.417  -6.615  -0.811
   49    H2*    A   5           H2*        A   5   4.093  -7.021  -2.725
   50   2HO*    A   5          2HO*        A   5   5.804  -6.647  -4.239
   51    H1*    A   5           H1*        A   5   4.739  -9.625  -3.016
   52    H8     A   5           H8         A   5   4.703  -9.080   0.710
   53   1H6     A   5          1H6         A   5  -1.369 -10.254   0.323
   54   2H6     A   5          2H6         A   5   0.019 -10.092   1.396
   55    H2     A   5           H2         A   5   0.118  -9.431  -3.775
   56   1H5*    U   6          1H5*        U   6   4.236  -2.802  -4.130
   57   2H5*    U   6          2H5*        U   6   3.451  -3.776  -2.889
   58    H4*    U   6           H4*        U   6   3.568  -4.404  -5.869
   59    H3*    U   6           H3*        U   6   1.496  -3.424  -3.917
   60    H2*    U   6           H2*        U   6  -0.191  -4.743  -5.038
   61   2HO*    U   6          2HO*        U   6   0.824  -4.349  -7.157
   62    H1*    U   6           H1*        U   6   1.211  -7.022  -5.025
   63    H3     U   6           H3         U   6  -1.786  -6.720  -1.477
   64    H5     U   6           H5         U   6   1.985  -5.638   0.023
   65    H6     U   6           H6         U   6   2.844  -5.600  -2.213
   66   1H5*    A   7          1H5*        A   7  -0.684  -3.298  -7.331
   67   2H5*    A   7          2H5*        A   7  -1.571  -1.779  -7.537
   68    H4*    A   7           H4*        A   7  -3.024  -3.826  -7.414
   69    H3*    A   7           H3*        A   7  -3.389  -1.559  -5.495
   70    H2*    A   7           H2*        A   7  -4.971  -2.775  -4.235
   71   2HO*    A   7          2HO*        A   7  -6.170  -3.553  -5.993
   72    H1*    A   7           H1*        A   7  -3.867  -5.250  -4.364
   73    H8     A   7           H8         A   7  -0.840  -3.217  -3.742
   74   1H6     A   7          1H6         A   7  -2.789  -2.543   2.076
   75   2H6     A   7          2H6         A   7  -1.419  -2.349   0.986
   76    H2     A   7           H2         A   7  -6.127  -4.217  -0.261
   77   1H5*    U   8          1H5*        U   8  -5.541   1.693  -5.401
   78   2H5*    U   8          2H5*        U   8  -4.857   0.159  -4.910
   79    H4*    U   8           H4*        U   8  -7.858   0.355  -5.175
   80    H3*    U   8           H3*        U   8  -6.220   1.689  -3.030
   81    H2*    U   8           H2*        U   8  -8.066   1.205  -1.498
   82   2HO*    U   8          2HO*        U   8  -9.731   1.135  -3.319
   83    H1*    U   8           H1*        U   8  -7.800  -1.387  -1.976
   84    H3     U   8           H3         U   8  -4.785   0.425   1.285
   85    H5     U   8           H5         U   8  -2.652  -0.535  -2.223
   86    H6     U   8           H6         U   8  -4.715  -0.943  -3.312
   87   1H5*    G   9          1H5*        G   9 -10.539   2.157  -1.503
   88   2H5*    G   9          2H5*        G   9 -10.977   3.875  -1.429
   89    H4*    G   9           H4*        G   9 -10.789   2.839   0.795
   90    H3*    G   9           H3*        G   9  -8.721   4.990   0.205
   91    H2*    G   9           H2*        G   9  -8.095   4.720   2.544
   92   2HO*    G   9          2HO*        G   9 -10.353   4.325   3.160
   93    H1*    G   9           H1*        G   9  -7.931   2.047   2.440
   94    H8     G   9           H8         G   9  -6.934   2.945  -1.047
   95    H1     G   9           H1         G   9  -2.467   4.382   3.348
   96   1H2     G   9          1H2         G   9  -3.389   4.436   5.340
   97   2H2     G   9          2H2         G   9  -5.050   3.939   5.574
   98   1H5*    A  10          1H5*        A  10 -10.345   5.779   4.075
   99   2H5*    A  10          2H5*        A  10 -10.735   7.500   4.173
  100    H4*    A  10           H4*        A  10  -9.296   6.770   6.026
  101    H3*    A  10           H3*        A  10  -8.060   8.826   4.117
  102    H2*    A  10           H2*        A  10  -6.223   8.879   5.555
  103   2HO*    A  10          2HO*        A  10  -7.435   8.816   7.507
  104    H1*    A  10           H1*        A  10  -5.963   6.220   5.896
  105    H8     A  10           H8         A  10  -7.201   6.511   2.370
  106   1H6     A  10          1H6         A  10  -1.300   7.612   0.829
  107   2H6     A  10          2H6         A  10  -2.925   7.273   0.237
  108    H2     A  10           H2         A  10  -1.627   7.891   5.245
  109   1H5*    U  11          1H5*        U  11  -7.089  12.736   7.251
  110   2H5*    U  11          2H5*        U  11  -6.458  12.025   5.768
  111    H4*    U  11           H4*        U  11  -5.533  11.343   8.596
  112    H3*    U  11           H3*        U  11  -4.684  13.135   6.365
  113    H2*    U  11           H2*        U  11  -2.370  12.607   6.630
  114   2HO*    U  11          2HO*        U  11  -2.445  12.613   8.935
  115    H1*    U  11           H1*        U  11  -2.672   9.966   6.860
  116    H3     U  11           H3         U  11  -1.160  11.000   2.673
  117    H5     U  11           H5         U  11  -5.337  10.608   2.362
  118    H6     U  11           H6         U  11  -5.495  10.557   4.761
  119   1H5*    A  12          1H5*        A  12  -1.729  16.739   7.874
  120   2H5*    A  12          2H5*        A  12  -1.997  15.850   6.384
  121    H4*    A  12           H4*        A  12   0.256  15.350   8.378
  122    H3*    A  12           H3*        A  12  -0.181  17.263   6.251
  123    H2*    A  12           H2*        A  12   1.025  16.371   4.542
  124   2HO*    A  12          2HO*        A  12   2.929  16.671   6.045
  125    H1*    A  12           H1*        A  12   1.570  13.883   5.160
  126    H8     A  12           H8         A  12  -2.091  14.234   5.267
  127   1H6     A  12          1H6         A  12  -1.802  13.664  -0.927
  128   2H6     A  12          2H6         A  12  -2.893  13.666   0.462
  129    H2     A  12           H2         A  12   2.261  14.438   0.605
  130   1H5*    U  13          1H5*        U  13   3.994  17.988   5.566
  131   2H5*    U  13          2H5*        U  13   4.022  19.750   5.777
  132    H4*    U  13           H4*        U  13   4.596  19.257   3.470
  133    H3*    U  13           H3*        U  13   1.802  20.387   3.863
  134    H2*    U  13           H2*        U  13   1.575  20.417   1.560
  135   2HO*    U  13          2HO*        U  13   3.607  21.294   1.031
  136    H1*    U  13           H1*        U  13   2.913  18.090   1.011
  137    H3     U  13           H3         U  13  -1.223  17.002  -0.328
  138    H5     U  13           H5         U  13  -1.665  17.489   3.813
  139    H6     U  13           H6         U  13   0.648  18.215   3.917
  140   1H5*    A  14          1H5*        A  14   4.843  22.521   1.148
  141   2H5*    A  14          2H5*        A  14   4.589  24.253   1.394
  142    H4*    A  14           H4*        A  14   4.918  23.666  -0.947
  143    H3*    A  14           H3*        A  14   2.976  25.369   0.049
  144    H2*    A  14           H2*        A  14   1.290  23.910  -0.107
  145   2HO*    A  14          2HO*        A  14   1.386  25.385  -2.392
  146    H1*    A  14           H1*        A  14   2.261  22.838  -2.731
  147    H8     A  14           H8         A  14   0.924  22.124   0.665
  148   1H6     A  14          1H6         A  14  -2.729  17.983  -2.331
  149   2H6     A  14          2H6         A  14  -2.422  18.739  -0.770
  150    H2     A  14           H2         A  14   0.137  19.725  -5.220
  151   1H5*    A  15          1H5*        A  15   5.171  23.378  -2.927
  152   2H5*    A  15          2H5*        A  15   6.647  24.051  -3.605
  153    H4*    A  15           H4*        A  15   6.004  22.362  -5.086
  154    H3*    A  15           H3*        A  15   6.054  24.896  -6.171
  155    H2*    A  15           H2*        A  15   3.698  25.262  -5.720
  156   2HO*    A  15          2HO*        A  15   4.210  24.370  -8.347
  157    H1*    A  15           H1*        A  15   3.282  22.512  -6.893
  158    H8     A  15           H8         A  15   2.148  24.505  -3.893
  159   1H6     A  15          1H6         A  15  -3.588  23.171  -6.057
  160   2H6     A  15          2H6         A  15  -2.697  24.082  -4.834
  161    H2     A  15           H2         A  15  -0.587  21.137  -8.603
  162   1H5*    U  16          1H5*        U  16   5.484  20.708  -8.114
  163   2H5*    U  16          2H5*        U  16   6.967  19.851  -8.523
  164    H4*    U  16           H4*        U  16   6.375  20.191 -10.920
  165    H3*    U  16           H3*        U  16   4.449  21.924  -9.976
  166    H2*    U  16           H2*        U  16   2.726  20.759  -9.204
  167   2HO*    U  16          2HO*        U  16   2.640  19.616 -11.724
  168    H1*    U  16           H1*        U  16   3.152  18.100 -10.042
  169    H3     U  16           H3         U  16   4.421  16.174  -6.039
  170    H5     U  16           H5         U  16   3.589  20.209  -5.201
  171    H6     U  16           H6         U  16   3.433  20.615  -7.478
  172   1H5*    U  17          1H5*        U  17   3.215  17.902 -14.280
  173   2H5*    U  17          2H5*        U  17   2.099  18.860 -13.315
  174    H4*    U  17           H4*        U  17   3.348  16.259 -12.346
  175    H3*    U  17           H3*        U  17   1.354  16.528 -14.394
  176    H2*    U  17           H2*        U  17  -0.641  16.223 -13.281
  177   2HO*    U  17          2HO*        U  17  -0.034  14.050 -12.873
  178    H1*    U  17           H1*        U  17  -0.008  16.424 -10.586
  179    H3     U  17           H3         U  17  -2.219  20.339 -10.178
  180    H5     U  17           H5         U  17  -0.953  20.398 -14.166
  181    H6     U  17           H6         U  17   0.294  18.347 -13.717
  182   1H5*    U  18          1H5*        U  18   2.079  10.706 -12.925
  183   2H5*    U  18          2H5*        U  18   0.923  11.972 -12.586
  184    H4*    U  18           H4*        U  18   3.897  12.540 -12.330
  185    H3*    U  18           H3*        U  18   2.225  10.818 -10.501
  186    H2*    U  18           H2*        U  18   3.095  11.837  -8.635
  187   2HO*    U  18          2HO*        U  18   5.316  11.800  -9.337
  188    H1*    U  18           H1*        U  18   3.185  14.432  -9.531
  189    H3     U  18           H3         U  18  -0.309  14.564  -6.616
  190    H5     U  18           H5         U  18  -1.402  11.580  -9.353
  191    H6     U  18           H6         U  18   0.637  11.946 -10.481
  192   1H5*    G  19          1H5*        G  19   5.657   8.791  -7.221
  193   2H5*    G  19          2H5*        G  19   4.081   9.609  -7.180
  194    H4*    G  19           H4*        G  19   6.739  11.064  -6.893
  195    H3*    G  19           H3*        G  19   4.898   9.864  -4.798
  196    H2*    G  19           H2*        G  19   5.314  11.752  -3.404
  197   2HO*    G  19          2HO*        G  19   7.592  11.805  -4.018
  198    H1*    G  19           H1*        G  19   5.035  13.609  -5.326
  199    H8     G  19           H8         G  19   2.663  10.752  -6.000
  200    H1     G  19           H1         G  19   0.558  15.138  -1.827
  201   1H2     G  19          1H2         G  19   2.199  16.627  -1.431
  202   2H2     G  19          2H2         G  19   3.757  16.424  -2.196
  203   1H5*    A  20          1H5*        A  20   8.380  10.906  -2.218
  204   2H5*    A  20          2H5*        A  20   8.769   9.305  -1.549
  205    H4*    A  20           H4*        A  20   8.492  10.857   0.290
  206    H3*    A  20           H3*        A  20   6.109   9.019  -0.056
  207    H2*    A  20           H2*        A  20   5.457   9.767   2.161
  208   2HO*    A  20          2HO*        A  20   7.654  10.141   2.990
  209    H1*    A  20           H1*        A  20   5.651  12.298   1.403
  210    H8     A  20           H8         A  20   4.739  10.684  -1.849
  211   1H6     A  20          1H6         A  20  -1.067  10.406   0.353
  212   2H6     A  20          2H6         A  20  -0.040  10.233  -1.061
  213    H2     A  20           H2         A  20   1.617  11.404   3.737
  214   1H5*    U  21          1H5*        U  21   7.729   6.538   4.092
  215   2H5*    U  21          2H5*        U  21   6.529   7.055   2.920
  216    H4*    U  21           H4*        U  21   6.753   8.134   5.762
  217    H3*    U  21           H3*        U  21   5.080   5.916   4.547
  218    H2*    U  21           H2*        U  21   3.241   6.625   5.937
  219   2HO*    U  21          2HO*        U  21   4.604   7.092   7.759
  220    H1*    U  21           H1*        U  21   3.457   9.225   5.446
  221    H3     U  21           H3         U  21  -0.031   7.477   3.030
  222    H5     U  21           H5         U  21   3.299   7.355   0.476
  223    H6     U  21           H6         U  21   4.716   7.944   2.360
  224   1H5*    C  22          1H5*        C  22   4.347   5.837   8.738
  225   2H5*    C  22          2H5*        C  22   4.282   4.171   9.335
  226    H4*    C  22           H4*        C  22   2.188   5.467   9.773
  227    H3*    C  22           H3*        C  22   2.003   3.005   8.009
  228    H2*    C  22           H2*        C  22  -0.366   3.410   7.971
  229   2HO*    C  22          2HO*        C  22  -0.431   3.965  10.224
  230    H1*    C  22           H1*        C  22  -0.281   6.053   7.574
  231   1H4     C  22          1H4         C  22  -0.707   3.585   1.779
  232   2H4     C  22          2H4         C  22   1.036   3.437   1.678
  233    H5     C  22           H5         C  22   2.519   3.983   3.537
  234    H6     C  22           H6         C  22   2.585   4.755   5.809
  235   1H5*    A  23          1H5*        A  23  -0.899   2.638  11.457
  236   2H5*    A  23          2H5*        A  23  -0.976   0.917  11.894
  237    H4*    A  23           H4*        A  23  -3.204   1.894  11.342
  238    H3*    A  23           H3*        A  23  -2.186  -0.315   9.540
  239    H2*    A  23           H2*        A  23  -4.382  -0.138   8.432
  240   2HO*    A  23          2HO*        A  23  -5.417   0.296  10.532
  241    H1*    A  23           H1*        A  23  -4.312   2.530   8.183
  242    H8     A  23           H8         A  23  -0.690   1.557   7.897
  243   1H6     A  23          1H6         A  23  -1.927   0.195   2.006
  244   2H6     A  23          2H6         A  23  -0.670   0.413   3.241
  245    H2     A  23           H2         A  23  -5.791   0.717   4.117
  246   1H5*    G  24          1H5*        G  24  -6.061  -1.449   9.797
  247   2H5*    G  24          2H5*        G  24  -6.171  -3.177  10.175
  248    H4*    G  24           H4*        G  24  -7.260  -2.598   8.038
  249    H3*    G  24           H3*        G  24  -4.878  -4.451   7.882
  250    H2*    G  24           H2*        G  24  -5.358  -4.620   5.502
  251   2HO*    G  24          2HO*        G  24  -7.690  -4.505   5.804
  252    H1*    G  24           H1*        G  24  -5.431  -1.985   5.080
  253    H8     G  24           H8         G  24  -3.151  -1.507   7.788
  254    H1     G  24           H1         G  24  -0.264  -5.060   3.323
  255   1H2     G  24          1H2         G  24  -1.778  -5.821   1.881
  256   2H2     G  24          2H2         G  24  -3.473  -5.451   2.067
  257   1H5*    U  25          1H5*        U  25  -8.493  -8.031   5.383
  258   2H5*    U  25          2H5*        U  25  -7.887  -6.714   4.390
  259    H4*    U  25           H4*        U  25 -10.735  -7.079   5.409
  260    H3*    U  25           H3*        U  25  -9.728  -8.374   3.280
  261    H2*    U  25           H2*        U  25  -8.766  -6.633   2.100
  262   2HO*    U  25          2HO*        U  25 -10.972  -7.242   0.986
  263    H1*    U  25           H1*        U  25 -10.858  -4.655   2.581
  264    H3     U  25           H3         U  25  -8.266  -0.963   2.613
  265    H5     U  25           H5         U  25  -5.506  -4.102   2.663
  266    H6     U  25           H6         U  25  -7.293  -5.646   2.830
  267   1H5*    A  26          1H5*        A  26 -11.499 -10.474  -0.037
  268   2H5*    A  26          2H5*        A  26 -10.098  -9.692   0.664
  269    H4*    A  26           H4*        A  26 -11.565  -8.823  -1.870
  270    H3*    A  26           H3*        A  26  -9.064 -10.381  -1.275
  271    H2*    A  26           H2*        A  26  -7.860  -9.267  -3.029
  272   2HO*    A  26          2HO*        A  26  -9.756  -9.244  -4.450
  273    H1*    A  26           H1*        A  26  -8.584  -6.781  -2.405
  274    H8     A  26           H8         A  26  -8.723  -8.367   0.941
  275   1H6     A  26          1H6         A  26  -2.542  -8.036   1.081
  276   2H6     A  26          2H6         A  26  -3.992  -8.403   2.014
  277    H2     A  26           H2         A  26  -3.880  -6.960  -2.996
  278   1H5*    U  27          1H5*        U  27  -9.225 -10.471  -5.394
  279   2H5*    U  27          2H5*        U  27  -8.928 -12.092  -6.029
  280    H4*    U  27           H4*        U  27  -7.312 -10.453  -6.919
  281    H3*    U  27           H3*        U  27  -6.119 -12.562  -5.077
  282    H2*    U  27           H2*        U  27  -3.984 -11.616  -5.763
  283   2HO*    U  27          2HO*        U  27  -4.685 -11.258  -7.947
  284    H1*    U  27           H1*        U  27  -4.723  -9.049  -5.394
  285    H3     U  27           H3         U  27  -1.949 -10.371  -2.008
  286    H5     U  27           H5         U  27  -5.824 -11.387  -0.731
  287    H6     U  27           H6         U  27  -6.642 -10.845  -2.924
  288   1H5*    A  28          1H5*        A  28  -3.941 -12.498  -8.736
  289   2H5*    A  28          2H5*        A  28  -3.434 -14.121  -9.217
  290    H4*    A  28           H4*        A  28  -1.522 -12.589  -9.051
  291    H3*    A  28           H3*        A  28  -1.518 -14.810  -6.960
  292    H2*    A  28           H2*        A  28   0.665 -13.956  -6.378
  293   2HO*    A  28          2HO*        A  28   1.224 -13.471  -8.593
  294    H1*    A  28           H1*        A  28  -0.095 -11.394  -6.242
  295    H8     A  28           H8         A  28  -3.166 -13.273  -5.186
  296   1H6     A  28          1H6         A  28  -0.488 -13.611   0.405
  297   2H6     A  28          2H6         A  28  -1.974 -13.886  -0.504
  298    H2     A  28           H2         A  28   2.571 -12.275  -2.496
  299   1H5*    U  29          1H5*        U  29   2.239 -14.735  -8.831
  300   2H5*    U  29          2H5*        U  29   2.874 -16.362  -9.100
  301    H4*    U  29           H4*        U  29   4.421 -14.987  -7.764
  302    H3*    U  29           H3*        U  29   3.199 -17.330  -6.232
  303    H2*    U  29           H2*        U  29   4.772 -16.684  -4.501
  304   2HO*    U  29          2HO*        U  29   6.444 -16.121  -6.012
  305    H1*    U  29           H1*        U  29   4.157 -14.068  -4.585
  306    H3     U  29           H3         U  29   2.208 -15.933  -0.902
  307    H5     U  29           H5         U  29  -0.581 -16.474  -3.983
  308    H6     U  29           H6         U  29   1.061 -15.709  -5.565
  309   1H5*    C  30          1H5*        C  30   7.360 -17.441  -5.790
  310   2H5*    C  30          2H5*        C  30   7.997 -19.086  -5.859
  311    H4*    C  30           H4*        C  30   8.639 -17.942  -3.773
  312    H3*    C  30           H3*        C  30   6.726 -20.296  -3.365
  313    H2*    C  30           H2*        C  30   7.166 -19.926  -1.018
  314   2HO*    C  30          2HO*        C  30   9.423 -19.299  -1.519
  315    H1*    C  30           H1*        C  30   6.754 -17.266  -1.115
  316   1H4     C  30          1H4         C  30   1.052 -19.635   0.081
  317   2H4     C  30          2H4         C  30   0.637 -19.569  -1.627
  318    H5     C  30           H5         C  30   2.306 -19.108  -3.364
  319    H6     C  30           H6         C  30   4.590 -18.485  -3.757
  320   1H5*    C  31          1H5*        C  31   9.900 -20.711  -0.724
  321   2H5*    C  31          2H5*        C  31  10.546 -22.356  -0.769
  322    H4*    C  31           H4*        C  31   9.973 -21.780   1.533
  323    H3*    C  31           H3*        C  31   8.047 -23.752   0.235
  324    H2*    C  31           H2*        C  31   7.117 -24.016   2.448
  325   2HO*    C  31          2HO*        C  31   9.264 -23.854   3.464
  326    H1*    C  31           H1*        C  31   7.054 -21.325   2.952
  327   1H4     C  31          1H4         C  31   1.402 -22.851   0.626
  328   2H4     C  31          2H4         C  31   1.953 -22.565  -1.023
  329    H5     C  31           H5         C  31   4.288 -22.080  -1.567
  330    H6     C  31           H6         C  31   6.481 -21.740  -0.651
  331    H3T    C  31           H3T        C  31  10.194 -24.477   0.437
  Start of MODEL    4
    1   1H5*    G   1          1H5*        G   1  -5.626 -25.218   7.386
    2   2H5*    G   1          2H5*        G   1  -5.711 -23.543   7.967
    3    H4*    G   1           H4*        G   1  -3.770 -24.580   8.944
    4    H3*    G   1           H3*        G   1  -3.087 -22.622   6.741
    5    H2*    G   1           H2*        G   1  -0.781 -22.938   7.369
    6   2HO*    G   1          2HO*        G   1  -1.246 -23.115   9.641
    7    H1*    G   1           H1*        G   1  -0.903 -25.594   7.345
    8    H8     G   1           H8         G   1  -3.433 -24.859   4.736
    9    H1     G   1           H1         G   1   2.546 -23.474   2.838
   10   1H2     G   1          1H2         G   1   3.862 -23.423   4.614
   11   2H2     G   1          2H2         G   1   3.239 -23.817   6.216
   12    H5T    G   1           H5T        G   1  -4.832 -22.858   5.986
   13   1H5*    G   2          1H5*        G   2  -0.788 -21.514  10.046
   14   2H5*    G   2          2H5*        G   2  -0.847 -19.767  10.304
   15    H4*    G   2           H4*        G   2   1.463 -20.578  10.162
   16    H3*    G   2           H3*        G   2   0.585 -18.760   7.906
   17    H2*    G   2           H2*        G   2   2.899 -18.879   7.152
   18   2HO*    G   2          2HO*        G   2   3.692 -18.907   9.362
   19    H1*    G   2           H1*        G   2   3.093 -21.525   7.309
   20    H8     G   2           H8         G   2  -0.489 -21.163   6.392
   21    H1     G   2           H1         G   2   3.494 -19.695   1.561
   22   1H2     G   2          1H2         G   2   5.531 -19.414   2.360
   23   2H2     G   2          2H2         G   2   5.875 -19.673   4.073
   24   1H5*    A   3          1H5*        A   3   4.377 -17.400   9.325
   25   2H5*    A   3          2H5*        A   3   4.402 -15.646   9.522
   26    H4*    A   3           H4*        A   3   6.249 -16.421   8.106
   27    H3*    A   3           H3*        A   3   4.177 -14.702   6.704
   28    H2*    A   3           H2*        A   3   5.607 -14.845   4.770
   29   2HO*    A   3          2HO*        A   3   7.557 -14.780   6.115
   30    H1*    A   3           H1*        A   3   5.969 -17.476   4.855
   31    H8     A   3           H8         A   3   2.507 -17.169   6.216
   32   1H6     A   3          1H6         A   3   0.686 -16.629   0.327
   33   2H6     A   3          2H6         A   3   0.183 -16.861   2.008
   34    H2     A   3           H2         A   3   5.072 -16.108   0.424
   35   1H5*    U   4          1H5*        U   4   7.981 -13.275   5.653
   36   2H5*    U   4          2H5*        U   4   8.056 -11.515   5.650
   37    H4*    U   4           H4*        U   4   8.702 -12.476   3.466
   38    H3*    U   4           H3*        U   4   6.164 -10.810   3.469
   39    H2*    U   4           H2*        U   4   6.213 -11.117   1.053
   40   2HO*    U   4          2HO*        U   4   8.530 -10.984   0.969
   41    H1*    U   4           H1*        U   4   6.668 -13.761   1.132
   42    H3     U   4           H3         U   4   2.316 -12.919  -0.048
   43    H5     U   4           H5         U   4   2.305 -13.204   4.137
   44    H6     U   4           H6         U   4   4.697 -13.204   4.115
   45   1H5*    A   5          1H5*        A   5   8.600  -9.520   0.291
   46   2H5*    A   5          2H5*        A   5   8.588  -7.766   0.115
   47    H4*    A   5           H4*        A   5   7.954  -8.890  -1.969
   48    H3*    A   5           H3*        A   5   5.725  -7.261  -0.692
   49    H2*    A   5           H2*        A   5   4.463  -7.806  -2.679
   50   2HO*    A   5          2HO*        A   5   6.299  -7.625  -4.072
   51    H1*    A   5           H1*        A   5   5.003 -10.417  -2.648
   52    H8     A   5           H8         A   5   4.960  -9.582   0.993
   53   1H6     A   5          1H6         A   5  -1.216  -9.933   0.524
   54   2H6     A   5          2H6         A   5   0.169  -9.896   1.639
   55    H2     A   5           H2         A   5   0.420  -9.608  -3.545
   56   1H5*    U   6          1H5*        U   6   6.040  -6.153  -4.824
   57   2H5*    U   6          2H5*        U   6   5.792  -4.406  -4.983
   58    H4*    U   6           H4*        U   6   4.177  -5.764  -6.312
   59    H3*    U   6           H3*        U   6   3.046  -4.010  -4.118
   60    H2*    U   6           H2*        U   6   0.876  -4.666  -5.018
   61   2HO*    U   6          2HO*        U   6   1.651  -4.608  -7.199
   62    H1*    U   6           H1*        U   6   1.426  -7.291  -5.174
   63    H3     U   6           H3         U   6  -1.398  -6.482  -1.686
   64    H5     U   6           H5         U   6   2.450  -6.098  -0.069
   65    H6     U   6           H6         U   6   3.355  -6.217  -2.294
   66   1H5*    A   7          1H5*        A   7   0.831  -3.256  -7.720
   67   2H5*    A   7          2H5*        A   7   0.443  -1.532  -7.844
   68    H4*    A   7           H4*        A   7  -1.544  -3.030  -7.961
   69    H3*    A   7           H3*        A   7  -1.443  -1.067  -5.649
   70    H2*    A   7           H2*        A   7  -3.614  -1.871  -5.060
   71   2HO*    A   7          2HO*        A   7  -4.215  -2.062  -7.341
   72    H1*    A   7           H1*        A   7  -3.057  -4.483  -5.283
   73    H8     A   7           H8         A   7   0.177  -3.106  -4.031
   74   1H6     A   7          1H6         A   7  -2.654  -2.803   1.494
   75   2H6     A   7          2H6         A   7  -1.091  -2.724   0.663
   76    H2     A   7           H2         A   7  -5.724  -3.461  -1.585
   77   1H5*    U   8          1H5*        U   8  -5.424  -0.845  -7.041
   78   2H5*    U   8          2H5*        U   8  -5.830   0.862  -7.238
   79    H4*    U   8           H4*        U   8  -7.400  -0.335  -5.756
   80    H3*    U   8           H3*        U   8  -5.797   1.918  -4.506
   81    H2*    U   8           H2*        U   8  -7.151   1.557  -2.550
   82   2HO*    U   8          2HO*        U   8  -9.061   1.189  -3.846
   83    H1*    U   8           H1*        U   8  -7.003  -1.117  -2.536
   84    H3     U   8           H3         U   8  -4.404   0.574   0.831
   85    H5     U   8           H5         U   8  -1.866   0.224  -2.489
   86    H6     U   8           H6         U   8  -3.774  -0.232  -3.870
   87   1H5*    G   9          1H5*        G   9 -10.002   2.695  -3.505
   88   2H5*    G   9          2H5*        G   9 -10.257   4.416  -3.850
   89    H4*    G   9           H4*        G   9 -10.925   3.881  -1.572
   90    H3*    G   9           H3*        G   9  -8.491   5.720  -1.752
   91    H2*    G   9           H2*        G   9  -8.571   5.850   0.578
   92   2HO*    G   9          2HO*        G   9 -10.828   6.049   0.736
   93    H1*    G   9           H1*        G   9  -8.960   3.259   1.087
   94    H8     G   9           H8         G   9  -6.684   3.376  -1.981
   95    H1     G   9           H1         G   9  -3.722   4.424   3.637
   96   1H2     G   9          1H2         G   9  -5.221   4.761   5.214
   97   2H2     G   9          2H2         G   9  -6.955   4.610   4.856
   98   1H5*    A  10          1H5*        A  10 -10.190   9.902   0.800
   99   2H5*    A  10          2H5*        A  10  -8.663   9.102   0.503
  100    H4*    A  10           H4*        A  10 -10.457   8.701   2.933
  101    H3*    A  10           H3*        A  10  -7.970  10.163   2.165
  102    H2*    A  10           H2*        A  10  -6.839   9.679   4.197
  103   2HO*    A  10          2HO*        A  10  -8.831   9.890   5.477
  104    H1*    A  10           H1*        A  10  -7.361   7.080   4.218
  105    H8     A  10           H8         A  10  -7.432   7.533   0.549
  106   1H6     A  10          1H6         A  10  -1.222   7.804   0.801
  107   2H6     A  10          2H6         A  10  -2.637   7.681  -0.250
  108    H2     A  10           H2         A  10  -2.731   8.272   4.900
  109   1H5*    U  11          1H5*        U  11  -8.186  11.496   6.080
  110   2H5*    U  11          2H5*        U  11  -8.205  13.269   6.066
  111    H4*    U  11           H4*        U  11  -6.313  12.443   7.369
  112    H3*    U  11           H3*        U  11  -5.496  13.589   4.689
  113    H2*    U  11           H2*        U  11  -3.263  13.596   5.605
  114   2HO*    U  11          2HO*        U  11  -3.880  14.027   7.849
  115    H1*    U  11           H1*        U  11  -3.473  11.095   6.409
  116    H3     U  11           H3         U  11  -0.924  11.253   2.628
  117    H5     U  11           H5         U  11  -4.891  10.927   1.258
  118    H6     U  11           H6         U  11  -5.650  11.209   3.528
  119   1H5*    A  12          1H5*        A  12  -3.964  17.710   7.550
  120   2H5*    A  12          2H5*        A  12  -3.825  16.642   6.146
  121    H4*    A  12           H4*        A  12  -1.823  16.860   8.439
  122    H3*    A  12           H3*        A  12  -1.989  17.922   5.626
  123    H2*    A  12           H2*        A  12   0.253  17.364   5.213
  124   2HO*    A  12          2HO*        A  12   0.837  18.208   7.415
  125    H1*    A  12           H1*        A  12   0.394  15.031   6.403
  126    H8     A  12           H8         A  12  -2.921  15.313   4.712
  127   1H6     A  12          1H6         A  12   0.119  13.239  -0.305
  128   2H6     A  12          2H6         A  12  -1.467  13.642   0.349
  129    H2     A  12           H2         A  12   3.087  14.188   2.800
  130   1H5*    U  13          1H5*        U  13   1.769  19.798   6.748
  131   2H5*    U  13          2H5*        U  13   1.630  21.466   6.144
  132    H4*    U  13           H4*        U  13   3.510  20.345   5.051
  133    H3*    U  13           H3*        U  13   1.145  20.689   3.216
  134    H2*    U  13           H2*        U  13   2.694  20.075   1.464
  135   2HO*    U  13          2HO*        U  13   4.652  20.883   2.950
  136    H1*    U  13           H1*        U  13   3.433  17.885   2.728
  137    H3     U  13           H3         U  13   0.377  16.678  -0.468
  138    H5     U  13           H5         U  13  -1.906  17.873   2.843
  139    H6     U  13           H6         U  13   0.100  18.740   3.822
  140   1H5*    A  14          1H5*        A  14   5.898  22.039   1.481
  141   2H5*    A  14          2H5*        A  14   5.606  23.664   0.834
  142    H4*    A  14           H4*        A  14   6.152  21.941  -0.881
  143    H3*    A  14           H3*        A  14   3.414  23.206  -1.137
  144    H2*    A  14           H2*        A  14   3.317  21.982  -3.247
  145   2HO*    A  14          2HO*        A  14   5.608  22.430  -3.644
  146    H1*    A  14           H1*        A  14   4.394  19.674  -2.246
  147    H8     A  14           H8         A  14   1.952  21.287   0.131
  148   1H6     A  14          1H6         A  14  -2.277  17.908  -2.961
  149   2H6     A  14          2H6         A  14  -1.996  18.810  -1.463
  150    H2     A  14           H2         A  14   1.483  17.735  -5.169
  151   1H5*    A  15          1H5*        A  15   5.701  23.319  -4.878
  152   2H5*    A  15          2H5*        A  15   5.371  24.779  -5.777
  153    H4*    A  15           H4*        A  15   5.000  22.499  -6.923
  154    H3*    A  15           H3*        A  15   3.898  24.910  -7.512
  155    H2*    A  15           H2*        A  15   2.066  24.608  -6.020
  156   2HO*    A  15          2HO*        A  15   1.481  24.663  -8.527
  157    H1*    A  15           H1*        A  15   1.683  21.806  -7.103
  158    H8     A  15           H8         A  15   1.884  23.730  -3.835
  159   1H6     A  15          1H6         A  15  -3.604  21.115  -2.603
  160   2H6     A  15          2H6         A  15  -2.324  22.174  -1.955
  161    H2     A  15           H2         A  15  -2.271  19.655  -6.487
  162   1H5*    U  16          1H5*        U  16   2.731  21.038  -9.956
  163   2H5*    U  16          2H5*        U  16   2.740  21.487 -11.667
  164    H4*    U  16           H4*        U  16   1.125  19.670 -11.162
  165    H3*    U  16           H3*        U  16   0.195  22.260 -12.302
  166    H2*    U  16           H2*        U  16  -2.007  21.927 -11.770
  167   2HO*    U  16          2HO*        U  16  -1.588  19.808 -13.051
  168    H1*    U  16           H1*        U  16  -1.741  19.789  -9.863
  169    H3     U  16           H3         U  16  -4.401  22.362  -7.266
  170    H5     U  16           H5         U  16  -1.503  25.076  -8.572
  171    H6     U  16           H6         U  16  -0.462  23.286  -9.853
  172   1H5*    U  17          1H5*        U  17   2.455  17.758 -13.891
  173   2H5*    U  17          2H5*        U  17   1.475  18.166 -12.503
  174    H4*    U  17           H4*        U  17   4.525  18.269 -12.493
  175    H3*    U  17           H3*        U  17   2.676  15.997 -12.212
  176    H2*    U  17           H2*        U  17   3.198  15.376 -10.012
  177   2HO*    U  17          2HO*        U  17   5.566  15.547 -10.551
  178    H1*    U  17           H1*        U  17   3.786  17.751  -8.887
  179    H3     U  17           H3         U  17  -0.224  18.451  -7.022
  180    H5     U  17           H5         U  17  -1.167  16.461 -10.603
  181    H6     U  17           H6         U  17   1.113  16.515 -11.187
  182   1H5*    U  18          1H5*        U  18   5.555  12.230 -10.600
  183   2H5*    U  18          2H5*        U  18   5.023  13.693  -9.814
  184    H4*    U  18           H4*        U  18   7.979  13.087 -10.234
  185    H3*    U  18           H3*        U  18   6.126  11.938  -8.210
  186    H2*    U  18           H2*        U  18   7.359  12.645  -6.352
  187   2HO*    U  18          2HO*        U  18   9.345  11.863  -7.231
  188    H1*    U  18           H1*        U  18   8.286  15.042  -7.228
  189    H3     U  18           H3         U  18   5.230  16.864  -4.480
  190    H5     U  18           H5         U  18   3.025  13.966  -6.563
  191    H6     U  18           H6         U  18   4.941  13.491  -7.843
  192   1H5*    G  19          1H5*        G  19   8.208   8.574  -5.244
  193   2H5*    G  19          2H5*        G  19   6.720   9.524  -5.354
  194    H4*    G  19           H4*        G  19   9.315  10.517  -4.113
  195    H3*    G  19           H3*        G  19   6.821   9.320  -2.842
  196    H2*    G  19           H2*        G  19   7.136  10.817  -1.005
  197   2HO*    G  19          2HO*        G  19   9.505  10.612  -1.189
  198    H1*    G  19           H1*        G  19   7.438  12.996  -2.524
  199    H8     G  19           H8         G  19   5.254  10.442  -4.263
  200    H1     G  19           H1         G  19   2.184  14.359  -0.225
  201   1H2     G  19          1H2         G  19   3.655  15.776   0.665
  202   2H2     G  19          2H2         G  19   5.375  15.493   0.455
  203   1H5*    A  20          1H5*        A  20   9.393   9.661   0.450
  204   2H5*    A  20          2H5*        A  20   9.505   8.043   1.163
  205    H4*    A  20           H4*        A  20   8.944   9.665   2.871
  206    H3*    A  20           H3*        A  20   6.710   7.703   2.213
  207    H2*    A  20           H2*        A  20   5.493   8.679   3.980
  208   2HO*    A  20          2HO*        A  20   7.287   8.826   5.410
  209    H1*    A  20           H1*        A  20   6.034  11.261   3.392
  210    H8     A  20           H8         A  20   5.836   9.613   0.035
  211   1H6     A  20          1H6         A  20  -0.319  10.401   0.484
  212   2H6     A  20          2H6         A  20   1.033   9.979  -0.571
  213    H2     A  20           H2         A  20   1.402  11.093   4.477
  214   1H5*    U  21          1H5*        U  21   5.907   4.972   6.374
  215   2H5*    U  21          2H5*        U  21   5.046   5.606   4.979
  216    H4*    U  21           H4*        U  21   5.192   6.900   7.734
  217    H3*    U  21           H3*        U  21   3.116   5.464   6.082
  218    H2*    U  21           H2*        U  21   1.377   6.772   7.111
  219   2HO*    U  21          2HO*        U  21   2.484   7.074   9.206
  220    H1*    U  21           H1*        U  21   2.551   9.021   6.490
  221    H3     U  21           H3         U  21  -0.558   7.728   3.286
  222    H5     U  21           H5         U  21   3.217   6.713   1.776
  223    H6     U  21           H6         U  21   4.194   7.182   3.911
  224   1H5*    C  22          1H5*        C  22   1.168   3.720  10.652
  225   2H5*    C  22          2H5*        C  22   1.219   3.851   8.907
  226    H4*    C  22           H4*        C  22  -0.538   5.504  10.782
  227    H3*    C  22           H3*        C  22  -0.953   3.296   8.769
  228    H2*    C  22           H2*        C  22  -3.180   4.131   8.356
  229   2HO*    C  22          2HO*        C  22  -3.472   5.066  10.566
  230    H1*    C  22           H1*        C  22  -2.266   6.549   7.842
  231   1H4     C  22          1H4         C  22  -1.359   3.363   2.453
  232   2H4     C  22          2H4         C  22   0.355   3.193   2.827
  233    H5     C  22           H5         C  22   1.294   3.891   4.964
  234    H6     C  22           H6         C  22   0.762   4.867   7.121
  235   1H5*    A  23          1H5*        A  23  -4.848   1.564  11.611
  236   2H5*    A  23          2H5*        A  23  -3.859   1.674  10.168
  237    H4*    A  23           H4*        A  23  -6.605   2.953  10.529
  238    H3*    A  23           H3*        A  23  -5.583   0.432   9.260
  239    H2*    A  23           H2*        A  23  -7.081   0.715   7.380
  240   2HO*    A  23          2HO*        A  23  -8.759   1.553   8.883
  241    H1*    A  23           H1*        A  23  -6.517   3.299   6.937
  242    H8     A  23           H8         A  23  -3.263   2.131   8.294
  243   1H6     A  23          1H6         A  23  -2.229  -0.263   2.642
  244   2H6     A  23          2H6         A  23  -1.489   0.142   4.204
  245    H2     A  23           H2         A  23  -6.490   0.679   2.938
  246   1H5*    G  24          1H5*        G  24  -9.109  -0.393   8.022
  247   2H5*    G  24          2H5*        G  24  -9.623  -1.983   8.616
  248    H4*    G  24           H4*        G  24  -9.516  -1.910   6.151
  249    H3*    G  24           H3*        G  24  -7.600  -3.758   7.566
  250    H2*    G  24           H2*        G  24  -6.879  -4.512   5.387
  251   2HO*    G  24          2HO*        G  24  -8.958  -4.351   4.365
  252    H1*    G  24           H1*        G  24  -6.439  -2.052   4.404
  253    H8     G  24           H8         G  24  -5.651  -0.857   7.641
  254    H1     G  24           H1         G  24  -1.589  -5.601   6.248
  255   1H2     G  24          1H2         G  24  -2.341  -6.732   4.480
  256   2H2     G  24          2H2         G  24  -3.799  -6.208   3.666
  257   1H5*    U  25          1H5*        U  25 -11.456  -5.026   4.938
  258   2H5*    U  25          2H5*        U  25 -11.585  -6.793   4.840
  259    H4*    U  25           H4*        U  25 -12.085  -5.607   2.696
  260    H3*    U  25           H3*        U  25  -9.780  -7.593   2.610
  261    H2*    U  25           H2*        U  25  -9.554  -7.051   0.342
  262   2HO*    U  25          2HO*        U  25 -11.750  -7.019  -0.140
  263    H1*    U  25           H1*        U  25  -9.779  -4.376   0.567
  264    H3     U  25           H3         U  25  -5.306  -4.259   0.288
  265    H5     U  25           H5         U  25  -5.917  -6.772   3.554
  266    H6     U  25           H6         U  25  -8.278  -6.516   3.253
  267   1H5*    A  26          1H5*        A  26 -10.808 -10.735  -1.236
  268   2H5*    A  26          2H5*        A  26  -9.451  -9.941  -0.457
  269    H4*    A  26           H4*        A  26 -10.966  -8.912  -2.888
  270    H3*    A  26           H3*        A  26  -8.335 -10.267  -2.359
  271    H2*    A  26           H2*        A  26  -7.220  -8.906  -3.994
  272   2HO*    A  26          2HO*        A  26  -9.133  -8.916  -5.411
  273    H1*    A  26           H1*        A  26  -8.167  -6.589  -3.110
  274    H8     A  26           H8         A  26  -8.193  -8.485   0.108
  275   1H6     A  26          1H6         A  26  -2.056  -7.581   0.272
  276   2H6     A  26          2H6         A  26  -3.488  -8.136   1.148
  277    H2     A  26           H2         A  26  -3.442  -6.425  -3.741
  278   1H5*    U  27          1H5*        U  27  -8.206 -10.365  -6.444
  279   2H5*    U  27          2H5*        U  27  -7.885 -12.009  -7.037
  280    H4*    U  27           H4*        U  27  -6.175 -10.456  -7.824
  281    H3*    U  27           H3*        U  27  -5.139 -12.499  -5.817
  282    H2*    U  27           H2*        U  27  -2.985 -11.564  -6.274
  283   2HO*    U  27          2HO*        U  27  -3.417 -11.297  -8.519
  284    H1*    U  27           H1*        U  27  -3.698  -9.006  -6.033
  285    H3     U  27           H3         U  27  -1.476 -10.486  -2.275
  286    H5     U  27           H5         U  27  -5.540 -11.091  -1.488
  287    H6     U  27           H6         U  27  -6.022 -10.531  -3.781
  288   1H5*    A  28          1H5*        A  28  -2.641 -12.634  -9.360
  289   2H5*    A  28          2H5*        A  28  -2.228 -14.319  -9.723
  290    H4*    A  28           H4*        A  28  -0.223 -12.935  -9.547
  291    H3*    A  28           H3*        A  28  -0.482 -15.025  -7.353
  292    H2*    A  28           H2*        A  28   1.699 -14.283  -6.659
  293   2HO*    A  28          2HO*        A  28   2.384 -13.959  -8.904
  294    H1*    A  28           H1*        A  28   1.137 -11.678  -6.689
  295    H8     A  28           H8         A  28  -2.161 -13.239  -5.787
  296   1H6     A  28          1H6         A  28  -0.022 -13.425   0.000
  297   2H6     A  28          2H6         A  28  -1.428 -13.570  -1.057
  298    H2     A  28           H2         A  28   3.415 -12.546  -2.654
  299   1H5*    U  29          1H5*        U  29   3.371 -15.255  -9.009
  300   2H5*    U  29          2H5*        U  29   3.933 -16.920  -9.171
  301    H4*    U  29           H4*        U  29   5.465 -15.547  -7.800
  302    H3*    U  29           H3*        U  29   4.071 -17.805  -6.294
  303    H2*    U  29           H2*        U  29   5.539 -17.156  -4.470
  304   2HO*    U  29          2HO*        U  29   7.329 -16.693  -5.833
  305    H1*    U  29           H1*        U  29   5.032 -14.539  -4.640
  306    H3     U  29           H3         U  29   2.805 -16.341  -1.057
  307    H5     U  29           H5         U  29   0.162 -16.710  -4.278
  308    H6     U  29           H6         U  29   1.917 -16.035  -5.769
  309   1H5*    C  30          1H5*        C  30   8.218 -18.027  -5.610
  310   2H5*    C  30          2H5*        C  30   8.803 -19.694  -5.596
  311    H4*    C  30           H4*        C  30   9.345 -18.514  -3.504
  312    H3*    C  30           H3*        C  30   7.348 -20.792  -3.168
  313    H2*    C  30           H2*        C  30   7.644 -20.365  -0.796
  314   2HO*    C  30          2HO*        C  30   9.937 -19.794  -1.186
  315    H1*    C  30           H1*        C  30   7.262 -17.721  -0.987
  316   1H4     C  30          1H4         C  30   1.502 -20.126  -0.246
  317   2H4     C  30          2H4         C  30   1.216 -20.074  -1.996
  318    H5     C  30           H5         C  30   3.004 -19.613  -3.573
  319    H6     C  30           H6         C  30   5.300 -18.970  -3.773
  320   1H5*    C  31          1H5*        C  31  10.403 -21.237  -0.333
  321   2H5*    C  31          2H5*        C  31  10.955 -22.918  -0.251
  322    H4*    C  31           H4*        C  31  10.276 -22.101   1.966
  323    H3*    C  31           H3*        C  31   8.492 -24.225   0.725
  324    H2*    C  31           H2*        C  31   7.341 -24.297   2.831
  325   2HO*    C  31          2HO*        C  31   8.100 -23.048   4.622
  326    H1*    C  31           H1*        C  31   7.158 -21.568   3.080
  327   1H4     C  31          1H4         C  31   1.866 -23.440   0.309
  328   2H4     C  31          2H4         C  31   2.569 -23.172  -1.297
  329    H5     C  31           H5         C  31   4.930 -22.667  -1.619
  330    H6     C  31           H6         C  31   6.976 -22.201  -0.498
  331    H3T    C  31           H3T        C  31  10.300 -24.320   2.912
  Start of MODEL    5
    1   1H5*    G   1          1H5*        G   1  -3.702 -21.918  10.023
    2   2H5*    G   1          2H5*        G   1  -3.244 -22.859   8.595
    3    H4*    G   1           H4*        G   1  -1.636 -22.765  11.191
    4    H3*    G   1           H3*        G   1  -1.483 -21.143   8.651
    5    H2*    G   1           H2*        G   1   0.942 -21.204   8.817
    6   2HO*    G   1          2HO*        G   1   0.927 -21.058  11.172
    7    H1*    G   1           H1*        G   1   1.092 -23.847   9.197
    8    H8     G   1           H8         G   1  -2.028 -23.683   7.171
    9    H1     G   1           H1         G   1   3.220 -22.344   3.732
   10   1H2     G   1          1H2         G   1   4.929 -21.944   5.101
   11   2H2     G   1          2H2         G   1   4.752 -22.069   6.842
   12    H5T    G   1           H5T        G   1  -3.256 -24.723   9.986
   13   1H5*    G   2          1H5*        G   2   1.338 -19.448  11.183
   14   2H5*    G   2          2H5*        G   2   1.225 -17.678  11.207
   15    H4*    G   2           H4*        G   2   3.499 -18.442  10.635
   16    H3*    G   2           H3*        G   2   2.000 -17.012   8.430
   17    H2*    G   2           H2*        G   2   4.092 -17.135   7.174
   18   2HO*    G   2          2HO*        G   2   5.380 -16.807   9.138
   19    H1*    G   2           H1*        G   2   4.501 -19.752   7.667
   20    H8     G   2           H8         G   2   0.777 -19.622   7.532
   21    H1     G   2           H1         G   2   3.488 -18.807   1.775
   22   1H2     G   2          1H2         G   2   5.645 -18.371   2.014
   23   2H2     G   2          2H2         G   2   6.410 -18.360   3.594
   24   1H5*    A   3          1H5*        A   3   5.875 -15.332   8.747
   25   2H5*    A   3          2H5*        A   3   5.839 -13.562   8.675
   26    H4*    A   3           H4*        A   3   7.397 -14.511   7.015
   27    H3*    A   3           H3*        A   3   4.969 -13.086   5.892
   28    H2*    A   3           H2*        A   3   5.959 -13.458   3.705
   29   2HO*    A   3          2HO*        A   3   8.160 -13.137   4.579
   30    H1*    A   3           H1*        A   3   6.497 -16.062   4.105
   31    H8     A   3           H8         A   3   3.386 -15.636   6.132
   32   1H6     A   3          1H6         A   3   0.258 -16.000   0.809
   33   2H6     A   3          2H6         A   3   0.149 -16.037   2.562
   34    H2     A   3           H2         A   3   4.551 -15.323  -0.166
   35   1H5*    U   4          1H5*        U   4   8.307 -11.745   3.787
   36   2H5*    U   4          2H5*        U   4   8.305  -9.990   3.543
   37    H4*    U   4           H4*        U   4   8.486 -11.230   1.408
   38    H3*    U   4           H3*        U   4   5.924  -9.644   1.771
   39    H2*    U   4           H2*        U   4   5.459 -10.259  -0.537
   40   2HO*    U   4          2HO*        U   4   7.706 -10.070  -1.182
   41    H1*    U   4           H1*        U   4   6.074 -12.873  -0.212
   42    H3     U   4           H3         U   4   1.522 -12.274  -0.428
   43    H5     U   4           H5         U   4   2.515 -12.034   3.647
   44    H6     U   4           H6         U   4   4.838 -11.986   3.032
   45   1H5*    A   5          1H5*        A   5   7.705  -8.660  -1.994
   46   2H5*    A   5          2H5*        A   5   7.541  -6.930  -2.344
   47    H4*    A   5           H4*        A   5   6.622  -8.298  -4.165
   48    H3*    A   5           H3*        A   5   4.556  -6.704  -2.602
   49    H2*    A   5           H2*        A   5   2.995  -7.441  -4.309
   50   2HO*    A   5          2HO*        A   5   4.595  -7.305  -6.035
   51    H1*    A   5           H1*        A   5   3.725 -10.034  -4.158
   52    H8     A   5           H8         A   5   4.291  -8.747  -0.664
   53   1H6     A   5          1H6         A   5  -1.767  -9.706   0.226
   54   2H6     A   5          2H6         A   5  -0.230  -9.389   1.015
   55    H2     A   5           H2         A   5  -0.979  -9.857  -4.139
   56   1H5*    U   6          1H5*        U   6   3.930  -5.845  -6.739
   57   2H5*    U   6          2H5*        U   6   3.583  -4.111  -6.904
   58    H4*    U   6           H4*        U   6   1.760  -5.488  -7.851
   59    H3*    U   6           H3*        U   6   1.004  -4.115  -5.264
   60    H2*    U   6           H2*        U   6  -1.283  -4.659  -5.936
   61   2HO*    U   6          2HO*        U   6  -0.916  -4.558  -8.285
   62    H1*    U   6           H1*        U   6  -0.568  -7.224  -6.267
   63    H3     U   6           H3         U   6  -2.721  -6.682  -2.281
   64    H5     U   6           H5         U   6   1.325  -5.925  -1.441
   65    H6     U   6           H6         U   6   1.778  -5.975  -3.806
   66   1H5*    A   7          1H5*        A   7  -1.592  -0.788  -8.317
   67   2H5*    A   7          2H5*        A   7  -1.382  -1.660  -6.794
   68    H4*    A   7           H4*        A   7  -3.700  -1.982  -8.764
   69    H3*    A   7           H3*        A   7  -3.317  -0.911  -5.971
   70    H2*    A   7           H2*        A   7  -5.628  -1.425  -5.503
   71   2HO*    A   7          2HO*        A   7  -6.182  -1.271  -8.000
   72    H1*    A   7           H1*        A   7  -5.234  -3.968  -6.232
   73    H8     A   7           H8         A   7  -1.767  -2.933  -5.263
   74   1H6     A   7          1H6         A   7  -3.632  -3.282   0.642
   75   2H6     A   7          2H6         A   7  -2.233  -3.112  -0.409
   76    H2     A   7           H2         A   7  -7.184  -3.788  -1.947
   77   1H5*    U   8          1H5*        U   8  -6.759   2.686  -6.478
   78   2H5*    U   8          2H5*        U   8  -5.563   1.704  -5.620
   79    H4*    U   8           H4*        U   8  -8.594   1.359  -5.434
   80    H3*    U   8           H3*        U   8  -6.458   2.546  -3.660
   81    H2*    U   8           H2*        U   8  -7.842   2.004  -1.740
   82   2HO*    U   8          2HO*        U   8  -9.939   2.179  -2.871
   83    H1*    U   8           H1*        U   8  -7.943  -0.550  -2.492
   84    H3     U   8           H3         U   8  -4.337   0.360   0.403
   85    H5     U   8           H5         U   8  -2.833   0.176  -3.513
   86    H6     U   8           H6         U   8  -5.097   0.161  -4.323
   87   1H5*    G   9          1H5*        G   9 -10.106   5.913  -2.151
   88   2H5*    G   9          2H5*        G   9  -8.573   5.045  -1.985
   89    H4*    G   9           H4*        G   9 -11.095   4.511  -0.350
   90    H3*    G   9           H3*        G   9  -8.558   6.064   0.114
   91    H2*    G   9           H2*        G   9  -8.438   5.237   2.389
   92   2HO*    G   9          2HO*        G   9 -10.833   5.334   2.573
   93    H1*    G   9           H1*        G   9  -8.833   2.667   1.769
   94    H8     G   9           H8         G   9  -7.137   3.775  -1.365
   95    H1     G   9           H1         G   9  -3.184   3.683   3.688
   96   1H2     G   9          1H2         G   9  -4.366   3.583   5.564
   97   2H2     G   9          2H2         G   9  -6.120   3.434   5.536
   98   1H5*    A  10          1H5*        A  10 -10.234   6.551   3.820
   99   2H5*    A  10          2H5*        A  10 -10.304   8.279   4.209
  100    H4*    A  10           H4*        A  10  -9.061   6.998   5.910
  101    H3*    A  10           H3*        A  10  -7.499   9.041   4.312
  102    H2*    A  10           H2*        A  10  -5.618   8.534   5.769
  103   2HO*    A  10          2HO*        A  10  -7.056   8.258   7.646
  104    H1*    A  10           H1*        A  10  -5.845   5.874   5.596
  105    H8     A  10           H8         A  10  -7.032   6.845   2.211
  106   1H6     A  10          1H6         A  10  -1.050   7.520   0.703
  107   2H6     A  10          2H6         A  10  -2.685   7.401   0.074
  108    H2     A  10           H2         A  10  -1.343   7.331   5.118
  109   1H5*    U  11          1H5*        U  11  -6.293   9.450   8.337
  110   2H5*    U  11          2H5*        U  11  -6.381  11.152   8.821
  111    H4*    U  11           H4*        U  11  -4.107  10.173   9.161
  112    H3*    U  11           H3*        U  11  -4.501  12.442   7.217
  113    H2*    U  11           H2*        U  11  -2.135  12.472   6.854
  114   2HO*    U  11          2HO*        U  11  -1.543  12.291   9.051
  115    H1*    U  11           H1*        U  11  -1.755   9.770   6.962
  116    H3     U  11           H3         U  11  -0.613  10.803   2.754
  117    H5     U  11           H5         U  11  -4.794  10.392   2.663
  118    H6     U  11           H6         U  11  -4.788  10.275   5.079
  119   1H5*    A  12          1H5*        A  12  -4.148  16.005   6.802
  120   2H5*    A  12          2H5*        A  12  -3.628  14.315   6.705
  121    H4*    A  12           H4*        A  12  -1.758  16.153   8.131
  122    H3*    A  12           H3*        A  12  -2.500  16.526   5.227
  123    H2*    A  12           H2*        A  12  -0.189  16.940   4.776
  124   2HO*    A  12          2HO*        A  12   0.096  18.151   6.817
  125    H1*    A  12           H1*        A  12   0.790  14.881   6.152
  126    H8     A  12           H8         A  12  -2.536  13.885   4.766
  127   1H6     A  12          1H6         A  12   0.425  12.843  -0.587
  128   2H6     A  12          2H6         A  12  -1.100  12.722   0.265
  129    H2     A  12           H2         A  12   3.306  14.692   2.288
  130   1H5*    U  13          1H5*        U  13   0.265  19.663   6.595
  131   2H5*    U  13          2H5*        U  13  -0.153  21.201   5.816
  132    H4*    U  13           H4*        U  13   2.221  20.567   5.421
  133    H3*    U  13           H3*        U  13   0.371  20.661   3.033
  134    H2*    U  13           H2*        U  13   2.338  20.305   1.679
  135   2HO*    U  13          2HO*        U  13   3.726  21.671   2.900
  136    H1*    U  13           H1*        U  13   3.390  18.336   3.231
  137    H3     U  13           H3         U  13   1.789  16.496  -0.638
  138    H5     U  13           H5         U  13  -1.543  16.826   1.911
  139    H6     U  13           H6         U  13  -0.214  18.167   3.367
  140   1H5*    A  14          1H5*        A  14   4.120  23.229   2.543
  141   2H5*    A  14          2H5*        A  14   3.597  24.673   1.648
  142    H4*    A  14           H4*        A  14   5.601  23.563   0.630
  143    H3*    A  14           H3*        A  14   3.032  23.815  -0.923
  144    H2*    A  14           H2*        A  14   4.058  22.679  -2.765
  145   2HO*    A  14          2HO*        A  14   6.031  23.888  -2.617
  146    H1*    A  14           H1*        A  14   5.537  20.876  -1.322
  147    H8     A  14           H8         A  14   2.004  21.219   0.027
  148   1H6     A  14          1H6         A  14   0.639  16.662  -3.950
  149   2H6     A  14          2H6         A  14   0.071  17.528  -2.530
  150    H2     A  14           H2         A  14   4.613  18.284  -5.022
  151   1H5*    A  15          1H5*        A  15   6.407  25.063  -3.441
  152   2H5*    A  15          2H5*        A  15   5.949  26.399  -4.500
  153    H4*    A  15           H4*        A  15   6.803  24.218  -5.563
  154    H3*    A  15           H3*        A  15   5.257  26.087  -6.742
  155    H2*    A  15           H2*        A  15   3.224  25.168  -5.783
  156   2HO*    A  15          2HO*        A  15   3.499  24.104  -8.412
  157    H1*    A  15           H1*        A  15   4.144  22.464  -6.768
  158    H8     A  15           H8         A  15   2.497  24.185  -3.756
  159   1H6     A  15          1H6         A  15  -1.514  19.443  -4.051
  160   2H6     A  15          2H6         A  15  -1.094  20.903  -3.163
  161    H2     A  15           H2         A  15   1.527  18.925  -7.234
  162   1H5*    U  16          1H5*        U  16   4.623  23.879 -11.719
  163   2H5*    U  16          2H5*        U  16   3.131  24.391 -10.911
  164    H4*    U  16           H4*        U  16   2.604  22.517 -12.268
  165    H3*    U  16           H3*        U  16   2.469  22.143  -9.375
  166    H2*    U  16           H2*        U  16   2.783  19.768  -9.324
  167   2HO*    U  16          2HO*        U  16   1.157  19.677 -11.104
  168    H1*    U  16           H1*        U  16   4.483  19.356 -11.345
  169    H3     U  16           H3         U  16   8.571  20.779  -9.738
  170    H5     U  16           H5         U  16   5.803  21.281  -6.634
  171    H6     U  16           H6         U  16   4.020  20.938  -8.246
  172   1H5*    U  17          1H5*        U  17  -0.210  18.635 -10.800
  173   2H5*    U  17          2H5*        U  17  -1.631  18.888  -9.780
  174    H4*    U  17           H4*        U  17  -0.173  17.794  -7.886
  175    H3*    U  17           H3*        U  17   1.480  17.435 -10.283
  176    H2*    U  17           H2*        U  17   1.463  15.073 -10.444
  177   2HO*    U  17          2HO*        U  17   1.788  14.883  -8.062
  178    H1*    U  17           H1*        U  17  -1.091  14.579  -9.886
  179    H3     U  17           H3         U  17  -3.489  16.543 -13.344
  180    H5     U  17           H5         U  17   0.554  17.344 -14.108
  181    H6     U  17           H6         U  17   1.102  16.440 -11.955
  182   1H5*    U  18          1H5*        U  18   4.894  14.019  -9.094
  183   2H5*    U  18          2H5*        U  18   3.155  13.861  -9.396
  184    H4*    U  18           H4*        U  18   4.532  12.975  -6.826
  185    H3*    U  18           H3*        U  18   4.455  11.739  -9.461
  186    H2*    U  18           H2*        U  18   3.029   9.954  -9.092
  187   2HO*    U  18          2HO*        U  18   4.286   9.083  -7.436
  188    H1*    U  18           H1*        U  18   1.454  10.824  -7.025
  189    H3     U  18           H3         U  18  -2.053  11.962  -9.578
  190    H5     U  18           H5         U  18   1.205  12.565 -12.149
  191    H6     U  18           H6         U  18   2.676  12.025 -10.321
  192   1H5*    G  19          1H5*        G  19   8.044   8.394  -6.079
  193   2H5*    G  19          2H5*        G  19   6.390   9.038  -6.117
  194    H4*    G  19           H4*        G  19   8.917  10.646  -5.526
  195    H3*    G  19           H3*        G  19   6.776   9.435  -3.748
  196    H2*    G  19           H2*        G  19   7.072  11.295  -2.262
  197   2HO*    G  19          2HO*        G  19   9.425  11.318  -2.658
  198    H1*    G  19           H1*        G  19   6.998  13.175  -4.210
  199    H8     G  19           H8         G  19   4.661  10.603  -5.582
  200    H1     G  19           H1         G  19   2.253  13.808  -0.568
  201   1H2     G  19          1H2         G  19   3.841  15.027   0.367
  202   2H2     G  19          2H2         G  19   5.487  15.027  -0.237
  203   1H5*    A  20          1H5*        A  20   9.502  10.623  -0.804
  204   2H5*    A  20          2H5*        A  20   9.970   9.130   0.038
  205    H4*    A  20           H4*        A  20   9.284  10.750   1.689
  206    H3*    A  20           H3*        A  20   7.284   8.509   1.263
  207    H2*    A  20           H2*        A  20   6.097   9.398   3.147
  208   2HO*    A  20          2HO*        A  20   7.988   9.875   4.393
  209    H1*    A  20           H1*        A  20   6.285  12.004   2.369
  210    H8     A  20           H8         A  20   5.901  10.227  -0.888
  211   1H6     A  20          1H6         A  20  -0.154   9.759   0.469
  212   2H6     A  20          2H6         A  20   1.048   9.579  -0.801
  213    H2     A  20           H2         A  20   1.968  11.012   4.135
  214   1H5*    U  21          1H5*        U  21   7.134   5.821   5.617
  215   2H5*    U  21          2H5*        U  21   6.030   6.184   4.279
  216    H4*    U  21           H4*        U  21   6.158   7.593   6.985
  217    H3*    U  21           H3*        U  21   4.224   5.854   5.455
  218    H2*    U  21           H2*        U  21   2.378   6.905   6.609
  219   2HO*    U  21          2HO*        U  21   4.078   7.603   8.478
  220    H1*    U  21           H1*        U  21   3.168   9.289   5.747
  221    H3     U  21           H3         U  21   0.282   7.040   2.807
  222    H5     U  21           H5         U  21   4.156   6.887   1.178
  223    H6     U  21           H6         U  21   5.016   7.745   3.248
  224   1H5*    C  22          1H5*        C  22   2.821   3.582   9.703
  225   2H5*    C  22          2H5*        C  22   2.561   4.047   8.020
  226    H4*    C  22           H4*        C  22   0.795   4.832  10.392
  227    H3*    C  22           H3*        C  22   0.581   2.946   8.046
  228    H2*    C  22           H2*        C  22  -1.835   3.151   8.192
  229   2HO*    C  22          2HO*        C  22  -1.565   3.882  10.665
  230    H1*    C  22           H1*        C  22  -1.620   5.804   7.971
  231   1H4     C  22          1H4         C  22  -0.986   3.754   2.011
  232   2H4     C  22          2H4         C  22   0.731   4.105   2.102
  233    H5     C  22           H5         C  22   1.851   4.654   4.204
  234    H6     C  22           H6         C  22   1.507   5.109   6.554
  235   1H5*    A  23          1H5*        A  23  -1.860  -0.444  10.707
  236   2H5*    A  23          2H5*        A  23  -1.369   0.363   9.213
  237    H4*    A  23           H4*        A  23  -4.210   0.287  10.328
  238    H3*    A  23           H3*        A  23  -2.757  -1.313   8.225
  239    H2*    A  23           H2*        A  23  -4.732  -1.281   6.829
  240   2HO*    A  23          2HO*        A  23  -6.151  -1.470   8.750
  241    H1*    A  23           H1*        A  23  -5.179   1.363   7.074
  242    H8     A  23           H8         A  23  -1.465   1.280   7.386
  243   1H6     A  23          1H6         A  23  -1.407   0.646   1.187
  244   2H6     A  23          2H6         A  23  -0.390   0.977   2.590
  245    H2     A  23           H2         A  23  -5.487  -0.150   2.613
  246   1H5*    G  24          1H5*        G  24  -5.913  -3.312   7.408
  247   2H5*    G  24          2H5*        G  24  -5.790  -4.937   8.103
  248    H4*    G  24           H4*        G  24  -6.371  -5.088   5.726
  249    H3*    G  24           H3*        G  24  -3.798  -6.145   6.755
  250    H2*    G  24           H2*        G  24  -2.740  -6.377   4.694
  251   2HO*    G  24          2HO*        G  24  -4.805  -7.469   3.965
  252    H1*    G  24           H1*        G  24  -3.904  -4.325   3.253
  253    H8     G  24           H8         G  24  -2.988  -2.522   6.302
  254    H1     G  24           H1         G  24   2.204  -4.404   3.034
  255   1H2     G  24          1H2         G  24   1.623  -5.832   1.435
  256   2H2     G  24          2H2         G  24  -0.048  -6.281   1.171
  257   1H5*    U  25          1H5*        U  25  -8.403  -8.578   5.294
  258   2H5*    U  25          2H5*        U  25  -7.704  -7.222   4.401
  259    H4*    U  25           H4*        U  25 -10.304  -7.141   5.994
  260    H3*    U  25           H3*        U  25 -10.029  -8.524   3.700
  261    H2*    U  25           H2*        U  25  -8.989  -6.926   2.370
  262   2HO*    U  25          2HO*        U  25 -11.356  -7.220   1.621
  263    H1*    U  25           H1*        U  25 -10.558  -4.633   3.259
  264    H3     U  25           H3         U  25  -7.405  -1.475   2.606
  265    H5     U  25           H5         U  25  -5.393  -5.085   1.887
  266    H6     U  25           H6         U  25  -7.300  -6.261   2.707
  267   1H5*    A  26          1H5*        A  26 -11.914 -10.605   1.324
  268   2H5*    A  26          2H5*        A  26 -10.526  -9.583   1.742
  269    H4*    A  26           H4*        A  26 -12.229  -9.289  -0.777
  270    H3*    A  26           H3*        A  26  -9.614 -10.708  -0.255
  271    H2*    A  26           H2*        A  26  -8.789  -9.926  -2.380
  272   2HO*    A  26          2HO*        A  26 -10.952 -10.195  -3.379
  273    H1*    A  26           H1*        A  26  -9.571  -7.363  -2.067
  274    H8     A  26           H8         A  26  -8.860  -8.528   1.415
  275   1H6     A  26          1H6         A  26  -2.928  -7.130   0.266
  276   2H6     A  26          2H6         A  26  -4.087  -7.529   1.525
  277    H2     A  26           H2         A  26  -5.129  -7.104  -3.588
  278   1H5*    U  27          1H5*        U  27 -10.422 -11.489  -4.239
  279   2H5*    U  27          2H5*        U  27 -10.091 -13.175  -4.665
  280    H4*    U  27           H4*        U  27  -8.781 -11.611  -6.048
  281    H3*    U  27           H3*        U  27  -7.123 -13.300  -4.148
  282    H2*    U  27           H2*        U  27  -5.212 -12.347  -5.321
  283   2HO*    U  27          2HO*        U  27  -6.272 -12.411  -7.400
  284    H1*    U  27           H1*        U  27  -6.144  -9.800  -5.253
  285    H3     U  27           H3         U  27  -2.734 -10.243  -2.224
  286    H5     U  27           H5         U  27  -6.194 -11.428  -0.166
  287    H6     U  27           H6         U  27  -7.404 -11.363  -2.251
  288   1H5*    A  28          1H5*        A  28  -5.555 -13.729  -8.136
  289   2H5*    A  28          2H5*        A  28  -5.054 -15.407  -8.418
  290    H4*    A  28           H4*        A  28  -3.226 -13.826  -8.880
  291    H3*    A  28           H3*        A  28  -2.750 -15.633  -6.487
  292    H2*    A  28           H2*        A  28  -0.522 -14.655  -6.457
  293   2HO*    A  28          2HO*        A  28  -0.441 -14.539  -8.829
  294    H1*    A  28           H1*        A  28  -1.391 -12.108  -6.623
  295    H8     A  28           H8         A  28  -4.157 -13.822  -4.737
  296   1H6     A  28          1H6         A  28  -0.610 -13.200   0.297
  297   2H6     A  28          2H6         A  28  -2.210 -13.595  -0.304
  298    H2     A  28           H2         A  28   1.923 -12.396  -3.274
  299   1H5*    U  29          1H5*        U  29   0.644 -15.795  -8.921
  300   2H5*    U  29          2H5*        U  29   1.293 -17.440  -9.073
  301    H4*    U  29           H4*        U  29   2.994 -15.854  -8.243
  302    H3*    U  29           H3*        U  29   2.148 -17.961  -6.220
  303    H2*    U  29           H2*        U  29   3.965 -17.058  -4.870
  304   2HO*    U  29          2HO*        U  29   5.364 -16.665  -6.691
  305    H1*    U  29           H1*        U  29   3.235 -14.482  -5.218
  306    H3     U  29           H3         U  29   2.019 -15.907  -1.038
  307    H5     U  29           H5         U  29  -1.265 -16.771  -3.508
  308    H6     U  29           H6         U  29   0.090 -16.221  -5.423
  309   1H5*    C  30          1H5*        C  30   6.332 -17.915  -6.483
  310   2H5*    C  30          2H5*        C  30   7.041 -19.538  -6.415
  311    H4*    C  30           H4*        C  30   7.950 -18.058  -4.653
  312    H3*    C  30           H3*        C  30   6.256 -20.364  -3.609
  313    H2*    C  30           H2*        C  30   7.068 -19.643  -1.426
  314   2HO*    C  30          2HO*        C  30   9.182 -19.014  -2.391
  315    H1*    C  30           H1*        C  30   6.459 -17.043  -1.850
  316   1H4     C  30          1H4         C  30   1.169 -19.546   0.547
  317   2H4     C  30          2H4         C  30   0.517 -19.773  -1.069
  318    H5     C  30           H5         C  30   1.881 -19.433  -3.095
  319    H6     C  30           H6         C  30   4.038 -18.732  -3.904
  320   1H5*    C  31          1H5*        C  31   9.873 -20.285  -1.531
  321   2H5*    C  31          2H5*        C  31  10.603 -21.904  -1.483
  322    H4*    C  31           H4*        C  31  10.449 -21.019   0.795
  323    H3*    C  31           H3*        C  31   8.468 -23.238   0.155
  324    H2*    C  31           H2*        C  31   7.951 -23.228   2.514
  325   2HO*    C  31          2HO*        C  31  10.221 -22.818   3.108
  326    H1*    C  31           H1*        C  31   7.743 -20.513   2.659
  327   1H4     C  31          1H4         C  31   1.940 -22.692   1.425
  328   2H4     C  31          2H4         C  31   2.215 -22.569  -0.307
  329    H5     C  31           H5         C  31   4.416 -21.989  -1.251
  330    H6     C  31           H6         C  31   6.687 -21.403  -0.704
  331    H3T    C  31           H3T        C  31  10.665 -23.821   0.068
  Start of MODEL    6
    1   1H5*    G   1          1H5*        G   1  -6.464 -24.210   8.932
    2   2H5*    G   1          2H5*        G   1  -6.272 -22.512   9.418
    3    H4*    G   1           H4*        G   1  -4.385 -23.758  10.263
    4    H3*    G   1           H3*        G   1  -3.699 -22.007   7.887
    5    H2*    G   1           H2*        G   1  -1.392 -22.594   8.306
    6   2HO*    G   1          2HO*        G   1  -1.619 -22.611  10.628
    7    H1*    G   1           H1*        G   1  -1.866 -25.224   8.451
    8    H8     G   1           H8         G   1  -4.536 -24.268   6.063
    9    H1     G   1           H1         G   1   1.326 -23.760   3.506
   10   1H2     G   1          1H2         G   1   2.845 -23.844   5.127
   11   2H2     G   1          2H2         G   1   2.381 -24.077   6.800
   12    H5T    G   1           H5T        G   1  -5.517 -22.045   7.338
   13   1H5*    G   2          1H5*        G   2  -0.946 -21.045  10.865
   14   2H5*    G   2          2H5*        G   2  -0.769 -19.290  11.024
   15    H4*    G   2           H4*        G   2   1.404 -20.391  10.705
   16    H3*    G   2           H3*        G   2   0.503 -18.601   8.433
   17    H2*    G   2           H2*        G   2   2.708 -19.018   7.474
   18   2HO*    G   2          2HO*        G   2   3.731 -19.017   9.598
   19    H1*    G   2           H1*        G   2   2.621 -21.676   7.811
   20    H8     G   2           H8         G   2  -0.969 -20.942   7.169
   21    H1     G   2           H1         G   2   2.703 -20.251   1.943
   22   1H2     G   2          1H2         G   2   4.833 -20.185   2.538
   23   2H2     G   2          2H2         G   2   5.321 -20.399   4.213
   24   1H5*    A   3          1H5*        A   3   4.540 -17.616   9.380
   25   2H5*    A   3          2H5*        A   3   4.766 -15.865   9.466
   26    H4*    A   3           H4*        A   3   6.379 -16.913   7.929
   27    H3*    A   3           H3*        A   3   4.352 -15.051   6.642
   28    H2*    A   3           H2*        A   3   5.571 -15.428   4.579
   29   2HO*    A   3          2HO*        A   3   7.648 -15.495   5.722
   30    H1*    A   3           H1*        A   3   5.683 -18.093   4.809
   31    H8     A   3           H8         A   3   2.410 -17.351   6.448
   32   1H6     A   3          1H6         A   3   0.062 -16.936   0.735
   33   2H6     A   3          2H6         A   3  -0.302 -17.026   2.457
   34    H2     A   3           H2         A   3   4.493 -16.877   0.402
   35   1H5*    U   4          1H5*        U   4   8.150 -14.059   5.166
   36   2H5*    U   4          2H5*        U   4   8.406 -12.314   5.065
   37    H4*    U   4           H4*        U   4   8.736 -13.425   2.879
   38    H3*    U   4           H3*        U   4   6.358 -11.543   3.019
   39    H2*    U   4           H2*        U   4   6.163 -11.958   0.620
   40   2HO*    U   4          2HO*        U   4   8.501 -12.044   0.351
   41    H1*    U   4           H1*        U   4   6.426 -14.637   0.823
   42    H3     U   4           H3         U   4   2.077 -13.526  -0.059
   43    H5     U   4           H5         U   4   2.392 -13.545   4.125
   44    H6     U   4           H6         U   4   4.775 -13.750   3.908
   45   1H5*    A   5          1H5*        A   5   8.553 -10.660  -0.428
   46   2H5*    A   5          2H5*        A   5   8.692  -8.925  -0.712
   47    H4*    A   5           H4*        A   5   7.756 -10.093  -2.659
   48    H3*    A   5           H3*        A   5   5.828  -8.168  -1.286
   49    H2*    A   5           H2*        A   5   4.341  -8.651  -3.118
   50   2HO*    A   5          2HO*        A   5   6.087  -8.755  -4.679
   51    H1*    A   5           H1*        A   5   4.637 -11.324  -2.998
   52    H8     A   5           H8         A   5   5.019 -10.342   0.590
   53   1H6     A   5          1H6         A   5  -1.177 -10.150   0.775
   54   2H6     A   5          2H6         A   5   0.302 -10.131   1.741
   55    H2     A   5           H2         A   5   0.061 -10.214  -3.472
   56   1H5*    U   6          1H5*        U   6   5.813  -7.332  -5.438
   57   2H5*    U   6          2H5*        U   6   5.832  -5.579  -5.694
   58    H4*    U   6           H4*        U   6   3.901  -6.687  -6.802
   59    H3*    U   6           H3*        U   6   3.278  -4.745  -4.558
   60    H2*    U   6           H2*        U   6   0.964  -5.062  -5.172
   61   2HO*    U   6          2HO*        U   6   1.281  -5.031  -7.419
   62    H1*    U   6           H1*        U   6   1.122  -7.752  -5.498
   63    H3     U   6           H3         U   6  -1.418  -6.881  -1.835
   64    H5     U   6           H5         U   6   2.536  -6.856  -0.422
   65    H6     U   6           H6         U   6   3.323  -6.999  -2.702
   66   1H5*    A   7          1H5*        A   7   0.230  -1.278  -7.193
   67   2H5*    A   7          2H5*        A   7   0.322  -1.920  -5.551
   68    H4*    A   7           H4*        A   7  -1.351  -3.049  -7.835
   69    H3*    A   7           H3*        A   7  -1.841  -1.288  -5.477
   70    H2*    A   7           H2*        A   7  -3.655  -2.547  -4.626
   71   2HO*    A   7          2HO*        A   7  -4.513  -2.869  -6.831
   72    H1*    A   7           H1*        A   7  -2.649  -5.015  -4.929
   73    H8     A   7           H8         A   7   0.589  -3.425  -4.198
   74   1H6     A   7          1H6         A   7  -1.375  -2.552   1.620
   75   2H6     A   7          2H6         A   7   0.022  -2.526   0.554
   76    H2     A   7           H2         A   7  -4.843  -3.811  -0.832
   77   1H5*    U   8          1H5*        U   8  -5.808  -1.696  -6.187
   78   2H5*    U   8          2H5*        U   8  -6.510  -0.076  -6.356
   79    H4*    U   8           H4*        U   8  -7.534  -1.288  -4.466
   80    H3*    U   8           H3*        U   8  -5.697   0.964  -3.648
   81    H2*    U   8           H2*        U   8  -6.640   0.703  -1.427
   82   2HO*    U   8          2HO*        U   8  -8.791  -0.007  -2.089
   83    H1*    U   8           H1*        U   8  -6.134  -1.919  -1.457
   84    H3     U   8           H3         U   8  -2.982   0.492   0.893
   85    H5     U   8           H5         U   8  -1.490   0.085  -3.022
   86    H6     U   8           H6         U   8  -3.626  -0.776  -3.678
   87   1H5*    G   9          1H5*        G   9  -9.850   3.570  -2.374
   88   2H5*    G   9          2H5*        G   9  -8.163   3.116  -2.166
   89    H4*    G   9           H4*        G   9 -10.389   2.567  -0.149
   90    H3*    G   9           H3*        G   9  -8.306   4.745  -0.387
   91    H2*    G   9           H2*        G   9  -8.012   4.682   2.021
   92   2HO*    G   9          2HO*        G   9 -10.329   4.284   2.352
   93    H1*    G   9           H1*        G   9  -7.761   2.022   2.193
   94    H8     G   9           H8         G   9  -6.412   2.610  -1.243
   95    H1     G   9           H1         G   9  -2.418   4.649   3.342
   96   1H2     G   9          1H2         G   9  -3.503   4.837   5.262
   97   2H2     G   9          2H2         G   9  -5.189   4.377   5.401
   98   1H5*    A  10          1H5*        A  10 -10.495   5.784   3.108
   99   2H5*    A  10          2H5*        A  10 -10.895   7.505   3.028
  100    H4*    A  10           H4*        A  10  -9.686   6.896   5.107
  101    H3*    A  10           H3*        A  10  -8.316   8.833   3.210
  102    H2*    A  10           H2*        A  10  -6.636   9.061   4.932
  103   2HO*    A  10          2HO*        A  10  -8.207   8.916   6.678
  104    H1*    A  10           H1*        A  10  -6.334   6.441   5.382
  105    H8     A  10           H8         A  10  -7.131   6.482   1.743
  106   1H6     A  10          1H6         A  10  -1.165   7.839   0.810
  107   2H6     A  10          2H6         A  10  -2.665   7.297   0.082
  108    H2     A  10           H2         A  10  -2.069   8.556   5.097
  109   1H5*    U  11          1H5*        U  11  -8.098  10.389   7.117
  110   2H5*    U  11          2H5*        U  11  -8.381  12.132   7.106
  111    H4*    U  11           H4*        U  11  -6.159  11.530   8.053
  112    H3*    U  11           H3*        U  11  -6.080  12.954   5.384
  113    H2*    U  11           H2*        U  11  -3.738  13.344   5.932
  114   2HO*    U  11          2HO*        U  11  -4.001  13.465   8.272
  115    H1*    U  11           H1*        U  11  -3.385  10.771   6.470
  116    H3     U  11           H3         U  11  -1.651  11.561   2.333
  117    H5     U  11           H5         U  11  -5.693  10.612   1.679
  118    H6     U  11           H6         U  11  -6.069  10.749   4.053
  119   1H5*    A  12          1H5*        A  12  -4.600  16.994   8.545
  120   2H5*    A  12          2H5*        A  12  -4.636  16.142   6.990
  121    H4*    A  12           H4*        A  12  -2.256  16.249   8.903
  122    H3*    A  12           H3*        A  12  -3.053  17.678   6.373
  123    H2*    A  12           H2*        A  12  -0.866  17.496   5.526
  124   2HO*    A  12          2HO*        A  12   0.110  18.084   7.603
  125    H1*    A  12           H1*        A  12  -0.295  15.020   6.322
  126    H8     A  12           H8         A  12  -3.833  15.159   5.142
  127   1H6     A  12          1H6         A  12  -1.444  14.181  -0.509
  128   2H6     A  12          2H6         A  12  -2.919  14.241   0.435
  129    H2     A  12           H2         A  12   1.886  15.106   2.303
  130   1H5*    U  13          1H5*        U  13   0.672  19.702   7.795
  131   2H5*    U  13          2H5*        U  13   0.500  21.414   7.366
  132    H4*    U  13           H4*        U  13   2.531  20.406   6.368
  133    H3*    U  13           H3*        U  13   0.400  21.215   4.365
  134    H2*    U  13           H2*        U  13   2.109  20.739   2.708
  135   2HO*    U  13          2HO*        U  13   3.884  21.544   3.885
  136    H1*    U  13           H1*        U  13   2.834  18.365   3.824
  137    H3     U  13           H3         U  13   0.449  17.486   0.047
  138    H5     U  13           H5         U  13  -2.450  18.286   2.979
  139    H6     U  13           H6         U  13  -0.703  19.051   4.420
  140   1H5*    A  14          1H5*        A  14   4.462  23.101   3.664
  141   2H5*    A  14          2H5*        A  14   4.222  24.618   2.777
  142    H4*    A  14           H4*        A  14   5.833  23.048   1.670
  143    H3*    A  14           H3*        A  14   3.303  23.721   0.143
  144    H2*    A  14           H2*        A  14   4.323  22.498  -1.689
  145   2HO*    A  14          2HO*        A  14   6.470  23.288  -1.287
  146    H1*    A  14           H1*        A  14   5.200  20.429  -0.141
  147    H8     A  14           H8         A  14   1.788  21.657   0.933
  148   1H6     A  14          1H6         A  14  -0.335  17.692  -3.374
  149   2H6     A  14          2H6         A  14  -0.810  18.681  -1.998
  150    H2     A  14           H2         A  14   4.016  18.164  -3.945
  151   1H5*    A  15          1H5*        A  15   7.034  24.287  -2.129
  152   2H5*    A  15          2H5*        A  15   6.923  25.688  -3.181
  153    H4*    A  15           H4*        A  15   7.627  23.428  -4.208
  154    H3*    A  15           H3*        A  15   6.521  25.600  -5.393
  155    H2*    A  15           H2*        A  15   4.281  24.875  -4.985
  156   2HO*    A  15          2HO*        A  15   4.879  25.054  -7.419
  157    H1*    A  15           H1*        A  15   5.069  22.117  -5.943
  158    H8     A  15           H8         A  15   3.144  23.913  -3.198
  159   1H6     A  15          1H6         A  15  -1.535  20.161  -4.872
  160   2H6     A  15          2H6         A  15  -1.075  21.470  -3.779
  161    H2     A  15           H2         A  15   2.029  19.047  -7.192
  162   1H5*    U  16          1H5*        U  16   7.073  21.795  -8.373
  163   2H5*    U  16          2H5*        U  16   7.803  22.505  -9.817
  164    H4*    U  16           H4*        U  16   5.722  22.219 -11.060
  165    H3*    U  16           H3*        U  16   4.619  21.748  -8.430
  166    H2*    U  16           H2*        U  16   3.951  19.507  -8.498
  167   2HO*    U  16          2HO*        U  16   3.887  19.876 -11.284
  168    H1*    U  16           H1*        U  16   5.820  18.407 -10.057
  169    H3     U  16           H3         U  16   9.658  18.619  -7.384
  170    H5     U  16           H5         U  16   6.469  20.054  -5.070
  171    H6     U  16           H6         U  16   5.122  20.113  -7.064
  172   1H5*    U  17          1H5*        U  17   1.360  20.317 -10.196
  173   2H5*    U  17          2H5*        U  17   1.836  19.671 -11.772
  174    H4*    U  17           H4*        U  17  -0.908  20.827 -11.281
  175    H3*    U  17           H3*        U  17   0.317  18.406 -10.318
  176    H2*    U  17           H2*        U  17  -0.585  16.746 -11.711
  177   2HO*    U  17          2HO*        U  17  -2.754  17.369 -11.338
  178    H1*    U  17           H1*        U  17  -0.894  18.008 -14.003
  179    H3     U  17           H3         U  17   3.178  17.771 -15.933
  180    H5     U  17           H5         U  17   3.818  16.547 -11.978
  181    H6     U  17           H6         U  17   1.618  17.283 -11.427
  182   1H5*    U  18          1H5*        U  18   0.900  16.999  -9.104
  183   2H5*    U  18          2H5*        U  18  -0.377  16.044  -9.862
  184    H4*    U  18           H4*        U  18   0.912  15.359  -7.204
  185    H3*    U  18           H3*        U  18   1.687  15.031 -10.002
  186    H2*    U  18           H2*        U  18   1.548  12.718 -10.226
  187   2HO*    U  18          2HO*        U  18   2.699  12.174  -8.413
  188    H1*    U  18           H1*        U  18  -0.639  12.183  -8.734
  189    H3     U  18           H3         U  18  -4.058  13.071 -11.541
  190    H5     U  18           H5         U  18  -0.775  14.919 -13.364
  191    H6     U  18           H6         U  18   0.523  14.466 -11.431
  192   1H5*    G  19          1H5*        G  19   5.226  11.348  -7.509
  193   2H5*    G  19          2H5*        G  19   3.754  12.196  -7.112
  194    H4*    G  19           H4*        G  19   6.502  13.491  -7.093
  195    H3*    G  19           H3*        G  19   4.797  12.042  -5.068
  196    H2*    G  19           H2*        G  19   5.389  13.637  -3.352
  197   2HO*    G  19          2HO*        G  19   7.600  13.859  -4.292
  198    H1*    G  19           H1*        G  19   4.800  15.772  -4.818
  199    H8     G  19           H8         G  19   2.392  13.439  -6.439
  200    H1     G  19           H1         G  19   0.854  14.906  -0.355
  201   1H2     G  19          1H2         G  19   2.583  16.011   0.593
  202   2H2     G  19          2H2         G  19   4.073  16.224  -0.275
  203   1H5*    A  20          1H5*        A  20   7.755  13.192  -2.548
  204   2H5*    A  20          2H5*        A  20   8.510  11.751  -1.856
  205    H4*    A  20           H4*        A  20   7.848  13.291  -0.100
  206    H3*    A  20           H3*        A  20   6.267  10.683  -0.164
  207    H2*    A  20           H2*        A  20   5.267  11.381   1.856
  208   2HO*    A  20          2HO*        A  20   7.207  12.246   2.780
  209    H1*    A  20           H1*        A  20   4.796  13.943   1.112
  210    H8     A  20           H8         A  20   4.342  12.109  -2.089
  211   1H6     A  20          1H6         A  20  -1.323  10.594   0.008
  212   2H6     A  20          2H6         A  20  -0.267  10.622  -1.391
  213    H2     A  20           H2         A  20   1.026  12.144   3.421
  214   1H5*    U  21          1H5*        U  21   7.409   8.296   4.130
  215   2H5*    U  21          2H5*        U  21   6.058   8.444   3.001
  216    H4*    U  21           H4*        U  21   6.417  10.009   5.597
  217    H3*    U  21           H3*        U  21   4.798   7.661   4.635
  218    H2*    U  21           H2*        U  21   2.908   8.390   5.947
  219   2HO*    U  21          2HO*        U  21   4.300   9.163   7.699
  220    H1*    U  21           H1*        U  21   2.963  10.920   5.084
  221    H3     U  21           H3         U  21  -0.113   8.285   2.821
  222    H5     U  21           H5         U  21   3.308   8.557   0.382
  223    H6     U  21           H6         U  21   4.506   9.554   2.204
  224   1H5*    C  22          1H5*        C  22   3.771   7.666   8.660
  225   2H5*    C  22          2H5*        C  22   3.966   6.034   9.333
  226    H4*    C  22           H4*        C  22   1.655   6.879   9.598
  227    H3*    C  22           H3*        C  22   2.001   4.492   7.750
  228    H2*    C  22           H2*        C  22  -0.419   4.445   7.678
  229   2HO*    C  22          2HO*        C  22  -0.677   5.001   9.906
  230    H1*    C  22           H1*        C  22  -0.720   7.092   7.258
  231   1H4     C  22          1H4         C  22  -0.300   4.421   1.526
  232   2H4     C  22          2H4         C  22   1.418   4.791   1.461
  233    H5     C  22           H5         C  22   2.636   5.706   3.384
  234    H6     C  22           H6         C  22   2.408   6.443   5.666
  235   1H5*    A  23          1H5*        A  23  -1.026   3.496  10.825
  236   2H5*    A  23          2H5*        A  23  -0.792   1.790  11.262
  237    H4*    A  23           H4*        A  23  -3.114   2.272  10.532
  238    H3*    A  23           H3*        A  23  -1.500   0.411   8.763
  239    H2*    A  23           H2*        A  23  -3.619   0.077   7.563
  240   2HO*    A  23          2HO*        A  23  -4.883   0.225   9.545
  241    H1*    A  23           H1*        A  23  -4.112   2.708   7.306
  242    H8     A  23           H8         A  23  -0.357   2.588   7.281
  243   1H6     A  23          1H6         A  23  -0.825   1.003   1.325
  244   2H6     A  23          2H6         A  23   0.246   1.516   2.614
  245    H2     A  23           H2         A  23  -4.845   0.528   3.189
  246   1H5*    G  24          1H5*        G  24  -5.296  -1.390   9.496
  247   2H5*    G  24          2H5*        G  24  -5.105  -3.122   9.819
  248    H4*    G  24           H4*        G  24  -6.706  -2.555   7.951
  249    H3*    G  24           H3*        G  24  -4.305  -4.293   7.337
  250    H2*    G  24           H2*        G  24  -5.333  -4.601   5.154
  251   2HO*    G  24          2HO*        G  24  -7.518  -4.556   5.804
  252    H1*    G  24           H1*        G  24  -5.527  -1.961   4.703
  253    H8     G  24           H8         G  24  -2.634  -1.392   6.745
  254    H1     G  24           H1         G  24  -1.062  -5.451   2.046
  255   1H2     G  24          1H2         G  24  -2.915  -6.268   1.136
  256   2H2     G  24          2H2         G  24  -4.503  -5.819   1.733
  257   1H5*    U  25          1H5*        U  25  -8.201  -8.242   5.837
  258   2H5*    U  25          2H5*        U  25  -7.145  -7.435   4.653
  259    H4*    U  25           H4*        U  25 -10.044  -6.672   5.266
  260    H3*    U  25           H3*        U  25  -8.716  -8.148   2.981
  261    H2*    U  25           H2*        U  25 -10.274  -7.110   1.502
  262   2HO*    U  25          2HO*        U  25 -12.060  -7.642   2.944
  263    H1*    U  25           H1*        U  25 -10.500  -4.739   2.946
  264    H3     U  25           H3         U  25  -9.320  -3.771  -1.364
  265    H5     U  25           H5         U  25  -5.773  -4.972   0.505
  266    H6     U  25           H6         U  25  -7.043  -5.552   2.480
  267   1H5*    A  26          1H5*        A  26 -10.273 -10.835   0.185
  268   2H5*    A  26          2H5*        A  26  -8.998  -9.815   0.815
  269    H4*    A  26           H4*        A  26 -11.099  -8.924  -1.220
  270    H3*    A  26           H3*        A  26  -8.383 -10.158  -1.302
  271    H2*    A  26           H2*        A  26  -7.638  -8.773  -3.108
  272   2HO*    A  26          2HO*        A  26  -9.790  -8.791  -4.135
  273    H1*    A  26           H1*        A  26  -8.369  -6.473  -2.002
  274    H8     A  26           H8         A  26  -8.012  -8.203   1.144
  275   1H6     A  26          1H6         A  26  -1.838  -8.172   0.316
  276   2H6     A  26          2H6         A  26  -3.151  -8.503   1.458
  277    H2     A  26           H2         A  26  -3.765  -6.981  -3.493
  278   1H5*    U  27          1H5*        U  27  -8.870 -10.321  -5.281
  279   2H5*    U  27          2H5*        U  27  -8.733 -11.981  -5.899
  280    H4*    U  27           H4*        U  27  -7.043 -10.545  -6.931
  281    H3*    U  27           H3*        U  27  -5.928 -12.623  -5.014
  282    H2*    U  27           H2*        U  27  -3.752 -11.864  -5.725
  283   2HO*    U  27          2HO*        U  27  -4.426 -11.563  -7.934
  284    H1*    U  27           H1*        U  27  -4.276  -9.236  -5.450
  285    H3     U  27           H3         U  27  -1.807 -10.926  -1.909
  286    H5     U  27           H5         U  27  -5.830 -11.010  -0.717
  287    H6     U  27           H6         U  27  -6.459 -10.478  -2.972
  288   1H5*    A  28          1H5*        A  28  -3.795 -13.043  -8.785
  289   2H5*    A  28          2H5*        A  28  -3.576 -14.769  -9.131
  290    H4*    A  28           H4*        A  28  -1.438 -13.568  -9.185
  291    H3*    A  28           H3*        A  28  -1.690 -15.555  -6.893
  292    H2*    A  28           H2*        A  28   0.629 -15.024  -6.456
  293   2HO*    A  28          2HO*        A  28   1.111 -14.829  -8.770
  294    H1*    A  28           H1*        A  28   0.295 -12.359  -6.561
  295    H8     A  28           H8         A  28  -3.006 -13.562  -5.229
  296   1H6     A  28          1H6         A  28  -0.232 -13.898   0.298
  297   2H6     A  28          2H6         A  28  -1.761 -13.950  -0.566
  298    H2     A  28           H2         A  28   2.933 -13.383  -2.790
  299   1H5*    U  29          1H5*        U  29   1.945 -16.242  -8.870
  300   2H5*    U  29          2H5*        U  29   2.326 -17.963  -9.017
  301    H4*    U  29           H4*        U  29   4.113 -16.705  -7.865
  302    H3*    U  29           H3*        U  29   2.667 -18.733  -6.103
  303    H2*    U  29           H2*        U  29   4.402 -18.173  -4.483
  304   2HO*    U  29          2HO*        U  29   6.029 -17.921  -6.172
  305    H1*    U  29           H1*        U  29   4.108 -15.510  -4.752
  306    H3     U  29           H3         U  29   2.109 -16.944  -0.878
  307    H5     U  29           H5         U  29  -0.872 -17.172  -3.815
  308    H6     U  29           H6         U  29   0.787 -16.724  -5.494
  309   1H5*    C  30          1H5*        C  30   6.778 -19.311  -5.725
  310   2H5*    C  30          2H5*        C  30   7.223 -21.022  -5.692
  311    H4*    C  30           H4*        C  30   8.060 -19.812  -3.709
  312    H3*    C  30           H3*        C  30   5.925 -21.910  -3.106
  313    H2*    C  30           H2*        C  30   6.463 -21.437  -0.783
  314   2HO*    C  30          2HO*        C  30   8.767 -21.063  -1.398
  315    H1*    C  30           H1*        C  30   6.313 -18.756  -1.062
  316   1H4     C  30          1H4         C  30   0.412 -20.501   0.317
  317   2H4     C  30          2H4         C  30  -0.020 -20.477  -1.392
  318    H5     C  30           H5         C  30   1.669 -20.246  -3.156
  319    H6     C  30           H6         C  30   4.000 -19.870  -3.589
  320   1H5*    C  31          1H5*        C  31   9.049 -22.477  -0.457
  321   2H5*    C  31          2H5*        C  31   9.543 -24.177  -0.417
  322    H4*    C  31           H4*        C  31   9.054 -23.431   1.855
  323    H3*    C  31           H3*        C  31   6.937 -25.276   0.681
  324    H2*    C  31           H2*        C  31   6.011 -25.330   2.912
  325   2HO*    C  31          2HO*        C  31   8.159 -25.320   3.923
  326    H1*    C  31           H1*        C  31   6.196 -22.626   3.263
  327   1H4     C  31          1H4         C  31   0.414 -23.753   1.034
  328   2H4     C  31          2H4         C  31   0.973 -23.577  -0.626
  329    H5     C  31           H5         C  31   3.343 -23.316  -1.198
  330    H6     C  31           H6         C  31   5.567 -23.138  -0.295
  331    H3T    C  31           H3T        C  31   9.009 -26.186   0.912
  Start of MODEL    7
    1   1H5*    G   1          1H5*        G   1  -5.827 -22.192   9.597
    2   2H5*    G   1          2H5*        G   1  -5.867 -20.434   9.809
    3    H4*    G   1           H4*        G   1  -3.885 -21.263  10.863
    4    H3*    G   1           H3*        G   1  -3.296 -19.844   8.267
    5    H2*    G   1           H2*        G   1  -0.966 -20.078   8.821
    6   2HO*    G   1          2HO*        G   1  -1.295 -19.748  11.083
    7    H1*    G   1           H1*        G   1  -1.099 -22.656   9.377
    8    H8     G   1           H8         G   1  -3.770 -22.450   6.810
    9    H1     G   1           H1         G   1   2.140 -21.717   4.370
   10   1H2     G   1          1H2         G   1   3.533 -21.309   6.031
   11   2H2     G   1          2H2         G   1   2.953 -21.321   7.703
   12    H5T    G   1           H5T        G   1  -5.126 -20.216   7.654
   13   1H5*    G   2          1H5*        G   2  -0.847 -18.139  11.186
   14   2H5*    G   2          2H5*        G   2  -0.814 -16.381  11.052
   15    H4*    G   2           H4*        G   2   1.441 -17.335  11.017
   16    H3*    G   2           H3*        G   2   0.565 -15.977   8.460
   17    H2*    G   2           H2*        G   2   2.836 -16.426   7.657
   18   2HO*    G   2          2HO*        G   2   3.693 -16.078   9.827
   19    H1*    G   2           H1*        G   2   2.876 -18.973   8.329
   20    H8     G   2           H8         G   2  -0.724 -18.535   7.499
   21    H1     G   2           H1         G   2   3.129 -18.456   2.333
   22   1H2     G   2          1H2         G   2   5.189 -18.168   2.993
   23   2H2     G   2          2H2         G   2   5.580 -18.145   4.725
   24   1H5*    A   3          1H5*        A   3   4.506 -14.706   9.405
   25   2H5*    A   3          2H5*        A   3   4.692 -12.969   9.196
   26    H4*    A   3           H4*        A   3   6.365 -14.228   7.914
   27    H3*    A   3           H3*        A   3   4.398 -12.602   6.279
   28    H2*    A   3           H2*        A   3   5.623 -13.301   4.335
   29   2HO*    A   3          2HO*        A   3   7.658 -13.196   5.586
   30    H1*    A   3           H1*        A   3   5.723 -15.874   4.927
   31    H8     A   3           H8         A   3   2.427 -14.898   6.372
   32   1H6     A   3          1H6         A   3   0.313 -15.324   0.558
   33   2H6     A   3          2H6         A   3  -0.109 -15.099   2.280
   34    H2     A   3           H2         A   3   4.688 -15.419   0.375
   35   1H5*    U   4          1H5*        U   4   8.229 -11.795   4.714
   36   2H5*    U   4          2H5*        U   4   8.439 -10.078   4.375
   37    H4*    U   4           H4*        U   4   8.790 -11.434   2.380
   38    H3*    U   4           H3*        U   4   6.349  -9.646   2.201
   39    H2*    U   4           H2*        U   4   6.211 -10.433  -0.088
   40   2HO*    U   4          2HO*        U   4   8.524 -10.429  -0.299
   41    H1*    U   4           H1*        U   4   6.532 -13.030   0.484
   42    H3     U   4           H3         U   4   2.178 -12.192  -0.584
   43    H5     U   4           H5         U   4   2.406 -11.560   3.553
   44    H6     U   4           H6         U   4   4.801 -11.702   3.413
   45   1H5*    A   5          1H5*        A   5   8.576  -9.055  -1.353
   46   2H5*    A   5          2H5*        A   5   8.607  -7.345  -1.783
   47    H4*    A   5           H4*        A   5   7.783  -8.705  -3.622
   48    H3*    A   5           H3*        A   5   5.701  -6.823  -2.477
   49    H2*    A   5           H2*        A   5   4.244  -7.633  -4.196
   50   2HO*    A   5          2HO*        A   5   5.938  -7.679  -5.757
   51    H1*    A   5           H1*        A   5   4.746 -10.226  -3.871
   52    H8     A   5           H8         A   5   5.012  -8.867  -0.392
   53   1H6     A   5          1H6         A   5  -1.189  -9.344  -0.373
   54   2H6     A   5          2H6         A   5   0.257  -9.068   0.616
   55    H2     A   5           H2         A   5   0.156  -9.635  -4.522
   56   1H5*    U   6          1H5*        U   6   5.525  -6.206  -6.787
   57   2H5*    U   6          2H5*        U   6   5.301  -4.457  -7.001
   58    H4*    U   6           H4*        U   6   3.505  -5.807  -8.021
   59    H3*    U   6           H3*        U   6   2.633  -3.968  -5.776
   60    H2*    U   6           H2*        U   6   0.388  -4.661  -6.394
   61   2HO*    U   6          2HO*        U   6   0.944  -4.654  -8.649
   62    H1*    U   6           H1*        U   6   0.918  -7.282  -6.521
   63    H3     U   6           H3         U   6  -1.484  -6.466  -2.759
   64    H5     U   6           H5         U   6   2.456  -5.771  -1.587
   65    H6     U   6           H6         U   6   3.153  -5.982  -3.916
   66   1H5*    A   7          1H5*        A   7  -0.071  -3.235  -9.098
   67   2H5*    A   7          2H5*        A   7  -0.387  -1.489  -9.139
   68    H4*    A   7           H4*        A   7  -2.426  -2.867  -8.993
   69    H3*    A   7           H3*        A   7  -1.964  -0.977  -6.664
   70    H2*    A   7           H2*        A   7  -4.058  -1.710  -5.822
   71   2HO*    A   7          2HO*        A   7  -4.917  -1.834  -8.047
   72    H1*    A   7           H1*        A   7  -3.641  -4.331  -6.143
   73    H8     A   7           H8         A   7  -0.210  -3.055  -5.376
   74   1H6     A   7          1H6         A   7  -2.127  -3.179   0.577
   75   2H6     A   7          2H6         A   7  -0.752  -3.062  -0.524
   76    H2     A   7           H2         A   7  -5.665  -3.583  -2.067
   77   1H5*    U   8          1H5*        U   8  -6.064  -0.349  -7.748
   78   2H5*    U   8          2H5*        U   8  -6.298   1.412  -7.761
   79    H4*    U   8           H4*        U   8  -7.865   0.237  -6.264
   80    H3*    U   8           H3*        U   8  -5.946   2.162  -4.952
   81    H2*    U   8           H2*        U   8  -7.189   1.675  -2.908
   82   2HO*    U   8          2HO*        U   8  -9.192   1.669  -4.023
   83    H1*    U   8           H1*        U   8  -7.313  -0.973  -3.233
   84    H3     U   8           H3         U   8  -4.463   0.037   0.212
   85    H5     U   8           H5         U   8  -2.069   0.075  -3.218
   86    H6     U   8           H6         U   8  -4.050  -0.083  -4.611
   87   1H5*    G   9          1H5*        G   9  -9.951   3.188  -3.424
   88   2H5*    G   9          2H5*        G   9 -10.004   4.961  -3.310
   89    H4*    G   9           H4*        G   9 -10.506   3.811  -1.183
   90    H3*    G   9           H3*        G   9  -8.037   5.564  -1.134
   91    H2*    G   9           H2*        G   9  -7.918   5.020   1.213
   92   2HO*    G   9          2HO*        G   9 -10.217   5.077   1.472
   93    H1*    G   9           H1*        G   9  -8.203   2.385   0.930
   94    H8     G   9           H8         G   9  -6.405   3.358  -2.243
   95    H1     G   9           H1         G   9  -2.698   3.805   2.998
   96   1H2     G   9          1H2         G   9  -3.995   3.845   4.764
   97   2H2     G   9          2H2         G   9  -5.734   3.595   4.615
   98   1H5*    A  10          1H5*        A  10 -10.273   6.669   2.515
   99   2H5*    A  10          2H5*        A  10 -10.255   8.445   2.500
  100    H4*    A  10           H4*        A  10  -9.388   7.546   4.607
  101    H3*    A  10           H3*        A  10  -7.317   8.908   2.892
  102    H2*    A  10           H2*        A  10  -5.867   8.793   4.801
  103   2HO*    A  10          2HO*        A  10  -7.633   8.885   6.462
  104    H1*    A  10           H1*        A  10  -6.228   6.215   5.056
  105    H8     A  10           H8         A  10  -6.736   6.635   1.383
  106   1H6     A  10          1H6         A  10  -0.559   6.943   1.021
  107   2H6     A  10          2H6         A  10  -2.074   6.719   0.142
  108    H2     A  10           H2         A  10  -1.636   7.412   5.244
  109   1H5*    U  11          1H5*        U  11  -7.180  12.685   6.266
  110   2H5*    U  11          2H5*        U  11  -6.543  11.682   4.981
  111    H4*    U  11           H4*        U  11  -5.725  11.476   7.914
  112    H3*    U  11           H3*        U  11  -4.539  12.991   5.589
  113    H2*    U  11           H2*        U  11  -2.333  12.450   6.426
  114   2HO*    U  11          2HO*        U  11  -3.075  12.678   8.646
  115    H1*    U  11           H1*        U  11  -2.774   9.869   6.819
  116    H3     U  11           H3         U  11  -0.384  10.367   2.926
  117    H5     U  11           H5         U  11  -4.399  10.368   1.765
  118    H6     U  11           H6         U  11  -5.049  10.490   4.109
  119   1H5*    A  12          1H5*        A  12  -2.232  14.194   9.121
  120   2H5*    A  12          2H5*        A  12  -2.110  15.961   9.035
  121    H4*    A  12           H4*        A  12   0.110  14.874   9.221
  122    H3*    A  12           H3*        A  12  -0.551  16.490   6.776
  123    H2*    A  12           H2*        A  12   1.537  15.914   5.848
  124   2HO*    A  12          2HO*        A  12   2.512  16.325   8.031
  125    H1*    A  12           H1*        A  12   1.764  13.413   6.610
  126    H8     A  12           H8         A  12  -1.722  14.050   5.388
  127   1H6     A  12          1H6         A  12   0.750  12.621  -0.157
  128   2H6     A  12          2H6         A  12  -0.757  12.927   0.708
  129    H2     A  12           H2         A  12   4.024  13.158   2.673
  130   1H5*    U  13          1H5*        U  13   3.575  17.924   7.482
  131   2H5*    U  13          2H5*        U  13   3.408  19.677   7.234
  132    H4*    U  13           H4*        U  13   4.995  18.741   5.638
  133    H3*    U  13           H3*        U  13   2.424  19.745   4.420
  134    H2*    U  13           H2*        U  13   3.435  19.265   2.280
  135   2HO*    U  13          2HO*        U  13   5.511  20.008   2.984
  136    H1*    U  13           H1*        U  13   4.416  16.850   2.915
  137    H3     U  13           H3         U  13   0.871  16.071   0.158
  138    H5     U  13           H5         U  13  -0.865  16.798   3.890
  139    H6     U  13           H6         U  13   1.278  17.512   4.708
  140   1H5*    A  14          1H5*        A  14   5.837  21.553   2.181
  141   2H5*    A  14          2H5*        A  14   5.304  23.177   1.726
  142    H4*    A  14           H4*        A  14   6.005  21.784  -0.211
  143    H3*    A  14           H3*        A  14   3.169  22.791  -0.131
  144    H2*    A  14           H2*        A  14   2.833  21.737  -2.248
  145   2HO*    A  14          2HO*        A  14   5.084  22.443  -2.862
  146    H1*    A  14           H1*        A  14   4.222  19.451  -1.790
  147    H8     A  14           H8         A  14   2.193  20.405   1.213
  148   1H6     A  14          1H6         A  14  -2.376  17.430  -1.789
  149   2H6     A  14          2H6         A  14  -1.815  17.907  -0.165
  150    H2     A  14           H2         A  14   0.751  18.245  -4.640
  151   1H5*    A  15          1H5*        A  15   4.450  23.344  -4.206
  152   2H5*    A  15          2H5*        A  15   4.080  24.995  -4.661
  153    H4*    A  15           H4*        A  15   3.116  23.115  -6.083
  154    H3*    A  15           H3*        A  15   2.104  25.627  -5.748
  155    H2*    A  15           H2*        A  15   0.931  24.983  -3.730
  156   2HO*    A  15          2HO*        A  15  -0.671  24.972  -5.998
  157    H1*    A  15           H1*        A  15  -0.129  22.609  -5.375
  158    H8     A  15           H8         A  15   1.114  23.667  -1.989
  159   1H6     A  15          1H6         A  15  -3.629  20.200   0.119
  160   2H6     A  15          2H6         A  15  -2.230  21.185   0.618
  161    H2     A  15           H2         A  15  -3.645  20.009  -4.201
  162   1H5*    U  16          1H5*        U  16   1.851  21.892  -8.655
  163   2H5*    U  16          2H5*        U  16   1.870  22.243 -10.386
  164    H4*    U  16           H4*        U  16   0.325  20.406  -9.948
  165    H3*    U  16           H3*        U  16  -0.947  23.001 -10.760
  166    H2*    U  16           H2*        U  16  -3.006  22.433 -10.028
  167   2HO*    U  16          2HO*        U  16  -2.471  20.402 -11.473
  168    H1*    U  16           H1*        U  16  -2.341  20.149  -8.373
  169    H3     U  16           H3         U  16  -5.049  22.173  -5.369
  170    H5     U  16           H5         U  16  -2.541  25.273  -6.564
  171    H6     U  16           H6         U  16  -1.394  23.729  -8.092
  172   1H5*    U  17          1H5*        U  17   1.444  18.770 -13.045
  173   2H5*    U  17          2H5*        U  17   0.518  19.017 -11.593
  174    H4*    U  17           H4*        U  17   3.541  19.405 -11.568
  175    H3*    U  17           H3*        U  17   2.030  16.826 -11.625
  176    H2*    U  17           H2*        U  17   3.079  15.969  -9.752
  177   2HO*    U  17          2HO*        U  17   5.248  16.634 -10.452
  178    H1*    U  17           H1*        U  17   3.338  18.199  -8.244
  179    H3     U  17           H3         U  17   0.103  16.145  -5.840
  180    H5     U  17           H5         U  17  -1.448  16.174  -9.761
  181    H6     U  17           H6         U  17   0.481  17.328 -10.468
  182   1H5*    U  18          1H5*        U  18   4.980  13.172 -11.150
  183   2H5*    U  18          2H5*        U  18   4.305  14.369 -10.099
  184    H4*    U  18           H4*        U  18   7.321  14.063 -10.375
  185    H3*    U  18           H3*        U  18   5.417  12.340  -8.851
  186    H2*    U  18           H2*        U  18   6.535  12.579  -6.831
  187   2HO*    U  18          2HO*        U  18   8.613  12.184  -7.763
  188    H1*    U  18           H1*        U  18   7.334  15.178  -6.984
  189    H3     U  18           H3         U  18   4.064  15.798  -3.899
  190    H5     U  18           H5         U  18   2.139  13.667  -6.955
  191    H6     U  18           H6         U  18   4.129  13.735  -8.209
  192   1H5*    G  19          1H5*        G  19   7.970   8.582  -6.638
  193   2H5*    G  19          2H5*        G  19   6.517   9.561  -6.402
  194    H4*    G  19           H4*        G  19   9.273  10.341  -5.393
  195    H3*    G  19           H3*        G  19   7.017   8.888  -3.943
  196    H2*    G  19           H2*        G  19   7.537  10.068  -2.002
  197   2HO*    G  19          2HO*        G  19   9.809   9.925  -2.328
  198    H1*    G  19           H1*        G  19   7.665  12.499  -3.147
  199    H8     G  19           H8         G  19   5.267  10.164  -4.915
  200    H1     G  19           H1         G  19   2.758  13.567  -0.111
  201   1H2     G  19          1H2         G  19   4.325  14.838   0.751
  202   2H2     G  19          2H2         G  19   6.010  14.571   0.302
  203   1H5*    A  20          1H5*        A  20   8.618   6.419  -0.100
  204   2H5*    A  20          2H5*        A  20   7.168   7.248  -0.634
  205    H4*    A  20           H4*        A  20   9.337   8.401   1.179
  206    H3*    A  20           H3*        A  20   6.617   7.183   1.495
  207    H2*    A  20           H2*        A  20   6.068   8.700   3.301
  208   2HO*    A  20          2HO*        A  20   8.312   8.706   4.074
  209    H1*    A  20           H1*        A  20   6.681  10.873   1.944
  210    H8     A  20           H8         A  20   5.996   8.851  -1.040
  211   1H6     A  20          1H6         A  20  -0.059   9.492   0.347
  212   2H6     A  20          2H6         A  20   1.104   9.041  -0.923
  213    H2     A  20           H2         A  20   2.200  10.358   3.950
  214   1H5*    U  21          1H5*        U  21   7.736   7.327   5.513
  215   2H5*    U  21          2H5*        U  21   7.612   5.708   6.245
  216    H4*    U  21           H4*        U  21   6.183   7.322   7.407
  217    H3*    U  21           H3*        U  21   4.741   5.121   5.909
  218    H2*    U  21           H2*        U  21   2.709   6.004   6.832
  219   2HO*    U  21          2HO*        U  21   3.822   6.525   8.849
  220    H1*    U  21           H1*        U  21   3.168   8.536   6.220
  221    H3     U  21           H3         U  21   0.198   6.796   3.227
  222    H5     U  21           H5         U  21   3.929   6.321   1.432
  223    H6     U  21           H6         U  21   4.956   6.988   3.519
  224   1H5*    C  22          1H5*        C  22   2.851   5.207   9.739
  225   2H5*    C  22          2H5*        C  22   2.675   3.529  10.277
  226    H4*    C  22           H4*        C  22   0.536   4.719  10.151
  227    H3*    C  22           H3*        C  22   0.746   2.367   8.229
  228    H2*    C  22           H2*        C  22  -1.525   2.819   7.757
  229   2HO*    C  22          2HO*        C  22  -2.120   3.274   9.899
  230    H1*    C  22           H1*        C  22  -1.325   5.446   7.479
  231   1H4     C  22          1H4         C  22  -0.534   3.300   1.664
  232   2H4     C  22          2H4         C  22   1.220   3.239   1.864
  233    H5     C  22           H5         C  22   2.312   3.572   4.026
  234    H6     C  22           H6         C  22   1.894   4.167   6.335
  235   1H5*    A  23          1H5*        A  23  -2.728   1.755  10.945
  236   2H5*    A  23          2H5*        A  23  -2.838  -0.001  11.230
  237    H4*    A  23           H4*        A  23  -4.936   0.918  10.337
  238    H3*    A  23           H3*        A  23  -3.479  -0.816   8.354
  239    H2*    A  23           H2*        A  23  -5.603  -0.671   7.076
  240   2HO*    A  23          2HO*        A  23  -6.828  -0.124   9.289
  241    H1*    A  23           H1*        A  23  -5.451   1.920   7.064
  242    H8     A  23           H8         A  23  -1.840   0.949   7.405
  243   1H6     A  23          1H6         A  23  -1.997  -0.013   1.321
  244   2H6     A  23          2H6         A  23  -0.991   0.151   2.783
  245    H2     A  23           H2         A  23  -6.148   0.287   2.687
  246   1H5*    G  24          1H5*        G  24  -8.534  -1.463   9.147
  247   2H5*    G  24          2H5*        G  24  -8.735  -3.200   9.477
  248    H4*    G  24           H4*        G  24  -9.778  -2.416   7.360
  249    H3*    G  24           H3*        G  24  -7.542  -4.412   6.992
  250    H2*    G  24           H2*        G  24  -8.238  -4.400   4.678
  251   2HO*    G  24          2HO*        G  24 -10.454  -4.255   5.042
  252    H1*    G  24           H1*        G  24  -8.312  -1.680   4.492
  253    H8     G  24           H8         G  24  -5.433  -2.568   6.754
  254    H1     G  24           H1         G  24  -4.331  -3.556   0.521
  255   1H2     G  24          1H2         G  24  -7.777  -3.131   0.320
  256   2H2     G  24          2H2         G  24  -6.289  -3.557  -0.542
  257   1H5*    U  25          1H5*        U  25 -10.938  -7.914   4.351
  258   2H5*    U  25          2H5*        U  25  -9.263  -7.578   3.999
  259    H4*    U  25           H4*        U  25 -11.615  -5.966   2.892
  260    H3*    U  25           H3*        U  25 -10.384  -8.449   1.698
  261    H2*    U  25           H2*        U  25  -9.561  -7.657  -0.055
  262   2HO*    U  25          2HO*        U  25 -11.406  -6.460  -0.672
  263    H1*    U  25           H1*        U  25  -8.389  -5.488   0.714
  264    H3     U  25           H3         U  25  -6.392  -9.989   2.473
  265    H5     U  25           H5         U  25  -5.379  -6.326   4.163
  266    H6     U  25           H6         U  25  -7.354  -5.361   3.076
  267   1H5*    A  26          1H5*        A  26 -11.310 -10.359  -1.824
  268   2H5*    A  26          2H5*        A  26 -10.144  -9.477  -0.876
  269    H4*    A  26           H4*        A  26 -11.109  -8.616  -3.645
  270    H3*    A  26           H3*        A  26  -8.765 -10.298  -2.770
  271    H2*    A  26           H2*        A  26  -7.443  -9.282  -4.519
  272   2HO*    A  26          2HO*        A  26  -9.326  -9.253  -5.950
  273    H1*    A  26           H1*        A  26  -8.166  -6.780  -3.974
  274    H8     A  26           H8         A  26  -8.186  -8.621  -0.692
  275   1H6     A  26          1H6         A  26  -2.107  -7.134  -0.548
  276   2H6     A  26          2H6         A  26  -3.466  -7.812   0.368
  277    H2     A  26           H2         A  26  -3.581  -6.300  -4.579
  278   1H5*    U  27          1H5*        U  27  -8.630 -10.643  -6.901
  279   2H5*    U  27          2H5*        U  27  -8.306 -12.321  -7.354
  280    H4*    U  27           H4*        U  27  -6.612 -10.854  -8.263
  281    H3*    U  27           H3*        U  27  -5.501 -12.681  -6.104
  282    H2*    U  27           H2*        U  27  -3.373 -11.812  -6.774
  283   2HO*    U  27          2HO*        U  27  -3.947 -11.757  -9.005
  284    H1*    U  27           H1*        U  27  -4.092  -9.251  -6.714
  285    H3     U  27           H3         U  27  -1.689 -10.151  -2.949
  286    H5     U  27           H5         U  27  -5.599 -11.182  -1.923
  287    H6     U  27           H6         U  27  -6.235 -10.885  -4.249
  288   1H5*    A  28          1H5*        A  28  -3.149 -13.395  -9.651
  289   2H5*    A  28          2H5*        A  28  -2.802 -15.131  -9.753
  290    H4*    A  28           H4*        A  28  -0.760 -13.843  -9.854
  291    H3*    A  28           H3*        A  28  -0.977 -15.496  -7.318
  292    H2*    A  28           H2*        A  28   1.235 -14.719  -6.842
  293   2HO*    A  28          2HO*        A  28   1.804 -14.812  -9.162
  294    H1*    A  28           H1*        A  28   0.742 -12.137  -7.288
  295    H8     A  28           H8         A  28  -2.550 -13.441  -6.047
  296   1H6     A  28          1H6         A  28  -0.164 -12.651  -0.398
  297   2H6     A  28          2H6         A  28  -1.619 -12.942  -1.359
  298    H2     A  28           H2         A  28   3.168 -12.412  -3.259
  299   1H5*    U  29          1H5*        U  29   2.789 -16.192  -8.953
  300   2H5*    U  29          2H5*        U  29   3.261 -17.887  -8.824
  301    H4*    U  29           H4*        U  29   4.887 -16.410  -7.762
  302    H3*    U  29           H3*        U  29   3.441 -18.211  -5.775
  303    H2*    U  29           H2*        U  29   5.029 -17.303  -4.189
  304   2HO*    U  29          2HO*        U  29   6.753 -17.253  -5.683
  305    H1*    U  29           H1*        U  29   4.630 -14.760  -4.828
  306    H3     U  29           H3         U  29   2.420 -15.662  -0.931
  307    H5     U  29           H5         U  29  -0.354 -16.473  -3.943
  308    H6     U  29           H6         U  29   1.391 -16.274  -5.583
  309   1H5*    C  30          1H5*        C  30   7.596 -18.598  -5.227
  310   2H5*    C  30          2H5*        C  30   8.057 -20.274  -4.922
  311    H4*    C  30           H4*        C  30   8.814 -18.784  -3.130
  312    H3*    C  30           H3*        C  30   6.699 -20.789  -2.250
  313    H2*    C  30           H2*        C  30   7.129 -19.922  -0.027
  314   2HO*    C  30          2HO*        C  30   9.423 -19.651  -0.588
  315    H1*    C  30           H1*        C  30   6.936 -17.358  -0.690
  316   1H4     C  30          1H4         C  30   1.074 -18.951   0.724
  317   2H4     C  30          2H4         C  30   0.658 -19.169  -0.992
  318    H5     C  30           H5         C  30   2.366 -19.288  -2.694
  319    H6     C  30           H6         C  30   4.707 -18.947  -3.117
  320   1H5*    C  31          1H5*        C  31   9.912 -20.917   0.453
  321   2H5*    C  31          2H5*        C  31  10.400 -22.588   0.752
  322    H4*    C  31           H4*        C  31   9.915 -21.490   2.873
  323    H3*    C  31           H3*        C  31   7.813 -23.528   2.040
  324    H2*    C  31           H2*        C  31   6.849 -23.228   4.200
  325   2HO*    C  31          2HO*        C  31   9.029 -23.019   5.190
  326    H1*    C  31           H1*        C  31   6.971 -20.506   4.129
  327   1H4     C  31          1H4         C  31   1.328 -22.027   1.951
  328   2H4     C  31          2H4         C  31   1.918 -22.105   0.273
  329    H5     C  31           H5         C  31   4.250 -21.993  -0.272
  330    H6     C  31           H6         C  31   6.445 -21.650   0.646
  331    H3T    C  31           H3T        C  31   9.873 -24.367   2.406
  Start of MODEL    8
    1   1H5*    G   1          1H5*        G   1  -5.714 -24.088   8.567
    2   2H5*    G   1          2H5*        G   1  -5.761 -22.370   9.010
    3    H4*    G   1           H4*        G   1  -3.864 -23.391  10.113
    4    H3*    G   1           H3*        G   1  -3.110 -21.615   7.779
    5    H2*    G   1           H2*        G   1  -0.809 -21.934   8.462
    6   2HO*    G   1          2HO*        G   1  -1.297 -21.923  10.751
    7    H1*    G   1           H1*        G   1  -1.017 -24.611   8.660
    8    H8     G   1           H8         G   1  -3.460 -23.994   5.930
    9    H1     G   1           H1         G   1   2.593 -22.930   4.092
   10   1H2     G   1          1H2         G   1   3.899 -22.782   5.892
   11   2H2     G   1          2H2         G   1   3.257 -23.013   7.508
   12    H5T    G   1           H5T        G   1  -4.825 -21.868   7.021
   13   1H5*    G   2          1H5*        G   2  -0.812 -20.280  11.006
   14   2H5*    G   2          2H5*        G   2  -0.877 -18.516  11.141
   15    H4*    G   2           H4*        G   2   1.444 -19.322  11.086
   16    H3*    G   2           H3*        G   2   0.567 -17.706   8.686
   17    H2*    G   2           H2*        G   2   2.892 -17.836   7.958
   18   2HO*    G   2          2HO*        G   2   3.676 -17.657  10.188
   19    H1*    G   2           H1*        G   2   3.132 -20.486   8.380
   20    H8     G   2           H8         G   2  -0.439 -20.261   7.355
   21    H1     G   2           H1         G   2   3.601 -19.167   2.488
   22   1H2     G   2          1H2         G   2   5.629 -18.774   3.265
   23   2H2     G   2          2H2         G   2   5.997 -18.880   4.977
   24   1H5*    A   3          1H5*        A   3   4.298 -16.174  10.038
   25   2H5*    A   3          2H5*        A   3   4.306 -14.403  10.087
   26    H4*    A   3           H4*        A   3   6.196 -15.284   8.775
   27    H3*    A   3           H3*        A   3   4.130 -13.717   7.206
   28    H2*    A   3           H2*        A   3   5.594 -14.000   5.294
   29   2HO*    A   3          2HO*        A   3   7.537 -13.773   6.647
   30    H1*    A   3           H1*        A   3   6.005 -16.633   5.651
   31    H8     A   3           H8         A   3   2.494 -16.231   6.885
   32   1H6     A   3          1H6         A   3   0.771 -16.228   0.939
   33   2H6     A   3          2H6         A   3   0.224 -16.320   2.608
   34    H2     A   3           H2         A   3   5.188 -15.713   1.090
   35   1H5*    U   4          1H5*        U   4   7.953 -12.341   6.133
   36   2H5*    U   4          2H5*        U   4   8.020 -10.582   5.923
   37    H4*    U   4           H4*        U   4   8.728 -11.806   3.880
   38    H3*    U   4           H3*        U   4   6.172 -10.192   3.618
   39    H2*    U   4           H2*        U   4   6.305 -10.770   1.246
   40   2HO*    U   4          2HO*        U   4   8.655 -10.598   1.235
   41    H1*    U   4           H1*        U   4   6.805 -13.399   1.687
   42    H3     U   4           H3         U   4   2.500 -12.797   0.242
   43    H5     U   4           H5         U   4   2.330 -12.419   4.424
   44    H6     U   4           H6         U   4   4.733 -12.442   4.478
   45   1H5*    A   5          1H5*        A   5   8.658  -9.221   0.347
   46   2H5*    A   5          2H5*        A   5   8.626  -7.482   0.007
   47    H4*    A   5           H4*        A   5   8.067  -8.812  -1.990
   48    H3*    A   5           H3*        A   5   5.810  -7.106  -0.894
   49    H2*    A   5           H2*        A   5   4.535  -7.833  -2.818
   50   2HO*    A   5          2HO*        A   5   6.393  -7.733  -4.251
   51    H1*    A   5           H1*        A   5   5.197 -10.450  -2.615
   52    H8     A   5           H8         A   5   5.004  -9.333   0.958
   53   1H6     A   5          1H6         A   5  -1.135 -10.060   0.412
   54   2H6     A   5          2H6         A   5   0.195  -9.856   1.546
   55    H2     A   5           H2         A   5   0.610  -9.969  -3.662
   56   1H5*    U   6          1H5*        U   6   5.998  -6.344  -5.124
   57   2H5*    U   6          2H5*        U   6   5.687  -4.620  -5.409
   58    H4*    U   6           H4*        U   6   4.078  -6.132  -6.581
   59    H3*    U   6           H3*        U   6   2.915  -4.297  -4.466
   60    H2*    U   6           H2*        U   6   0.756  -5.089  -5.316
   61   2HO*    U   6          2HO*        U   6   1.506  -5.142  -7.534
   62    H1*    U   6           H1*        U   6   1.479  -7.706  -5.319
   63    H3     U   6           H3         U   6  -1.419  -6.784  -1.895
   64    H5     U   6           H5         U   6   2.417  -6.069  -0.332
   65    H6     U   6           H6         U   6   3.321  -6.324  -2.551
   66   1H5*    A   7          1H5*        A   7   0.590  -3.849  -8.141
   67   2H5*    A   7          2H5*        A   7   0.095  -2.153  -8.301
   68    H4*    A   7           H4*        A   7  -1.807  -3.795  -8.339
   69    H3*    A   7           H3*        A   7  -1.775  -1.674  -6.174
   70    H2*    A   7           H2*        A   7  -3.888  -2.562  -5.434
   71   2HO*    A   7          2HO*        A   7  -4.579  -2.942  -7.677
   72    H1*    A   7           H1*        A   7  -3.172  -5.164  -5.526
   73    H8     A   7           H8         A   7   0.021  -3.538  -4.460
   74   1H6     A   7          1H6         A   7  -2.532  -3.141   1.173
   75   2H6     A   7          2H6         A   7  -1.023  -3.095   0.270
   76    H2     A   7           H2         A   7  -5.753  -3.993  -1.760
   77   1H5*    U   8          1H5*        U   8  -5.831  -1.816  -7.418
   78   2H5*    U   8          2H5*        U   8  -6.348  -0.150  -7.726
   79    H4*    U   8           H4*        U   8  -7.810  -1.309  -6.096
   80    H3*    U   8           H3*        U   8  -6.251   1.084  -5.078
   81    H2*    U   8           H2*        U   8  -7.554   0.833  -3.051
   82   2HO*    U   8          2HO*        U   8  -9.507   0.290  -4.211
   83    H1*    U   8           H1*        U   8  -7.265  -1.857  -2.877
   84    H3     U   8           H3         U   8  -4.722   0.321   0.277
   85    H5     U   8           H5         U   8  -2.224  -0.216  -3.057
   86    H6     U   8           H6         U   8  -4.148  -0.891  -4.337
   87   1H5*    G   9          1H5*        G   9 -10.563   1.973  -4.183
   88   2H5*    G   9          2H5*        G   9 -10.752   3.684  -4.624
   89    H4*    G   9           H4*        G   9 -11.512   3.231  -2.318
   90    H3*    G   9           H3*        G   9  -9.079   5.024  -2.583
   91    H2*    G   9           H2*        G   9  -9.239   5.318  -0.180
   92   2HO*    G   9          2HO*        G   9 -11.588   5.349  -0.203
   93    H1*    G   9           H1*        G   9  -9.535   2.691   0.374
   94    H8     G   9           H8         G   9  -7.253   2.653  -2.630
   95    H1     G   9           H1         G   9  -4.374   4.645   2.748
   96   1H2     G   9          1H2         G   9  -5.903   5.263   4.239
   97   2H2     G   9          2H2         G   9  -7.618   5.064   3.925
   98   1H5*    A  10          1H5*        A  10 -11.896   6.931   0.133
   99   2H5*    A  10          2H5*        A  10 -11.937   8.670  -0.220
  100    H4*    A  10           H4*        A  10 -11.419   8.165   2.168
  101    H3*    A  10           H3*        A  10  -9.300   9.608   0.552
  102    H2*    A  10           H2*        A  10  -8.058   9.769   2.625
  103   2HO*    A  10          2HO*        A  10  -9.993  10.129   3.915
  104    H1*    A  10           H1*        A  10  -8.394   7.201   3.347
  105    H8     A  10           H8         A  10  -8.206   6.975  -0.395
  106   1H6     A  10          1H6         A  10  -2.047   7.323   0.293
  107   2H6     A  10          2H6         A  10  -3.353   6.993  -0.832
  108    H2     A  10           H2         A  10  -3.929   8.451   4.154
  109   1H5*    U  11          1H5*        U  11  -9.846  11.647   4.289
  110   2H5*    U  11          2H5*        U  11  -9.684  13.399   4.066
  111    H4*    U  11           H4*        U  11  -8.021  12.437   5.683
  112    H3*    U  11           H3*        U  11  -6.853  13.525   3.115
  113    H2*    U  11           H2*        U  11  -4.731  13.417   4.340
  114   2HO*    U  11          2HO*        U  11  -5.613  13.761   6.505
  115    H1*    U  11           H1*        U  11  -5.189  10.855   4.928
  116    H3     U  11           H3         U  11  -2.303  11.112   1.384
  117    H5     U  11           H5         U  11  -6.145  11.001  -0.308
  118    H6     U  11           H6         U  11  -7.069  11.272   1.898
  119   1H5*    A  12          1H5*        A  12  -5.128  17.275   6.478
  120   2H5*    A  12          2H5*        A  12  -5.037  16.323   4.985
  121    H4*    A  12           H4*        A  12  -3.325  15.858   7.474
  122    H3*    A  12           H3*        A  12  -2.924  17.303   4.858
  123    H2*    A  12           H2*        A  12  -0.714  16.446   4.693
  124   2HO*    A  12          2HO*        A  12  -0.352  16.769   7.055
  125    H1*    A  12           H1*        A  12  -1.215  13.928   5.438
  126    H8     A  12           H8         A  12  -4.166  15.110   3.486
  127   1H6     A  12          1H6         A  12  -0.915  13.658  -1.585
  128   2H6     A  12          2H6         A  12  -2.495  14.095  -0.960
  129    H2     A  12           H2         A  12   1.849  13.603   1.903
  130   1H5*    U  13          1H5*        U  13   0.731  17.899   7.178
  131   2H5*    U  13          2H5*        U  13   1.180  19.608   7.025
  132    H4*    U  13           H4*        U  13   3.043  18.128   6.330
  133    H3*    U  13           H3*        U  13   1.728  19.819   4.199
  134    H2*    U  13           H2*        U  13   3.453  19.056   2.704
  135   2HO*    U  13          2HO*        U  13   5.173  19.206   4.216
  136    H1*    U  13           H1*        U  13   3.410  16.457   3.516
  137    H3     U  13           H3         U  13   1.673  16.731  -0.716
  138    H5     U  13           H5         U  13  -1.516  17.655   1.865
  139    H6     U  13           H6         U  13   0.069  17.826   3.656
  140   1H5*    A  14          1H5*        A  14   6.261  20.465   4.440
  141   2H5*    A  14          2H5*        A  14   6.491  22.208   4.154
  142    H4*    A  14           H4*        A  14   7.927  20.804   2.664
  143    H3*    A  14           H3*        A  14   5.803  22.585   1.456
  144    H2*    A  14           H2*        A  14   6.474  21.837  -0.701
  145   2HO*    A  14          2HO*        A  14   8.786  22.001   0.072
  146    H1*    A  14           H1*        A  14   6.928  19.199  -0.070
  147    H8     A  14           H8         A  14   3.744  20.504   1.521
  148   1H6     A  14          1H6         A  14   1.095  19.403  -3.991
  149   2H6     A  14          2H6         A  14   0.772  19.761  -2.299
  150    H2     A  14           H2         A  14   5.468  18.877  -4.424
  151   1H5*    A  15          1H5*        A  15   7.737  23.240  -1.545
  152   2H5*    A  15          2H5*        A  15   8.448  24.864  -1.537
  153    H4*    A  15           H4*        A  15   6.643  25.797  -2.749
  154    H3*    A  15           H3*        A  15   4.942  24.081  -1.492
  155    H2*    A  15           H2*        A  15   5.644  22.117  -2.467
  156   2HO*    A  15          2HO*        A  15   3.719  23.131  -4.283
  157    H1*    A  15           H1*        A  15   5.905  23.291  -5.199
  158    H8     A  15           H8         A  15   7.793  21.396  -2.434
  159   1H6     A  15          1H6         A  15   9.283  17.444  -6.998
  160   2H6     A  15          2H6         A  15   9.469  17.759  -5.277
  161    H2     A  15           H2         A  15   7.082  20.835  -8.758
  162   1H5*    U  16          1H5*        U  16   1.845  24.979  -5.868
  163   2H5*    U  16          2H5*        U  16   2.146  23.613  -4.785
  164    H4*    U  16           H4*        U  16   1.247  22.685  -6.768
  165    H3*    U  16           H3*        U  16   4.132  22.301  -6.318
  166    H2*    U  16           H2*        U  16   4.861  21.876  -8.457
  167   2HO*    U  16          2HO*        U  16   2.195  21.061  -8.929
  168    H1*    U  16           H1*        U  16   3.131  23.379  -9.921
  169    H3     U  16           H3         U  16   5.264  27.374  -9.961
  170    H5     U  16           H5         U  16   7.372  25.069  -7.161
  171    H6     U  16           H6         U  16   5.629  23.412  -7.292
  172   1H5*    U  17          1H5*        U  17   3.711  18.856  -8.209
  173   2H5*    U  17          2H5*        U  17   2.326  18.927  -9.314
  174    H4*    U  17           H4*        U  17   3.002  16.349  -7.914
  175    H3*    U  17           H3*        U  17   4.852  17.720  -9.553
  176    H2*    U  17           H2*        U  17   4.356  17.151 -11.715
  177   2HO*    U  17          2HO*        U  17   5.211  15.038 -11.240
  178    H1*    U  17           H1*        U  17   1.978  15.719 -11.600
  179    H3     U  17           H3         U  17  -0.551  18.959 -13.464
  180    H5     U  17           H5         U  17   2.834  21.014 -12.050
  181    H6     U  17           H6         U  17   3.582  18.996 -11.029
  182   1H5*    U  18          1H5*        U  18   6.870  12.002  -9.311
  183   2H5*    U  18          2H5*        U  18   5.968  13.049 -10.399
  184    H4*    U  18           H4*        U  18   5.062  12.563  -7.529
  185    H3*    U  18           H3*        U  18   4.890  10.763  -9.913
  186    H2*    U  18           H2*        U  18   2.606  10.345  -9.646
  187   2HO*    U  18          2HO*        U  18   2.618   9.960  -7.416
  188    H1*    U  18           H1*        U  18   1.800  12.860  -8.890
  189    H3     U  18           H3         U  18   0.266  13.329 -13.078
  190    H5     U  18           H5         U  18   4.207  11.982 -13.659
  191    H6     U  18           H6         U  18   4.490  11.960 -11.302
  192   1H5*    G  19          1H5*        G  19   5.930   6.804  -5.425
  193   2H5*    G  19          2H5*        G  19   4.497   7.830  -5.566
  194    H4*    G  19           H4*        G  19   7.395   8.747  -5.190
  195    H3*    G  19           H3*        G  19   4.875   8.704  -3.535
  196    H2*    G  19           H2*        G  19   5.767  10.538  -2.231
  197   2HO*    G  19          2HO*        G  19   8.164   9.801  -3.076
  198    H1*    G  19           H1*        G  19   6.144  11.964  -4.468
  199    H8     G  19           H8         G  19   3.366   9.981  -5.810
  200    H1     G  19           H1         G  19   1.438  13.819  -1.032
  201   1H2     G  19          1H2         G  19   3.234  14.663   0.025
  202   2H2     G  19          2H2         G  19   4.856  14.228  -0.466
  203   1H5*    A  20          1H5*        A  20   7.413   7.370   0.553
  204   2H5*    A  20          2H5*        A  20   6.009   7.919  -0.366
  205    H4*    A  20           H4*        A  20   7.627   9.625   1.579
  206    H3*    A  20           H3*        A  20   5.077   8.036   1.690
  207    H2*    A  20           H2*        A  20   4.037   9.728   3.070
  208   2HO*    A  20          2HO*        A  20   6.068  10.199   4.213
  209    H1*    A  20           H1*        A  20   4.694  11.770   1.464
  210    H8     A  20           H8         A  20   4.646   9.196  -1.137
  211   1H6     A  20          1H6         A  20  -1.553   9.294  -0.879
  212   2H6     A  20          2H6         A  20  -0.166   8.770  -1.822
  213    H2     A  20           H2         A  20   0.009  11.255   2.774
  214   1H5*    U  21          1H5*        U  21   5.360   9.201   5.655
  215   2H5*    U  21          2H5*        U  21   5.226   7.777   6.715
  216    H4*    U  21           H4*        U  21   3.468   9.432   7.254
  217    H3*    U  21           H3*        U  21   2.477   6.939   5.851
  218    H2*    U  21           H2*        U  21   0.253   7.685   6.493
  219   2HO*    U  21          2HO*        U  21   0.841   8.815   8.477
  220    H1*    U  21           H1*        U  21   0.703  10.086   5.400
  221    H3     U  21           H3         U  21  -1.728   7.377   2.603
  222    H5     U  21           H5         U  21   2.290   6.850   1.500
  223    H6     U  21           H6         U  21   2.930   8.103   3.455
  224   1H5*    C  22          1H5*        C  22   0.366   5.550  10.190
  225   2H5*    C  22          2H5*        C  22   0.568   5.600   8.434
  226    H4*    C  22           H4*        C  22  -1.682   7.002   9.942
  227    H3*    C  22           H3*        C  22  -1.518   4.251   8.680
  228    H2*    C  22           H2*        C  22  -3.750   4.511   7.889
  229   2HO*    C  22          2HO*        C  22  -4.585   5.476   9.787
  230    H1*    C  22           H1*        C  22  -3.504   7.078   7.038
  231   1H4     C  22          1H4         C  22  -2.093   3.557   1.939
  232   2H4     C  22          2H4         C  22  -0.389   3.623   2.351
  233    H5     C  22           H5         C  22   0.431   4.599   4.453
  234    H6     C  22           H6         C  22  -0.232   5.722   6.494
  235   1H5*    A  23          1H5*        A  23  -5.555   1.692  10.473
  236   2H5*    A  23          2H5*        A  23  -4.535   1.799   9.029
  237    H4*    A  23           H4*        A  23  -7.115   3.362   9.499
  238    H3*    A  23           H3*        A  23  -6.361   0.892   7.981
  239    H2*    A  23           H2*        A  23  -7.836   1.482   6.164
  240   2HO*    A  23          2HO*        A  23  -9.492   2.508   7.447
  241    H1*    A  23           H1*        A  23  -6.809   3.917   5.895
  242    H8     A  23           H8         A  23  -3.759   2.548   7.353
  243   1H6     A  23          1H6         A  23  -2.655  -0.192   1.888
  244   2H6     A  23          2H6         A  23  -1.939   0.300   3.420
  245    H2     A  23           H2         A  23  -6.929   0.940   2.013
  246   1H5*    G  24          1H5*        G  24  -9.991   0.051   5.821
  247   2H5*    G  24          2H5*        G  24 -10.641  -1.376   6.648
  248    H4*    G  24           H4*        G  24  -9.792  -1.996   4.465
  249    H3*    G  24           H3*        G  24  -8.068  -3.026   6.732
  250    H2*    G  24           H2*        G  24  -6.906  -4.273   4.988
  251   2HO*    G  24          2HO*        G  24  -8.869  -4.690   3.744
  252    H1*    G  24           H1*        G  24  -6.697  -2.153   3.305
  253    H8     G  24           H8         G  24  -6.507  -0.588   6.699
  254    H1     G  24           H1         G  24  -1.042  -3.481   4.981
  255   1H2     G  24          1H2         G  24  -1.362  -4.655   3.126
  256   2H2     G  24          2H2         G  24  -2.951  -4.828   2.413
  257   1H5*    U  25          1H5*        U  25 -11.585  -5.270   4.404
  258   2H5*    U  25          2H5*        U  25 -11.616  -7.037   4.526
  259    H4*    U  25           H4*        U  25 -12.107  -6.098   2.240
  260    H3*    U  25           H3*        U  25  -9.780  -8.032   2.466
  261    H2*    U  25           H2*        U  25  -9.496  -7.779   0.119
  262   2HO*    U  25          2HO*        U  25 -11.707  -7.765  -0.442
  263    H1*    U  25           H1*        U  25  -9.717  -5.085   0.054
  264    H3     U  25           H3         U  25  -5.255  -4.950  -0.033
  265    H5     U  25           H5         U  25  -6.017  -7.075   3.498
  266    H6     U  25           H6         U  25  -8.367  -6.905   3.027
  267   1H5*    A  26          1H5*        A  26 -10.739 -11.501  -1.179
  268   2H5*    A  26          2H5*        A  26  -9.404 -10.602  -0.440
  269    H4*    A  26           H4*        A  26 -10.930  -9.785  -2.952
  270    H3*    A  26           H3*        A  26  -8.305 -11.114  -2.346
  271    H2*    A  26           H2*        A  26  -7.175  -9.832  -4.041
  272   2HO*    A  26          2HO*        A  26  -9.083  -9.954  -5.481
  273    H1*    A  26           H1*        A  26  -8.186  -7.450  -3.329
  274    H8     A  26           H8         A  26  -8.121  -9.165   0.001
  275   1H6     A  26          1H6         A  26  -2.037  -7.977   0.112
  276   2H6     A  26          2H6         A  26  -3.418  -8.536   1.043
  277    H2     A  26           H2         A  26  -3.512  -7.105  -3.976
  278   1H5*    U  27          1H5*        U  27  -8.122 -11.298  -6.369
  279   2H5*    U  27          2H5*        U  27  -7.734 -12.933  -6.940
  280    H4*    U  27           H4*        U  27  -6.058 -11.328  -7.714
  281    H3*    U  27           H3*        U  27  -5.016 -13.265  -5.622
  282    H2*    U  27           H2*        U  27  -2.850 -12.288  -6.080
  283   2HO*    U  27          2HO*        U  27  -3.262 -12.097  -8.370
  284    H1*    U  27           H1*        U  27  -3.707  -9.726  -5.988
  285    H3     U  27           H3         U  27  -1.423 -10.745  -2.141
  286    H5     U  27           H5         U  27  -5.429 -11.739  -1.369
  287    H6     U  27           H6         U  27  -5.911 -11.385  -3.707
  288   1H5*    A  28          1H5*        A  28  -2.423 -13.469  -9.121
  289   2H5*    A  28          2H5*        A  28  -1.939 -15.158  -9.380
  290    H4*    A  28           H4*        A  28   0.014 -13.676  -9.241
  291    H3*    A  28           H3*        A  28  -0.248 -15.639  -6.937
  292    H2*    A  28           H2*        A  28   1.923 -14.809  -6.241
  293   2HO*    A  28          2HO*        A  28   2.647 -14.590  -8.500
  294    H1*    A  28           H1*        A  28   1.274 -12.200  -6.493
  295    H8     A  28           H8         A  28  -1.963 -13.859  -5.482
  296   1H6     A  28          1H6         A  28   0.103 -13.382   0.335
  297   2H6     A  28          2H6         A  28  -1.286 -13.733  -0.680
  298    H2     A  28           H2         A  28   3.522 -12.595  -2.400
  299   1H5*    U  29          1H5*        U  29   3.650 -15.874  -8.463
  300   2H5*    U  29          2H5*        U  29   4.277 -17.531  -8.493
  301    H4*    U  29           H4*        U  29   5.721 -16.013  -7.177
  302    H3*    U  29           H3*        U  29   4.324 -18.150  -5.524
  303    H2*    U  29           H2*        U  29   5.749 -17.336  -3.720
  304   2HO*    U  29          2HO*        U  29   7.589 -16.962  -5.090
  305    H1*    U  29           H1*        U  29   5.214 -14.727  -4.190
  306    H3     U  29           H3         U  29   2.978 -16.086  -0.446
  307    H5     U  29           H5         U  29   0.397 -16.959  -3.636
  308    H6     U  29           H6         U  29   2.182 -16.434  -5.172
  309   1H5*    C  30          1H5*        C  30   8.464 -18.258  -4.743
  310   2H5*    C  30          2H5*        C  30   9.075 -19.908  -4.519
  311    H4*    C  30           H4*        C  30   9.562 -18.469  -2.564
  312    H3*    C  30           H3*        C  30   7.580 -20.716  -2.028
  313    H2*    C  30           H2*        C  30   7.802 -20.035   0.306
  314   2HO*    C  30          2HO*        C  30  10.121 -19.478  -0.076
  315    H1*    C  30           H1*        C  30   7.429 -17.407  -0.220
  316   1H4     C  30          1H4         C  30   1.608 -19.697   0.698
  317   2H4     C  30          2H4         C  30   1.395 -19.921  -1.029
  318    H5     C  30           H5         C  30   3.250 -19.652  -2.629
  319    H6     C  30           H6         C  30   5.566 -19.033  -2.846
  320   1H5*    C  31          1H5*        C  31  10.455 -20.776   0.979
  321   2H5*    C  31          2H5*        C  31  11.113 -22.413   1.186
  322    H4*    C  31           H4*        C  31  10.338 -21.572   3.353
  323    H3*    C  31           H3*        C  31   8.588 -23.732   2.122
  324    H2*    C  31           H2*        C  31   7.426 -23.761   4.240
  325   2HO*    C  31          2HO*        C  31   9.424 -23.410   5.474
  326    H1*    C  31           H1*        C  31   7.226 -21.047   4.390
  327   1H4     C  31          1H4         C  31   1.972 -23.077   1.532
  328   2H4     C  31          2H4         C  31   2.713 -22.887  -0.051
  329    H5     C  31           H5         C  31   5.088 -22.299  -0.331
  330    H6     C  31           H6         C  31   7.128 -21.785   0.845
  331    H3T    C  31           H3T        C  31  10.710 -24.363   2.645
  Start of MODEL    9
    1   1H5*    G   1          1H5*        G   1  -6.603 -22.829   6.611
    2   2H5*    G   1          2H5*        G   1  -5.723 -23.566   5.283
    3    H4*    G   1           H4*        G   1  -5.056 -23.960   8.238
    4    H3*    G   1           H3*        G   1  -3.987 -22.025   6.188
    5    H2*    G   1           H2*        G   1  -1.806 -22.268   7.212
    6   2HO*    G   1          2HO*        G   1  -2.666 -22.426   9.360
    7    H1*    G   1           H1*        G   1  -1.829 -24.918   7.194
    8    H8     G   1           H8         G   1  -3.960 -24.029   4.261
    9    H1     G   1           H1         G   1   2.325 -23.132   3.228
   10   1H2     G   1          1H2         G   1   3.369 -23.210   5.176
   11   2H2     G   1          2H2         G   1   2.459 -23.535   6.655
   12    H5T    G   1           H5T        G   1  -6.193 -25.629   6.302
   13   1H5*    G   2          1H5*        G   2  -2.391 -20.766   9.849
   14   2H5*    G   2          2H5*        G   2  -2.508 -19.012  10.009
   15    H4*    G   2           H4*        G   2  -0.220 -19.789  10.342
   16    H3*    G   2           H3*        G   2  -0.582 -18.070   7.864
   17    H2*    G   2           H2*        G   2   1.792 -18.248   7.573
   18   2HO*    G   2          2HO*        G   2   2.122 -18.147   9.895
   19    H1*    G   2           H1*        G   2   1.934 -20.893   7.900
   20    H8     G   2           H8         G   2  -1.407 -20.496   6.291
   21    H1     G   2           H1         G   2   3.491 -19.389   2.281
   22   1H2     G   2          1H2         G   2   5.321 -19.132   3.466
   23   2H2     G   2          2H2         G   2   5.311 -19.387   5.224
   24   1H5*    A   3          1H5*        A   3   2.840 -16.540   9.858
   25   2H5*    A   3          2H5*        A   3   2.663 -14.784  10.004
   26    H4*    A   3           H4*        A   3   4.796 -15.349   8.992
   27    H3*    A   3           H3*        A   3   2.848 -13.958   7.148
   28    H2*    A   3           H2*        A   3   4.678 -13.917   5.549
   29   2HO*    A   3          2HO*        A   3   6.257 -13.550   7.257
   30    H1*    A   3           H1*        A   3   5.348 -16.474   5.820
   31    H8     A   3           H8         A   3   1.661 -16.640   6.364
   32   1H6     A   3          1H6         A   3   0.451 -16.705   1.519
   33   2H6     A   3          2H6         A   3   1.295 -16.267   0.132
   34    H2     A   3           H2         A   3   5.248 -15.081   1.215
   35   1H5*    U   4          1H5*        U   4   6.573 -11.954   6.848
   36   2H5*    U   4          2H5*        U   4   6.386 -10.197   6.842
   37    H4*    U   4           H4*        U   4   7.611 -10.999   4.862
   38    H3*    U   4           H3*        U   4   4.917  -9.736   4.285
   39    H2*    U   4           H2*        U   4   5.494 -10.032   1.934
   40   2HO*    U   4          2HO*        U   4   7.743  -9.569   2.340
   41    H1*    U   4           H1*        U   4   6.226 -12.588   2.147
   42    H3     U   4           H3         U   4   2.035 -12.101   0.289
   43    H5     U   4           H5         U   4   1.379 -12.594   4.394
   44    H6     U   4           H6         U   4   3.738 -12.385   4.746
   45   1H5*    A   5          1H5*        A   5   7.746  -8.050   1.604
   46   2H5*    A   5          2H5*        A   5   7.524  -6.306   1.451
   47    H4*    A   5           H4*        A   5   7.478  -7.410  -0.730
   48    H3*    A   5           H3*        A   5   4.831  -6.150   0.088
   49    H2*    A   5           H2*        A   5   4.047  -6.781  -2.090
   50   2HO*    A   5          2HO*        A   5   6.121  -6.300  -3.074
   51    H1*    A   5           H1*        A   5   4.907  -9.297  -1.999
   52    H8     A   5           H8         A   5   4.152  -8.614   1.596
   53   1H6     A   5          1H6         A   5  -1.757  -9.650   0.059
   54   2H6     A   5          2H6         A   5  -0.618  -9.473   1.403
   55    H2     A   5           H2         A   5   0.476  -9.048  -3.656
   56   1H5*    U   6          1H5*        U   6   5.712  -4.739  -3.896
   57   2H5*    U   6          2H5*        U   6   5.202  -3.045  -3.994
   58    H4*    U   6           H4*        U   6   4.119  -4.551  -5.666
   59    H3*    U   6           H3*        U   6   2.297  -3.138  -3.714
   60    H2*    U   6           H2*        U   6   0.490  -4.111  -5.074
   61   2HO*    U   6          2HO*        U   6   1.698  -3.800  -7.030
   62    H1*    U   6           H1*        U   6   1.489  -6.594  -5.102
   63    H3     U   6           H3         U   6  -2.045  -6.391  -2.203
   64    H5     U   6           H5         U   6   1.328  -5.532   0.125
   65    H6     U   6           H6         U   6   2.644  -5.380  -1.890
   66   1H5*    A   7          1H5*        A   7   0.570  -2.638  -7.692
   67   2H5*    A   7          2H5*        A   7   0.016  -0.960  -7.815
   68    H4*    A   7           H4*        A   7  -1.807  -2.573  -8.287
   69    H3*    A   7           H3*        A   7  -2.082  -1.025  -5.728
   70    H2*    A   7           H2*        A   7  -4.355  -1.857  -5.624
   71   2HO*    A   7          2HO*        A   7  -4.433  -2.169  -8.149
   72    H1*    A   7           H1*        A   7  -3.505  -4.363  -5.878
   73    H8     A   7           H8         A   7  -0.615  -2.757  -4.161
   74   1H6     A   7          1H6         A   7  -4.074  -3.000   0.988
   75   2H6     A   7          2H6         A   7  -2.419  -2.834   0.394
   76    H2     A   7           H2         A   7  -6.693  -3.803  -2.383
   77   1H5*    U   8          1H5*        U   8  -5.768   1.824  -7.581
   78   2H5*    U   8          2H5*        U   8  -4.708   1.184  -6.346
   79    H4*    U   8           H4*        U   8  -7.609   0.337  -6.843
   80    H3*    U   8           H3*        U   8  -6.171   1.980  -4.766
   81    H2*    U   8           H2*        U   8  -7.830   1.393  -3.134
   82   2HO*    U   8          2HO*        U   8  -9.632   1.114  -4.769
   83    H1*    U   8           H1*        U   8  -7.518  -1.167  -3.613
   84    H3     U   8           H3         U   8  -5.029   0.041   0.061
   85    H5     U   8           H5         U   8  -2.418   0.247  -3.208
   86    H6     U   8           H6         U   8  -4.304  -0.058  -4.699
   87   1H5*    G   9          1H5*        G   9 -10.267   5.003  -4.399
   88   2H5*    G   9          2H5*        G   9  -8.716   4.370  -3.877
   89    H4*    G   9           H4*        G   9 -11.415   3.775  -2.595
   90    H3*    G   9           H3*        G   9  -9.133   5.656  -1.946
   91    H2*    G   9           H2*        G   9  -9.327   5.238   0.352
   92   2HO*    G   9          2HO*        G   9 -11.618   5.278   0.347
   93    H1*    G   9           H1*        G   9  -9.503   2.581   0.230
   94    H8     G   9           H8         G   9  -7.405   3.319  -2.756
   95    H1     G   9           H1         G   9  -4.104   3.749   2.729
   96   1H2     G   9          1H2         G   9  -5.481   3.814   4.415
   97   2H2     G   9          2H2         G   9  -7.221   3.609   4.147
   98   1H5*    A  10          1H5*        A  10 -10.965   9.347   0.988
   99   2H5*    A  10          2H5*        A  10  -9.431   8.558   0.701
  100    H4*    A  10           H4*        A  10 -11.404   7.932   2.942
  101    H3*    A  10           H3*        A  10  -8.812   9.360   2.568
  102    H2*    A  10           H2*        A  10  -7.923   8.632   4.663
  103   2HO*    A  10          2HO*        A  10 -10.098   8.745   5.650
  104    H1*    A  10           H1*        A  10  -8.440   6.091   4.276
  105    H8     A  10           H8         A  10  -8.229   6.916   0.688
  106   1H6     A  10          1H6         A  10  -3.319   6.772   0.369
  107   2H6     A  10          2H6         A  10  -2.071   7.015   1.488
  108    H2     A  10           H2         A  10  -3.806   7.256   5.394
  109   1H5*    U  11          1H5*        U  11  -9.350  10.506   6.436
  110   2H5*    U  11          2H5*        U  11  -9.391  12.278   6.608
  111    H4*    U  11           H4*        U  11  -7.538  11.333   7.907
  112    H3*    U  11           H3*        U  11  -6.803  13.017   5.519
  113    H2*    U  11           H2*        U  11  -4.483  12.699   6.098
  114   2HO*    U  11          2HO*        U  11  -4.958  12.871   8.362
  115    H1*    U  11           H1*        U  11  -4.589  10.077   6.554
  116    H3     U  11           H3         U  11  -2.578  10.868   2.529
  117    H5     U  11           H5         U  11  -6.632  10.375   1.647
  118    H6     U  11           H6         U  11  -7.046  10.400   4.032
  119   1H5*    A  12          1H5*        A  12  -4.191  14.223   8.912
  120   2H5*    A  12          2H5*        A  12  -4.144  15.986   8.855
  121    H4*    A  12           H4*        A  12  -1.883  14.959   8.787
  122    H3*    A  12           H3*        A  12  -2.821  16.606   6.442
  123    H2*    A  12           H2*        A  12  -0.694  16.283   5.494
  124   2HO*    A  12          2HO*        A  12   0.415  16.676   7.502
  125    H1*    A  12           H1*        A  12  -0.282  13.730   6.185
  126    H8     A  12           H8         A  12  -3.743  14.215   4.864
  127   1H6     A  12          1H6         A  12  -1.010  13.549  -0.670
  128   2H6     A  12          2H6         A  12  -2.570  13.789   0.160
  129    H2     A  12           H2         A  12   2.140  13.857   2.283
  130   1H5*    U  13          1H5*        U  13   1.252  18.105   7.992
  131   2H5*    U  13          2H5*        U  13   1.215  19.845   7.672
  132    H4*    U  13           H4*        U  13   3.187  18.745   6.677
  133    H3*    U  13           H3*        U  13   1.239  19.941   4.702
  134    H2*    U  13           H2*        U  13   2.928  19.446   3.062
  135   2HO*    U  13          2HO*        U  13   4.735  19.967   4.223
  136    H1*    U  13           H1*        U  13   3.444  16.940   3.923
  137    H3     U  13           H3         U  13   1.226  16.594  -0.016
  138    H5     U  13           H5         U  13  -1.792  17.248   2.830
  139    H6     U  13           H6         U  13  -0.096  17.780   4.430
  140   1H5*    A  14          1H5*        A  14   5.463  21.534   4.358
  141   2H5*    A  14          2H5*        A  14   5.350  23.184   3.694
  142    H4*    A  14           H4*        A  14   6.905  21.719   2.424
  143    H3*    A  14           H3*        A  14   4.491  22.736   0.922
  144    H2*    A  14           H2*        A  14   5.459  21.654  -1.012
  145   2HO*    A  14          2HO*        A  14   7.585  22.222  -0.609
  146    H1*    A  14           H1*        A  14   6.191  19.359   0.244
  147    H8     A  14           H8         A  14   2.822  20.612   1.410
  148   1H6     A  14          1H6         A  14   0.799  17.345  -3.479
  149   2H6     A  14          2H6         A  14   0.246  18.264  -2.052
  150    H2     A  14           H2         A  14   5.081  17.486  -3.744
  151   1H5*    A  15          1H5*        A  15   8.590  23.438  -0.890
  152   2H5*    A  15          2H5*        A  15   8.565  24.810  -1.984
  153    H4*    A  15           H4*        A  15   9.230  22.331  -2.755
  154    H3*    A  15           H3*        A  15   8.895  24.582  -4.196
  155    H2*    A  15           H2*        A  15   6.541  24.363  -4.175
  156   2HO*    A  15          2HO*        A  15   7.704  24.130  -6.514
  157    H1*    A  15           H1*        A  15   6.771  21.469  -5.082
  158    H8     A  15           H8         A  15   4.931  23.924  -2.876
  159   1H6     A  15          1H6         A  15  -0.104  20.798  -4.608
  160   2H6     A  15          2H6         A  15   0.495  22.191  -3.660
  161    H2     A  15           H2         A  15   3.316  18.704  -6.236
  162   1H5*    U  16          1H5*        U  16   9.155  20.396  -6.314
  163   2H5*    U  16          2H5*        U  16  10.116  20.501  -7.805
  164    H4*    U  16           H4*        U  16   8.282  18.870  -8.031
  165    H3*    U  16           H3*        U  16   7.984  21.383  -9.695
  166    H2*    U  16           H2*        U  16   6.012  20.494 -10.580
  167   2HO*    U  16          2HO*        U  16   6.952  18.417 -11.007
  168    H1*    U  16           H1*        U  16   5.217  19.078  -8.262
  169    H3     U  16           H3         U  16   1.740  21.963  -8.665
  170    H5     U  16           H5         U  16   5.070  24.500  -8.651
  171    H6     U  16           H6         U  16   6.503  22.556  -8.460
  172   1H5*    U  17          1H5*        U  17   8.672  17.022 -11.081
  173   2H5*    U  17          2H5*        U  17   9.610  17.138 -12.548
  174    H4*    U  17           H4*        U  17   7.630  16.287 -13.853
  175    H3*    U  17           H3*        U  17   6.288  16.432 -11.306
  176    H2*    U  17           H2*        U  17   6.041  14.248 -10.649
  177   2HO*    U  17          2HO*        U  17   5.131  13.678 -12.905
  178    H1*    U  17           H1*        U  17   8.085  13.002 -11.726
  179    H3     U  17           H3         U  17  11.821  14.238  -9.254
  180    H5     U  17           H5         U  17   8.649  16.409  -7.661
  181    H6     U  17           H6         U  17   7.221  15.611  -9.405
  182   1H5*    U  18          1H5*        U  18   2.570  17.131 -10.946
  183   2H5*    U  18          2H5*        U  18   4.285  17.266 -10.466
  184    H4*    U  18           H4*        U  18   2.830  17.369  -8.519
  185    H3*    U  18           H3*        U  18   4.633  15.077  -8.812
  186    H2*    U  18           H2*        U  18   3.534  13.603  -7.408
  187   2HO*    U  18          2HO*        U  18   3.341  15.351  -5.718
  188    H1*    U  18           H1*        U  18   0.944  14.286  -7.740
  189    H3     U  18           H3         U  18  -0.070  11.265 -10.947
  190    H5     U  18           H5         U  18   3.908  12.322 -11.741
  191    H6     U  18           H6         U  18   3.911  13.713  -9.949
  192   1H5*    G  19          1H5*        G  19   6.108  13.386  -4.676
  193   2H5*    G  19          2H5*        G  19   4.579  13.254  -5.554
  194    H4*    G  19           H4*        G  19   4.904  14.238  -2.696
  195    H3*    G  19           H3*        G  19   3.892  11.513  -3.673
  196    H2*    G  19           H2*        G  19   2.457  11.489  -1.972
  197   2HO*    G  19          2HO*        G  19   4.152  12.554  -0.507
  198    H1*    G  19           H1*        G  19   1.501  13.957  -2.205
  199    H8     G  19           H8         G  19   2.518  12.660  -5.587
  200    H1     G  19           H1         G  19  -3.265  10.552  -3.744
  201   1H2     G  19          1H2         G  19  -3.556  11.029  -1.497
  202   2H2     G  19          2H2         G  19  -2.258  11.847  -0.707
  203   1H5*    A  20          1H5*        A  20   7.261  11.121  -0.389
  204   2H5*    A  20          2H5*        A  20   7.563   9.442   0.117
  205    H4*    A  20           H4*        A  20   6.961  10.957   1.994
  206    H3*    A  20           H3*        A  20   5.004   8.703   1.460
  207    H2*    A  20           H2*        A  20   3.801   9.512   3.387
  208   2HO*    A  20          2HO*        A  20   5.735  10.025   4.548
  209    H1*    A  20           H1*        A  20   3.745  12.058   2.622
  210    H8     A  20           H8         A  20   3.650  10.316  -0.715
  211   1H6     A  20          1H6         A  20  -2.331   9.338   0.613
  212   2H6     A  20          2H6         A  20  -1.082   9.207  -0.645
  213    H2     A  20           H2         A  20  -0.414  10.748   4.253
  214   1H5*    U  21          1H5*        U  21   5.681   8.735   5.739
  215   2H5*    U  21          2H5*        U  21   5.766   7.057   6.301
  216    H4*    U  21           H4*        U  21   3.992   8.407   7.398
  217    H3*    U  21           H3*        U  21   3.056   5.964   5.850
  218    H2*    U  21           H2*        U  21   0.886   6.487   6.691
  219   2HO*    U  21          2HO*        U  21   1.853   7.190   8.763
  220    H1*    U  21           H1*        U  21   0.918   9.101   6.113
  221    H3     U  21           H3         U  21  -1.728   6.907   3.104
  222    H5     U  21           H5         U  21   2.148   6.799   1.452
  223    H6     U  21           H6         U  21   3.000   7.696   3.505
  224   1H5*    C  22          1H5*        C  22   1.094   5.874   9.646
  225   2H5*    C  22          2H5*        C  22   1.022   4.198  10.202
  226    H4*    C  22           H4*        C  22  -1.199   5.283   9.978
  227    H3*    C  22           H3*        C  22  -0.677   2.883   8.223
  228    H2*    C  22           H2*        C  22  -3.031   3.097   7.613
  229   2HO*    C  22          2HO*        C  22  -3.693   3.653   9.723
  230    H1*    C  22           H1*        C  22  -2.986   5.730   7.175
  231   1H4     C  22          1H4         C  22  -1.861   3.065   1.604
  232   2H4     C  22          2H4         C  22  -0.112   3.135   1.849
  233    H5     C  22           H5         C  22   0.871   3.858   4.012
  234    H6     C  22           H6         C  22   0.343   4.625   6.220
  235   1H5*    A  23          1H5*        A  23  -4.375   2.060  10.583
  236   2H5*    A  23          2H5*        A  23  -4.473   0.296  10.809
  237    H4*    A  23           H4*        A  23  -6.442   1.337   9.663
  238    H3*    A  23           H3*        A  23  -4.943  -0.713   8.045
  239    H2*    A  23           H2*        A  23  -6.713  -0.397   6.394
  240   2HO*    A  23          2HO*        A  23  -8.428  -0.042   7.944
  241    H1*    A  23           H1*        A  23  -6.430   2.217   6.303
  242    H8     A  23           H8         A  23  -2.958   1.209   7.209
  243   1H6     A  23          1H6         A  23  -2.342  -0.204   1.218
  244   2H6     A  23          2H6         A  23  -1.498   0.004   2.774
  245    H2     A  23           H2         A  23  -6.639   0.061   2.106
  246   1H5*    G  24          1H5*        G  24  -8.256  -1.723   5.862
  247   2H5*    G  24          2H5*        G  24  -8.870  -3.293   6.370
  248    H4*    G  24           H4*        G  24  -8.104  -3.368   4.062
  249    H3*    G  24           H3*        G  24  -6.734  -5.029   6.125
  250    H2*    G  24           H2*        G  24  -5.025  -5.672   4.711
  251   2HO*    G  24          2HO*        G  24  -6.462  -6.454   3.154
  252    H1*    G  24           H1*        G  24  -4.926  -3.485   2.964
  253    H8     G  24           H8         G  24  -4.783  -1.995   6.313
  254    H1     G  24           H1         G  24   0.657  -5.162   4.920
  255   1H2     G  24          1H2         G  24   0.374  -6.303   3.040
  256   2H2     G  24          2H2         G  24  -1.131  -6.213   2.163
  257   1H5*    U  25          1H5*        U  25  -9.051  -8.970   2.675
  258   2H5*    U  25          2H5*        U  25  -8.885  -7.258   2.326
  259    H4*    U  25           H4*        U  25 -11.547  -8.530   2.963
  260    H3*    U  25           H3*        U  25 -10.295  -9.336   0.749
  261    H2*    U  25           H2*        U  25  -9.617  -7.339  -0.126
  262   2HO*    U  25          2HO*        U  25 -11.584  -8.121  -1.520
  263    H1*    U  25           H1*        U  25 -11.939  -5.752   0.380
  264    H3     U  25           H3         U  25  -9.928  -1.811   1.448
  265    H5     U  25           H5         U  25  -6.764  -4.431   0.755
  266    H6     U  25           H6         U  25  -8.295  -6.250   0.711
  267   1H5*    A  26          1H5*        A  26 -11.124 -11.539  -2.471
  268   2H5*    A  26          2H5*        A  26 -10.056 -10.512  -1.536
  269    H4*    A  26           H4*        A  26 -11.172  -9.895  -4.311
  270    H3*    A  26           H3*        A  26  -8.556 -10.962  -3.304
  271    H2*    A  26           H2*        A  26  -7.310  -9.593  -4.835
  272   2HO*    A  26          2HO*        A  26  -9.045  -9.940  -6.482
  273    H1*    A  26           H1*        A  26  -8.608  -7.307  -4.400
  274    H8     A  26           H8         A  26  -8.946  -8.915  -1.099
  275   1H6     A  26          1H6         A  26  -3.161  -6.997   0.034
  276   2H6     A  26          2H6         A  26  -4.650  -7.642   0.742
  277    H2     A  26           H2         A  26  -3.850  -6.599  -4.269
  278   1H5*    U  27          1H5*        U  27  -7.878 -11.013  -7.364
  279   2H5*    U  27          2H5*        U  27  -7.233 -12.571  -7.891
  280    H4*    U  27           H4*        U  27  -5.727 -10.745  -8.478
  281    H3*    U  27           H3*        U  27  -4.592 -12.634  -6.392
  282    H2*    U  27           H2*        U  27  -2.561 -11.356  -6.609
  283   2HO*    U  27          2HO*        U  27  -2.863 -11.127  -8.905
  284    H1*    U  27           H1*        U  27  -3.711  -8.944  -6.441
  285    H3     U  27           H3         U  27  -1.637 -10.042  -2.471
  286    H5     U  27           H5         U  27  -5.567 -11.424  -2.087
  287    H6     U  27           H6         U  27  -5.914 -10.968  -4.426
  288   1H5*    A  28          1H5*        A  28  -1.621 -12.428  -9.541
  289   2H5*    A  28          2H5*        A  28  -0.983 -14.060  -9.801
  290    H4*    A  28           H4*        A  28   0.811 -12.485  -9.365
  291    H3*    A  28           H3*        A  28   0.458 -14.541  -7.162
  292    H2*    A  28           H2*        A  28   2.427 -13.550  -6.182
  293   2HO*    A  28          2HO*        A  28   3.371 -13.195  -8.337
  294    H1*    A  28           H1*        A  28   1.596 -11.021  -6.381
  295    H8     A  28           H8         A  28  -1.608 -12.894  -5.884
  296   1H6     A  28          1H6         A  28  -0.143 -12.744   0.144
  297   2H6     A  28          2H6         A  28  -1.422 -12.974  -1.026
  298    H2     A  28           H2         A  28   3.510 -11.835  -2.128
  299   1H5*    U  29          1H5*        U  29   4.545 -14.399  -8.091
  300   2H5*    U  29          2H5*        U  29   5.264 -16.011  -8.157
  301    H4*    U  29           H4*        U  29   6.444 -14.542  -6.584
  302    H3*    U  29           H3*        U  29   5.022 -16.888  -5.266
  303    H2*    U  29           H2*        U  29   6.139 -16.108  -3.234
  304   2HO*    U  29          2HO*        U  29   8.029 -15.463  -4.513
  305    H1*    U  29           H1*        U  29   5.357 -13.576  -3.482
  306    H3     U  29           H3         U  29   2.705 -15.820  -0.434
  307    H5     U  29           H5         U  29   0.759 -16.212  -4.149
  308    H6     U  29           H6         U  29   2.665 -15.247  -5.214
  309   1H5*    C  30          1H5*        C  30   8.992 -16.773  -3.861
  310   2H5*    C  30          2H5*        C  30   9.726 -18.380  -3.826
  311    H4*    C  30           H4*        C  30   9.856 -17.270  -1.643
  312    H3*    C  30           H3*        C  30   8.082 -19.749  -1.667
  313    H2*    C  30           H2*        C  30   7.886 -19.401   0.712
  314   2HO*    C  30          2HO*        C  30  10.163 -18.546   0.675
  315    H1*    C  30           H1*        C  30   7.275 -16.801   0.569
  316   1H4     C  30          1H4         C  30   1.754 -19.651   0.116
  317   2H4     C  30          2H4         C  30   1.714 -19.442  -1.648
  318    H5     C  30           H5         C  30   3.716 -18.779  -2.869
  319    H6     C  30           H6         C  30   5.951 -17.955  -2.591
  320   1H5*    C  31          1H5*        C  31  10.405 -20.027   1.711
  321   2H5*    C  31          2H5*        C  31  11.244 -21.576   1.744
  322    H4*    C  31           H4*        C  31  10.051 -21.306   3.823
  323    H3*    C  31           H3*        C  31   8.720 -23.309   1.951
  324    H2*    C  31           H2*        C  31   7.310 -23.872   3.794
  325   2HO*    C  31          2HO*        C  31   9.162 -23.579   5.319
  326    H1*    C  31           H1*        C  31   6.801 -21.286   4.473
  327   1H4     C  31          1H4         C  31   2.151 -22.933   0.695
  328   2H4     C  31          2H4         C  31   3.039 -22.447  -0.760
  329    H5     C  31           H5         C  31   5.380 -21.759  -0.672
  330    H6     C  31           H6         C  31   7.218 -21.308   0.810
  331    H3T    C  31           H3T        C  31  10.811 -23.872   2.619
  Start of MODEL   10
    1   1H5*    G   1          1H5*        G   1  -5.902 -26.493   6.575
    2   2H5*    G   1          2H5*        G   1  -6.085 -24.832   7.172
    3    H4*    G   1           H4*        G   1  -4.217 -25.840   8.323
    4    H3*    G   1           H3*        G   1  -3.394 -23.829   6.215
    5    H2*    G   1           H2*        G   1  -1.134 -24.100   7.045
    6   2HO*    G   1          2HO*        G   1  -1.776 -24.301   9.283
    7    H1*    G   1           H1*        G   1  -1.210 -26.789   7.019
    8    H8     G   1           H8         G   1  -3.467 -26.012   4.156
    9    H1     G   1           H1         G   1   2.686 -24.741   2.870
   10   1H2     G   1          1H2         G   1   3.866 -24.773   4.757
   11   2H2     G   1          2H2         G   1   3.114 -25.126   6.302
   12    H5T    G   1           H5T        G   1  -5.041 -24.088   5.320
   13   1H5*    G   2          1H5*        G   2  -1.508 -22.617   9.764
   14   2H5*    G   2          2H5*        G   2  -1.665 -20.868   9.996
   15    H4*    G   2           H4*        G   2   0.680 -21.581  10.126
   16    H3*    G   2           H3*        G   2   0.004 -19.844   7.739
   17    H2*    G   2           H2*        G   2   2.391 -19.870   7.266
   18   2HO*    G   2          2HO*        G   2   2.948 -19.791   9.556
   19    H1*    G   2           H1*        G   2   2.675 -22.537   7.564
   20    H8     G   2           H8         G   2  -0.780 -22.317   6.172
   21    H1     G   2           H1         G   2   3.732 -20.879   1.840
   22   1H2     G   2          1H2         G   2   5.686 -20.593   2.857
   23   2H2     G   2          2H2         G   2   5.861 -20.812   4.591
   24   1H5*    A   3          1H5*        A   3   3.519 -18.252   9.577
   25   2H5*    A   3          2H5*        A   3   3.373 -16.494   9.770
   26    H4*    A   3           H4*        A   3   5.464 -17.096   8.617
   27    H3*    A   3           H3*        A   3   3.417 -15.598   6.969
   28    H2*    A   3           H2*        A   3   5.109 -15.546   5.212
   29   2HO*    A   3          2HO*        A   3   6.877 -15.237   6.727
   30    H1*    A   3           H1*        A   3   5.769 -18.149   5.408
   31    H8     A   3           H8         A   3   2.124 -18.240   6.209
   32   1H6     A   3          1H6         A   3   1.108 -17.807   0.116
   33   2H6     A   3          2H6         A   3   0.410 -18.204   1.673
   34    H2     A   3           H2         A   3   5.345 -16.687   0.882
   35   1H5*    U   4          1H5*        U   4   7.189 -13.725   6.539
   36   2H5*    U   4          2H5*        U   4   7.096 -11.956   6.504
   37    H4*    U   4           H4*        U   4   8.173 -12.908   4.463
   38    H3*    U   4           H3*        U   4   5.545 -11.456   4.058
   39    H2*    U   4           H2*        U   4   5.998 -11.744   1.665
   40   2HO*    U   4          2HO*        U   4   8.340 -11.480   2.000
   41    H1*    U   4           H1*        U   4   6.574 -14.372   1.883
   42    H3     U   4           H3         U   4   2.378 -13.639   0.136
   43    H5     U   4           H5         U   4   1.836 -14.049   4.282
   44    H6     U   4           H6         U   4   4.225 -13.974   4.548
   45   1H5*    A   5          1H5*        A   5   8.243 -10.063   1.206
   46   2H5*    A   5          2H5*        A   5   8.193  -8.302   1.035
   47    H4*    A   5           H4*        A   5   7.892  -9.442  -1.134
   48    H3*    A   5           H3*        A   5   5.496  -7.887  -0.124
   49    H2*    A   5           H2*        A   5   4.455  -8.416  -2.246
   50   2HO*    A   5          2HO*        A   5   6.489  -8.200  -3.427
   51    H1*    A   5           H1*        A   5   5.077 -11.043  -2.191
   52    H8     A   5           H8         A   5   4.635 -10.310   1.438
   53   1H6     A   5          1H6         A   5  -1.474 -10.576   0.448
   54   2H6     A   5          2H6         A   5  -0.216 -10.570   1.674
   55    H2     A   5           H2         A   5   0.534 -10.221  -3.490
   56   1H5*    U   6          1H5*        U   6   6.181  -6.745  -4.171
   57   2H5*    U   6          2H5*        U   6   5.891  -5.007  -4.381
   58    H4*    U   6           H4*        U   6   4.472  -6.457  -5.852
   59    H3*    U   6           H3*        U   6   3.050  -4.695  -3.841
   60    H2*    U   6           H2*        U   6   1.003  -5.447  -4.953
   61   2HO*    U   6          2HO*        U   6   2.045  -5.399  -7.069
   62    H1*    U   6           H1*        U   6   1.704  -8.069  -5.006
   63    H3     U   6           H3         U   6  -1.548  -7.313  -1.858
   64    H5     U   6           H5         U   6   2.109  -6.809   0.146
   65    H6     U   6           H6         U   6   3.236  -6.906  -1.979
   66   1H5*    A   7          1H5*        A   7   1.153  -4.150  -7.693
   67   2H5*    A   7          2H5*        A   7   0.741  -2.437  -7.898
   68    H4*    A   7           H4*        A   7  -1.222  -3.942  -8.153
   69    H3*    A   7           H3*        A   7  -1.266  -1.981  -5.853
   70    H2*    A   7           H2*        A   7  -3.525  -2.780  -5.411
   71   2HO*    A   7          2HO*        A   7  -3.929  -2.963  -7.767
   72    H1*    A   7           H1*        A   7  -2.939  -5.410  -5.650
   73    H8     A   7           H8         A   7   0.143  -3.938  -4.096
   74   1H6     A   7          1H6         A   7  -2.896  -4.333   1.290
   75   2H6     A   7          2H6         A   7  -1.326  -4.100   0.535
   76    H2     A   7           H2         A   7  -5.853  -4.775  -1.992
   77   1H5*    U   8          1H5*        U   8  -5.154  -1.815  -7.540
   78   2H5*    U   8          2H5*        U   8  -5.661  -0.126  -7.713
   79    H4*    U   8           H4*        U   8  -7.218  -1.515  -6.330
   80    H3*    U   8           H3*        U   8  -5.894   0.880  -5.042
   81    H2*    U   8           H2*        U   8  -7.282   0.417  -3.102
   82   2HO*    U   8          2HO*        U   8  -9.126  -0.256  -4.376
   83    H1*    U   8           H1*        U   8  -6.733  -2.221  -3.018
   84    H3     U   8           H3         U   8  -4.313   0.204   0.111
   85    H5     U   8           H5         U   8  -1.823  -0.273  -3.235
   86    H6     U   8           H6         U   8  -3.722  -1.105  -4.447
   87   1H5*    G   9          1H5*        G   9 -10.034   1.068  -4.028
   88   2H5*    G   9          2H5*        G   9 -10.606   2.716  -4.339
   89    H4*    G   9           H4*        G   9 -11.130   1.990  -2.046
   90    H3*    G   9           H3*        G   9  -9.184   4.300  -2.330
   91    H2*    G   9           H2*        G   9  -9.203   4.479   0.045
   92   2HO*    G   9          2HO*        G   9 -11.469   4.152   0.265
   93    H1*    G   9           H1*        G   9  -9.032   1.821   0.573
   94    H8     G   9           H8         G   9  -6.902   2.294  -2.513
   95    H1     G   9           H1         G   9  -4.054   4.270   2.890
   96   1H2     G   9          1H2         G   9  -5.542   4.426   4.526
   97   2H2     G   9          2H2         G   9  -7.213   3.943   4.296
   98   1H5*    A  10          1H5*        A  10 -11.476   8.147   0.125
   99   2H5*    A  10          2H5*        A  10  -9.855   7.495  -0.158
  100    H4*    A  10           H4*        A  10 -11.589   6.970   2.299
  101    H3*    A  10           H3*        A  10  -9.296   8.766   1.562
  102    H2*    A  10           H2*        A  10  -8.269   8.453   3.727
  103   2HO*    A  10          2HO*        A  10 -10.331   8.368   4.864
  104    H1*    A  10           H1*        A  10  -8.394   5.791   3.657
  105    H8     A  10           H8         A  10  -8.296   6.290  -0.006
  106   1H6     A  10          1H6         A  10  -2.229   7.459   0.567
  107   2H6     A  10          2H6         A  10  -3.531   7.098  -0.557
  108    H2     A  10           H2         A  10  -4.063   7.696   4.611
  109   1H5*    U  11          1H5*        U  11  -9.985   9.980   5.443
  110   2H5*    U  11          2H5*        U  11 -10.304  11.732   5.468
  111    H4*    U  11           H4*        U  11  -8.417  11.219   6.970
  112    H3*    U  11           H3*        U  11  -7.660  12.530   4.351
  113    H2*    U  11           H2*        U  11  -5.492  12.940   5.337
  114   2HO*    U  11          2HO*        U  11  -6.228  13.136   7.591
  115    H1*    U  11           H1*        U  11  -5.279  10.344   6.028
  116    H3     U  11           H3         U  11  -2.853  11.234   2.261
  117    H5     U  11           H5         U  11  -6.673  10.144   0.886
  118    H6     U  11           H6         U  11  -7.433  10.187   3.166
  119   1H5*    A  12          1H5*        A  12  -6.874  16.719   6.796
  120   2H5*    A  12          2H5*        A  12  -6.499  15.507   5.558
  121    H4*    A  12           H4*        A  12  -4.588  16.340   7.791
  122    H3*    A  12           H3*        A  12  -4.879  17.184   4.892
  123    H2*    A  12           H2*        A  12  -2.509  17.418   4.841
  124   2HO*    A  12          2HO*        A  12  -2.469  18.502   6.940
  125    H1*    A  12           H1*        A  12  -1.965  15.240   6.441
  126    H8     A  12           H8         A  12  -4.451  14.294   3.802
  127   1H6     A  12          1H6         A  12   0.492  13.798   0.019
  128   2H6     A  12          2H6         A  12  -1.233  13.497   0.136
  129    H2     A  12           H2         A  12   1.824  15.603   3.801
  130   1H5*    U  13          1H5*        U  13  -2.181  20.107   7.000
  131   2H5*    U  13          2H5*        U  13  -2.581  21.701   6.331
  132    H4*    U  13           H4*        U  13  -0.150  21.224   6.165
  133    H3*    U  13           H3*        U  13  -1.688  21.426   3.568
  134    H2*    U  13           H2*        U  13   0.458  21.266   2.463
  135   2HO*    U  13          2HO*        U  13   1.634  22.592   3.882
  136    H1*    U  13           H1*        U  13   1.443  19.286   4.064
  137    H3     U  13           H3         U  13   0.699  17.499  -0.059
  138    H5     U  13           H5         U  13  -3.028  17.377   1.890
  139    H6     U  13           H6         U  13  -2.101  18.788   3.605
  140   1H5*    A  14          1H5*        A  14   1.912  24.126   3.901
  141   2H5*    A  14          2H5*        A  14   1.636  25.602   2.957
  142    H4*    A  14           H4*        A  14   3.792  24.346   2.425
  143    H3*    A  14           H3*        A  14   1.756  24.923   0.273
  144    H2*    A  14           H2*        A  14   3.223  23.893  -1.285
  145   2HO*    A  14          2HO*        A  14   5.181  24.812  -0.684
  146    H1*    A  14           H1*        A  14   4.136  21.879   0.356
  147    H8     A  14           H8         A  14   0.408  22.065   0.651
  148   1H6     A  14          1H6         A  14   0.255  19.295  -4.930
  149   2H6     A  14          2H6         A  14  -0.732  19.758  -3.547
  150    H2     A  14           H2         A  14   4.395  20.581  -4.132
  151   1H5*    A  15          1H5*        A  15   6.094  26.094  -0.358
  152   2H5*    A  15          2H5*        A  15   6.206  27.620  -1.238
  153    H4*    A  15           H4*        A  15   7.665  25.569  -1.970
  154    H3*    A  15           H3*        A  15   7.016  27.835  -3.303
  155    H2*    A  15           H2*        A  15   4.921  26.951  -4.092
  156   2HO*    A  15          2HO*        A  15   6.691  27.484  -5.902
  157    H1*    A  15           H1*        A  15   6.486  24.484  -4.881
  158    H8     A  15           H8         A  15   3.199  25.235  -3.068
  159   1H6     A  15          1H6         A  15   0.659  21.784  -7.632
  160   2H6     A  15          2H6         A  15   0.285  22.638  -6.137
  161    H2     A  15           H2         A  15   4.975  22.234  -8.421
  162   1H5*    U  16          1H5*        U  16   7.813  26.242  -7.449
  163   2H5*    U  16          2H5*        U  16   8.105  24.780  -6.506
  164    H4*    U  16           H4*        U  16   9.670  25.699  -8.960
  165    H3*    U  16           H3*        U  16   7.108  24.612  -8.829
  166    H2*    U  16           H2*        U  16   7.349  22.332  -8.530
  167   2HO*    U  16          2HO*        U  16   8.022  22.457 -10.875
  168    H1*    U  16           H1*        U  16  10.048  21.833  -8.424
  169    H3     U  16           H3         U  16  10.746  21.220  -3.976
  170    H5     U  16           H5         U  16   6.709  22.306  -4.341
  171    H6     U  16           H6         U  16   7.119  22.814  -6.657
  172   1H5*    U  17          1H5*        U  17   4.905  23.092 -10.777
  173   2H5*    U  17          2H5*        U  17   6.258  22.096 -10.255
  174    H4*    U  17           H4*        U  17   4.698  21.666 -12.834
  175    H3*    U  17           H3*        U  17   4.201  20.921 -10.045
  176    H2*    U  17           H2*        U  17   4.307  18.558 -10.280
  177   2HO*    U  17          2HO*        U  17   2.889  18.544 -12.140
  178    H1*    U  17           H1*        U  17   6.196  18.282 -12.108
  179    H3     U  17           H3         U  17   9.778  17.894  -9.473
  180    H5     U  17           H5         U  17   7.146  20.230  -7.183
  181    H6     U  17           H6         U  17   5.680  20.319  -9.043
  182   1H5*    U  18          1H5*        U  18   3.494  19.771  -8.728
  183   2H5*    U  18          2H5*        U  18   2.622  18.382  -9.402
  184    H4*    U  18           H4*        U  18   2.005  19.666  -6.716
  185    H3*    U  18           H3*        U  18   4.018  17.769  -7.730
  186    H2*    U  18           H2*        U  18   3.364  15.822  -6.528
  187   2HO*    U  18          2HO*        U  18   2.923  17.071  -4.543
  188    H1*    U  18           H1*        U  18   0.737  15.977  -6.918
  189    H3     U  18           H3         U  18   0.084  15.229 -11.392
  190    H5     U  18           H5         U  18   4.244  15.320 -10.878
  191    H6     U  18           H6         U  18   3.918  16.125  -8.653
  192   1H5*    G  19          1H5*        G  19   5.885  15.433  -3.597
  193   2H5*    G  19          2H5*        G  19   4.451  15.266  -4.630
  194    H4*    G  19           H4*        G  19   4.396  15.983  -1.666
  195    H3*    G  19           H3*        G  19   3.949  13.311  -3.043
  196    H2*    G  19           H2*        G  19   2.232  12.853  -1.495
  197   2HO*    G  19          2HO*        G  19   3.476  14.009   0.269
  198    H1*    G  19           H1*        G  19   0.964  15.172  -1.736
  199    H8     G  19           H8         G  19   2.729  14.354  -5.007
  200    H1     G  19           H1         G  19  -2.814  11.233  -4.195
  201   1H2     G  19          1H2         G  19  -3.618  11.642  -2.148
  202   2H2     G  19          2H2         G  19  -2.773  12.680  -1.031
  203   1H5*    A  20          1H5*        A  20   7.010  10.196   0.357
  204   2H5*    A  20          2H5*        A  20   5.411  10.651  -0.236
  205    H4*    A  20           H4*        A  20   6.828  11.832   2.207
  206    H3*    A  20           H3*        A  20   4.547   9.923   1.723
  207    H2*    A  20           H2*        A  20   3.564  10.617   3.818
  208   2HO*    A  20          2HO*        A  20   5.706  11.237   4.843
  209    H1*    A  20           H1*        A  20   3.556  13.147   3.005
  210    H8     A  20           H8         A  20   3.622  11.630  -0.371
  211   1H6     A  20          1H6         A  20  -2.310  10.066   0.427
  212   2H6     A  20          2H6         A  20  -0.971  10.123  -0.703
  213    H2     A  20           H2         A  20  -0.712  11.404   4.359
  214   1H5*    U  21          1H5*        U  21   5.632   7.499   6.083
  215   2H5*    U  21          2H5*        U  21   4.667   7.876   4.646
  216    H4*    U  21           H4*        U  21   4.136   8.958   7.451
  217    H3*    U  21           H3*        U  21   2.971   6.669   5.855
  218    H2*    U  21           H2*        U  21   0.798   7.188   6.820
  219   2HO*    U  21          2HO*        U  21   1.728   7.760   8.905
  220    H1*    U  21           H1*        U  21   0.927   9.825   6.306
  221    H3     U  21           H3         U  21  -1.627   7.633   3.130
  222    H5     U  21           H5         U  21   2.252   7.945   1.541
  223    H6     U  21           H6         U  21   3.024   8.684   3.695
  224   1H5*    C  22          1H5*        C  22   1.141   6.131   9.703
  225   2H5*    C  22          2H5*        C  22   1.184   4.401  10.097
  226    H4*    C  22           H4*        C  22  -1.136   5.272  10.085
  227    H3*    C  22           H3*        C  22  -0.522   3.446   7.756
  228    H2*    C  22           H2*        C  22  -2.957   3.398   7.460
  229   2HO*    C  22          2HO*        C  22  -3.522   3.710   9.746
  230    H1*    C  22           H1*        C  22  -3.011   6.077   7.409
  231   1H4     C  22          1H4         C  22  -1.591   4.187   1.503
  232   2H4     C  22          2H4         C  22   0.120   4.364   1.839
  233    H5     C  22           H5         C  22   0.974   4.870   4.084
  234    H6     C  22           H6         C  22   0.335   5.325   6.365
  235   1H5*    A  23          1H5*        A  23  -3.615   0.029  10.310
  236   2H5*    A  23          2H5*        A  23  -2.876   0.669   8.831
  237    H4*    A  23           H4*        A  23  -5.790   1.034   9.662
  238    H3*    A  23           H3*        A  23  -4.442  -0.821   7.693
  239    H2*    A  23           H2*        A  23  -6.356  -0.591   6.237
  240   2HO*    A  23          2HO*        A  23  -7.970  -0.431   7.896
  241    H1*    A  23           H1*        A  23  -6.274   2.071   6.243
  242    H8     A  23           H8         A  23  -2.704   1.550   7.051
  243   1H6     A  23          1H6         A  23  -1.792   0.043   1.120
  244   2H6     A  23          2H6         A  23  -1.015   0.440   2.648
  245    H2     A  23           H2         A  23  -6.171  -0.050   1.903
  246   1H5*    G  24          1H5*        G  24  -7.553  -2.344   5.672
  247   2H5*    G  24          2H5*        G  24  -7.835  -3.997   6.242
  248    H4*    G  24           H4*        G  24  -7.040  -4.025   3.950
  249    H3*    G  24           H3*        G  24  -5.139  -5.136   6.009
  250    H2*    G  24           H2*        G  24  -3.639  -5.683   4.245
  251   2HO*    G  24          2HO*        G  24  -5.168  -6.574   2.844
  252    H1*    G  24           H1*        G  24  -4.043  -3.408   2.731
  253    H8     G  24           H8         G  24  -3.876  -1.818   5.990
  254    H1     G  24           H1         G  24   1.710  -4.679   4.635
  255   1H2     G  24          1H2         G  24   1.449  -6.065   2.905
  256   2H2     G  24          2H2         G  24  -0.091  -6.254   2.101
  257   1H5*    U  25          1H5*        U  25  -7.115  -9.794   3.130
  258   2H5*    U  25          2H5*        U  25  -7.482  -8.102   2.783
  259    H4*    U  25           H4*        U  25  -9.436 -10.026   4.112
  260    H3*    U  25           H3*        U  25  -8.697 -10.380   1.583
  261    H2*    U  25           H2*        U  25  -8.645  -8.128   0.902
  262   2HO*    U  25          2HO*        U  25 -10.582  -9.468  -0.183
  263    H1*    U  25           H1*        U  25 -11.307  -7.560   2.065
  264    H3     U  25           H3         U  25 -10.843  -3.105   2.574
  265    H5     U  25           H5         U  25  -7.012  -4.410   1.434
  266    H6     U  25           H6         U  25  -7.755  -6.641   1.615
  267   1H5*    A  26          1H5*        A  26 -10.184 -12.643  -1.632
  268   2H5*    A  26          2H5*        A  26  -8.954 -11.636  -0.870
  269    H4*    A  26           H4*        A  26 -10.798 -10.826  -3.166
  270    H3*    A  26           H3*        A  26  -7.958 -11.725  -2.860
  271    H2*    A  26           H2*        A  26  -7.125 -10.087  -4.401
  272   2HO*    A  26          2HO*        A  26  -9.048 -10.332  -5.802
  273    H1*    A  26           H1*        A  26  -8.445  -7.993  -3.343
  274    H8     A  26           H8         A  26  -8.204  -9.995  -0.291
  275   1H6     A  26          1H6         A  26  -2.333  -8.098   0.257
  276   2H6     A  26          2H6         A  26  -3.694  -8.827   1.088
  277    H2     A  26           H2         A  26  -3.629  -7.349  -3.921
  278   1H5*    U  27          1H5*        U  27  -7.803 -11.698  -6.855
  279   2H5*    U  27          2H5*        U  27  -7.313 -13.281  -7.497
  280    H4*    U  27           H4*        U  27  -5.715 -11.560  -8.178
  281    H3*    U  27           H3*        U  27  -4.625 -13.522  -6.133
  282    H2*    U  27           H2*        U  27  -2.500 -12.409  -6.457
  283   2HO*    U  27          2HO*        U  27  -2.879 -12.113  -8.761
  284    H1*    U  27           H1*        U  27  -3.502  -9.905  -6.226
  285    H3     U  27           H3         U  27  -1.355 -11.346  -2.377
  286    H5     U  27           H5         U  27  -5.431 -12.181  -1.842
  287    H6     U  27           H6         U  27  -5.798 -11.629  -4.161
  288   1H5*    A  28          1H5*        A  28  -1.823 -13.473  -9.469
  289   2H5*    A  28          2H5*        A  28  -1.311 -15.139  -9.800
  290    H4*    A  28           H4*        A  28   0.621 -13.660  -9.468
  291    H3*    A  28           H3*        A  28   0.236 -15.748  -7.302
  292    H2*    A  28           H2*        A  28   2.364 -14.953  -6.432
  293   2HO*    A  28          2HO*        A  28   3.263 -14.618  -8.582
  294    H1*    A  28           H1*        A  28   1.718 -12.337  -6.577
  295    H8     A  28           H8         A  28  -1.582 -13.976  -5.826
  296   1H6     A  28          1H6         A  28   0.257 -14.156   0.088
  297   2H6     A  28          2H6         A  28  -1.104 -14.313  -1.002
  298    H2     A  28           H2         A  28   3.810 -13.236  -2.428
  299   1H5*    U  29          1H5*        U  29   4.237 -15.905  -8.680
  300   2H5*    U  29          2H5*        U  29   4.876 -17.557  -8.769
  301    H4*    U  29           H4*        U  29   6.253 -16.080  -7.316
  302    H3*    U  29           H3*        U  29   4.839 -18.353  -5.881
  303    H2*    U  29           H2*        U  29   6.149 -17.641  -3.945
  304   2HO*    U  29          2HO*        U  29   8.004 -17.049  -5.319
  305    H1*    U  29           H1*        U  29   5.488 -15.037  -4.207
  306    H3     U  29           H3         U  29   3.078 -17.070  -0.866
  307    H5     U  29           H5         U  29   0.772 -17.526  -4.345
  308    H6     U  29           H6         U  29   2.623 -16.668  -5.620
  309   1H5*    C  30          1H5*        C  30   8.835 -18.341  -4.699
  310   2H5*    C  30          2H5*        C  30   9.542 -19.968  -4.676
  311    H4*    C  30           H4*        C  30   9.810 -18.798  -2.504
  312    H3*    C  30           H3*        C  30   8.026 -21.260  -2.465
  313    H2*    C  30           H2*        C  30   7.989 -20.945  -0.055
  314   2HO*    C  30          2HO*        C  30  10.271 -20.129  -0.134
  315    H1*    C  30           H1*        C  30   7.421 -18.306  -0.183
  316   1H4     C  30          1H4         C  30   1.791 -21.194  -0.235
  317   2H4     C  30          2H4         C  30   1.692 -20.986  -1.980
  318    H5     C  30           H5         C  30   3.606 -20.216  -3.316
  319    H6     C  30           H6         C  30   5.876 -19.416  -3.198
  320   1H5*    C  31          1H5*        C  31  10.572 -21.566   0.766
  321   2H5*    C  31          2H5*        C  31  11.414 -23.130   0.745
  322    H4*    C  31           H4*        C  31  10.365 -22.849   2.922
  323    H3*    C  31           H3*        C  31   8.919 -24.831   1.122
  324    H2*    C  31           H2*        C  31   7.643 -25.397   3.096
  325   2HO*    C  31          2HO*        C  31   9.539 -25.148   4.518
  326    H1*    C  31           H1*        C  31   7.202 -22.792   3.786
  327   1H4     C  31          1H4         C  31   2.262 -24.530   0.260
  328   2H4     C  31          2H4         C  31   3.065 -23.991  -1.207
  329    H5     C  31           H5         C  31   5.413 -23.236  -1.221
  330    H6     C  31           H6         C  31   7.348 -22.823   0.159
  331    H3T    C  31           H3T        C  31  11.056 -25.391   1.665
  Start of MODEL   11
    1   1H5*    G   1          1H5*        G   1  -8.074 -18.700  11.446
    2   2H5*    G   1          2H5*        G   1  -8.030 -20.014  10.257
    3    H4*    G   1           H4*        G   1  -6.552 -20.085  12.925
    4    H3*    G   1           H3*        G   1  -5.717 -19.106  10.192
    5    H2*    G   1           H2*        G   1  -3.503 -19.985  10.639
    6   2HO*    G   1          2HO*        G   1  -3.533 -19.413  12.907
    7    H1*    G   1           H1*        G   1  -4.380 -22.392  11.443
    8    H8     G   1           H8         G   1  -7.007 -21.310   8.998
    9    H1     G   1           H1         G   1  -1.531 -23.120   6.187
   10   1H2     G   1          1H2         G   1   0.072 -23.290   7.721
   11   2H2     G   1          2H2         G   1  -0.253 -22.988   9.418
   12    H5T    G   1           H5T        G   1  -9.825 -20.155  11.692
   13   1H5*    G   2          1H5*        G   2  -2.632 -17.978  12.764
   14   2H5*    G   2          2H5*        G   2  -2.105 -16.316  12.457
   15    H4*    G   2           H4*        G   2  -0.222 -17.896  12.372
   16    H3*    G   2           H3*        G   2  -0.905 -16.589   9.717
   17    H2*    G   2           H2*        G   2   1.062 -17.708   8.858
   18   2HO*    G   2          2HO*        G   2   2.255 -17.373  10.867
   19    H1*    G   2           H1*        G   2   0.468 -20.119   9.917
   20    H8     G   2           H8         G   2  -2.927 -18.750   9.151
   21    H1     G   2           H1         G   2   0.379 -20.351   3.892
   22   1H2     G   2          1H2         G   2   2.511 -20.696   4.426
   23   2H2     G   2          2H2         G   2   3.067 -20.597   6.092
   24   1H5*    A   3          1H5*        A   3   3.307 -16.237  10.233
   25   2H5*    A   3          2H5*        A   3   3.799 -14.561   9.916
   26    H4*    A   3           H4*        A   3   5.141 -16.146   8.599
   27    H3*    A   3           H3*        A   3   3.273 -14.377   7.000
   28    H2*    A   3           H2*        A   3   4.335 -15.343   5.031
   29   2HO*    A   3          2HO*        A   3   6.456 -15.385   6.061
   30    H1*    A   3           H1*        A   3   4.182 -17.894   5.899
   31    H8     A   3           H8         A   3   1.038 -16.443   7.300
   32   1H6     A   3          1H6         A   3  -1.704 -16.735   3.170
   33   2H6     A   3          2H6         A   3  -1.279 -16.969   1.525
   34    H2     A   3           H2         A   3   3.058 -17.423   1.275
   35   1H5*    U   4          1H5*        U   4   7.081 -14.199   5.201
   36   2H5*    U   4          2H5*        U   4   7.536 -12.558   4.706
   37    H4*    U   4           H4*        U   4   7.611 -14.168   2.817
   38    H3*    U   4           H3*        U   4   5.527 -11.970   2.591
   39    H2*    U   4           H2*        U   4   5.120 -12.847   0.360
   40   2HO*    U   4          2HO*        U   4   7.400 -13.354   0.029
   41    H1*    U   4           H1*        U   4   4.951 -15.423   1.153
   42    H3     U   4           H3         U   4   0.819 -13.575   0.314
   43    H5     U   4           H5         U   4   1.516 -13.002   4.414
   44    H6     U   4           H6         U   4   3.775 -13.752   4.078
   45   1H5*    A   5          1H5*        A   5   7.561 -12.186  -1.080
   46   2H5*    A   5          2H5*        A   5   8.025 -10.571  -1.638
   47    H4*    A   5           H4*        A   5   6.810 -11.788  -3.376
   48    H3*    A   5           H3*        A   5   5.372  -9.354  -2.268
   49    H2*    A   5           H2*        A   5   3.665  -9.749  -3.867
   50   2HO*    A   5          2HO*        A   5   5.115 -10.285  -5.589
   51    H1*    A   5           H1*        A   5   3.506 -12.439  -3.517
   52    H8     A   5           H8         A   5   4.267 -11.117  -0.082
   53   1H6     A   5          1H6         A   5  -1.825 -10.124   0.434
   54   2H6     A   5          2H6         A   5  -0.300 -10.207   1.303
   55    H2     A   5           H2         A   5  -0.922 -10.825  -3.851
   56   1H5*    U   6          1H5*        U   6   4.798  -6.172  -6.180
   57   2H5*    U   6          2H5*        U   6   3.968  -6.613  -4.680
   58    H4*    U   6           H4*        U   6   3.395  -7.748  -7.456
   59    H3*    U   6           H3*        U   6   2.152  -5.709  -5.635
   60    H2*    U   6           H2*        U   6  -0.062  -6.454  -6.220
   61   2HO*    U   6          2HO*        U   6   0.562  -6.831  -8.472
   62    H1*    U   6           H1*        U   6   0.434  -9.079  -5.897
   63    H3     U   6           H3         U   6  -1.718  -7.208  -2.238
   64    H5     U   6           H5         U   6   2.376  -7.372  -1.299
   65    H6     U   6           H6         U   6   2.842  -7.941  -3.589
   66   1H5*    A   7          1H5*        A   7  -0.383  -5.146  -8.855
   67   2H5*    A   7          2H5*        A   7  -0.554  -3.407  -9.181
   68    H4*    A   7           H4*        A   7  -2.716  -4.489  -8.567
   69    H3*    A   7           H3*        A   7  -1.629  -2.352  -6.718
   70    H2*    A   7           H2*        A   7  -3.596  -2.649  -5.364
   71   2HO*    A   7          2HO*        A   7  -4.962  -2.907  -7.298
   72    H1*    A   7           H1*        A   7  -3.611  -5.358  -5.396
   73    H8     A   7           H8         A   7   0.041  -4.596  -5.267
   74   1H6     A   7          1H6         A   7  -0.766  -3.365   0.760
   75   2H6     A   7          2H6         A   7   0.406  -3.622  -0.518
   76    H2     A   7           H2         A   7  -4.780  -3.666  -1.157
   77   1H5*    U   8          1H5*        U   8  -5.807  -1.564  -6.974
   78   2H5*    U   8          2H5*        U   8  -6.040   0.182  -7.129
   79    H4*    U   8           H4*        U   8  -7.172  -0.757  -5.127
   80    H3*    U   8           H3*        U   8  -4.829   1.051  -4.515
   81    H2*    U   8           H2*        U   8  -5.731   1.092  -2.255
   82   2HO*    U   8          2HO*        U   8  -8.024   0.901  -2.855
   83    H1*    U   8           H1*        U   8  -5.897  -1.582  -2.220
   84    H3     U   8           H3         U   8  -2.290  -0.135   0.208
   85    H5     U   8           H5         U   8  -0.878  -0.653  -3.720
   86    H6     U   8           H6         U   8  -3.154  -0.948  -4.451
   87   1H5*    G   9          1H5*        G   9  -8.726   4.501  -3.329
   88   2H5*    G   9          2H5*        G   9  -7.069   3.904  -3.158
   89    H4*    G   9           H4*        G   9  -9.274   3.739  -1.048
   90    H3*    G   9           H3*        G   9  -6.683   5.246  -1.389
   91    H2*    G   9           H2*        G   9  -6.410   5.292   1.007
   92   2HO*    G   9          2HO*        G   9  -8.725   5.290   1.573
   93    H1*    G   9           H1*        G   9  -6.644   2.667   1.154
   94    H8     G   9           H8         G   9  -5.458   2.993  -2.378
   95    H1     G   9           H1         G   9  -0.852   4.254   1.903
   96   1H2     G   9          1H2         G   9  -1.722   4.452   3.922
   97   2H2     G   9          2H2         G   9  -3.436   4.222   4.208
   98   1H5*    A  10          1H5*        A  10  -8.748   8.973   1.624
   99   2H5*    A  10          2H5*        A  10  -7.446   8.154   0.745
  100    H4*    A  10           H4*        A  10  -8.032   7.824   3.721
  101    H3*    A  10           H3*        A  10  -6.109   9.564   2.180
  102    H2*    A  10           H2*        A  10  -4.394   9.122   3.820
  103   2HO*    A  10          2HO*        A  10  -5.987   9.153   5.591
  104    H1*    A  10           H1*        A  10  -4.729   6.467   3.912
  105    H8     A  10           H8         A  10  -5.755   7.147   0.406
  106   1H6     A  10          1H6         A  10   0.279   7.348  -1.014
  107   2H6     A  10          2H6         A  10  -1.350   7.268  -1.672
  108    H2     A  10           H2         A  10  -0.093   7.513   3.389
  109   1H5*    U  11          1H5*        U  11  -5.498  10.552   6.227
  110   2H5*    U  11          2H5*        U  11  -5.305  12.301   6.423
  111    H4*    U  11           H4*        U  11  -3.324  11.005   7.219
  112    H3*    U  11           H3*        U  11  -2.904  12.862   4.866
  113    H2*    U  11           H2*        U  11  -0.543  12.367   5.152
  114   2HO*    U  11          2HO*        U  11  -0.568  12.363   7.453
  115    H1*    U  11           H1*        U  11  -0.900   9.683   5.428
  116    H3     U  11           H3         U  11   0.926  10.512   1.304
  117    H5     U  11           H5         U  11  -3.223  10.886   0.777
  118    H6     U  11           H6         U  11  -3.485  10.759   3.169
  119   1H5*    A  12          1H5*        A  12   0.623  16.181   7.248
  120   2H5*    A  12          2H5*        A  12   0.644  15.515   5.612
  121    H4*    A  12           H4*        A  12   2.190  14.493   8.032
  122    H3*    A  12           H3*        A  12   2.688  16.435   5.964
  123    H2*    A  12           H2*        A  12   3.987  15.279   4.451
  124   2HO*    A  12          2HO*        A  12   5.546  15.097   6.346
  125    H1*    A  12           H1*        A  12   3.725  12.677   5.081
  126    H8     A  12           H8         A  12   0.290  13.957   4.506
  127   1H6     A  12          1H6         A  12   1.467  13.298  -1.544
  128   2H6     A  12          2H6         A  12   0.213  13.529  -0.338
  129    H2     A  12           H2         A  12   5.327  13.095   0.657
  130   1H5*    U  13          1H5*        U  13   6.905  16.333   5.882
  131   2H5*    U  13          2H5*        U  13   7.241  18.068   6.064
  132    H4*    U  13           H4*        U  13   7.895  17.343   3.823
  133    H3*    U  13           H3*        U  13   5.408  19.070   3.883
  134    H2*    U  13           H2*        U  13   5.499  19.025   1.472
  135   2HO*    U  13          2HO*        U  13   7.801  19.249   1.358
  136    H1*    U  13           H1*        U  13   6.117  16.366   1.273
  137    H3     U  13           H3         U  13   1.841  16.644  -0.230
  138    H5     U  13           H5         U  13   1.487  17.145   3.922
  139    H6     U  13           H6         U  13   3.891  17.177   4.072
  140   1H5*    A  14          1H5*        A  14   8.444  20.805   0.922
  141   2H5*    A  14          2H5*        A  14   8.146  22.554   0.935
  142    H4*    A  14           H4*        A  14   8.054  21.598  -1.345
  143    H3*    A  14           H3*        A  14   5.421  22.686  -0.311
  144    H2*    A  14           H2*        A  14   4.620  22.280  -2.580
  145   2HO*    A  14          2HO*        A  14   6.685  22.936  -3.541
  146    H1*    A  14           H1*        A  14   5.732  19.801  -2.773
  147    H8     A  14           H8         A  14   4.451  20.527   0.733
  148   1H6     A  14          1H6         A  14  -0.978  18.397  -1.422
  149   2H6     A  14          2H6         A  14  -0.083  18.759   0.041
  150    H2     A  14           H2         A  14   1.728  19.030  -4.853
  151   1H5*    A  15          1H5*        A  15   6.302  24.127  -4.293
  152   2H5*    A  15          2H5*        A  15   5.846  25.817  -4.470
  153    H4*    A  15           H4*        A  15   4.933  24.110  -6.172
  154    H3*    A  15           H3*        A  15   3.942  26.541  -5.465
  155    H2*    A  15           H2*        A  15   2.617  25.632  -3.679
  156   2HO*    A  15          2HO*        A  15   1.317  26.660  -5.640
  157    H1*    A  15           H1*        A  15   1.713  23.460  -5.587
  158    H8     A  15           H8         A  15   2.973  23.946  -1.995
  159   1H6     A  15          1H6         A  15  -2.265  21.058  -0.311
  160   2H6     A  15          2H6         A  15  -0.794  21.816   0.285
  161    H2     A  15           H2         A  15  -2.120  21.195  -4.719
  162   1H5*    U  16          1H5*        U  16   1.639  23.728  -8.463
  163   2H5*    U  16          2H5*        U  16   1.121  24.714  -9.841
  164    H4*    U  16           H4*        U  16  -0.425  22.810  -9.414
  165    H3*    U  16           H3*        U  16  -1.433  25.622  -9.160
  166    H2*    U  16           H2*        U  16  -3.414  24.964  -8.163
  167   2HO*    U  16          2HO*        U  16  -3.528  23.417 -10.130
  168    H1*    U  16           H1*        U  16  -2.616  22.396  -7.202
  169    H3     U  16           H3         U  16  -4.216  24.042  -3.310
  170    H5     U  16           H5         U  16  -1.520  27.008  -4.555
  171    H6     U  16           H6         U  16  -1.107  25.722  -6.553
  172   1H5*    U  17          1H5*        U  17  -0.290  22.111 -12.914
  173   2H5*    U  17          2H5*        U  17  -0.671  21.944 -11.199
  174    H4*    U  17           H4*        U  17   2.170  22.082 -12.298
  175    H3*    U  17           H3*        U  17   0.232  19.877 -12.201
  176    H2*    U  17           H2*        U  17   1.374  18.439 -10.723
  177   2HO*    U  17          2HO*        U  17   3.415  18.732 -11.929
  178    H1*    U  17           H1*        U  17   2.594  20.191  -9.090
  179    H3     U  17           H3         U  17  -0.450  20.274  -5.830
  180    H5     U  17           H5         U  17  -2.762  19.581  -9.271
  181    H6     U  17           H6         U  17  -0.796  19.875 -10.587
  182   1H5*    U  18          1H5*        U  18   2.943  15.744 -13.284
  183   2H5*    U  18          2H5*        U  18   2.668  16.690 -11.811
  184    H4*    U  18           H4*        U  18   5.408  16.229 -13.071
  185    H3*    U  18           H3*        U  18   3.803  14.519 -11.282
  186    H2*    U  18           H2*        U  18   5.224  14.522  -9.417
  187   2HO*    U  18          2HO*        U  18   7.101  13.984 -10.654
  188    H1*    U  18           H1*        U  18   6.272  17.022  -9.533
  189    H3     U  18           H3         U  18   3.483  18.586  -6.410
  190    H5     U  18           H5         U  18   1.018  16.041  -8.659
  191    H6     U  18           H6         U  18   2.845  15.689 -10.154
  192   1H5*    G  19          1H5*        G  19   6.709  10.351 -10.142
  193   2H5*    G  19          2H5*        G  19   5.392  11.245  -9.357
  194    H4*    G  19           H4*        G  19   8.364  11.801  -8.955
  195    H3*    G  19           H3*        G  19   6.348  10.229  -7.319
  196    H2*    G  19           H2*        G  19   7.384  11.048  -5.327
  197   2HO*    G  19          2HO*        G  19   9.551  10.906  -6.108
  198    H1*    G  19           H1*        G  19   7.475  13.627  -6.116
  199    H8     G  19           H8         G  19   4.496  11.830  -7.682
  200    H1     G  19           H1         G  19   3.462  14.165  -1.806
  201   1H2     G  19          1H2         G  19   6.842  14.936  -1.893
  202   2H2     G  19          2H2         G  19   5.324  15.061  -1.017
  203   1H5*    A  20          1H5*        A  20   9.006   7.307  -4.125
  204   2H5*    A  20          2H5*        A  20   7.423   8.093  -4.179
  205    H4*    A  20           H4*        A  20   9.951   9.226  -2.880
  206    H3*    A  20           H3*        A  20   7.349   7.984  -2.029
  207    H2*    A  20           H2*        A  20   7.321   9.296  -0.002
  208   2HO*    A  20          2HO*        A  20   9.930   9.622  -0.324
  209    H1*    A  20           H1*        A  20   7.453  11.530  -1.423
  210    H8     A  20           H8         A  20   6.164   9.697  -4.257
  211   1H6     A  20          1H6         A  20   0.603   9.586  -1.521
  212   2H6     A  20          2H6         A  20   1.466   9.373  -3.042
  213    H2     A  20           H2         A  20   3.635  10.420   1.592
  214   1H5*    U  21          1H5*        U  21   9.569   5.902   1.992
  215   2H5*    U  21          2H5*        U  21   8.235   6.321   0.910
  216    H4*    U  21           H4*        U  21   8.823   7.670   3.583
  217    H3*    U  21           H3*        U  21   6.905   5.523   2.669
  218    H2*    U  21           H2*        U  21   5.238   6.448   4.178
  219   2HO*    U  21          2HO*        U  21   6.912   7.002   5.791
  220    H1*    U  21           H1*        U  21   5.561   8.988   3.370
  221    H3     U  21           H3         U  21   1.863   7.078   1.356
  222    H5     U  21           H5         U  21   5.033   6.705  -1.375
  223    H6     U  21           H6         U  21   6.551   7.429   0.344
  224   1H5*    C  22          1H5*        C  22   6.288   5.602   6.829
  225   2H5*    C  22          2H5*        C  22   6.127   3.947   7.445
  226    H4*    C  22           H4*        C  22   4.117   5.294   7.926
  227    H3*    C  22           H3*        C  22   3.619   3.196   5.809
  228    H2*    C  22           H2*        C  22   1.247   3.693   6.303
  229   2HO*    C  22          2HO*        C  22   2.005   4.579   8.609
  230    H1*    C  22           H1*        C  22   1.702   6.255   5.760
  231   1H4     C  22          1H4         C  22   0.886   3.417   0.141
  232   2H4     C  22          2H4         C  22   2.621   3.243  -0.036
  233    H5     C  22           H5         C  22   4.198   3.813   1.756
  234    H6     C  22           H6         C  22   4.370   4.647   4.014
  235   1H5*    A  23          1H5*        A  23   0.468   3.890   9.692
  236   2H5*    A  23          2H5*        A  23   0.299   2.403  10.647
  237    H4*    A  23           H4*        A  23  -1.811   3.069   9.539
  238    H3*    A  23           H3*        A  23  -0.597   0.508   8.481
  239    H2*    A  23           H2*        A  23  -2.655   0.333   7.174
  240   2HO*    A  23          2HO*        A  23  -4.049   1.139   8.821
  241    H1*    A  23           H1*        A  23  -2.604   2.900   6.322
  242    H8     A  23           H8         A  23   1.004   1.845   6.546
  243   1H6     A  23          1H6         A  23   0.122  -0.823   1.006
  244   2H6     A  23          2H6         A  23   1.319  -0.402   2.221
  245    H2     A  23           H2         A  23  -3.836   0.353   2.614
  246   1H5*    G  24          1H5*        G  24  -4.877   0.050   9.727
  247   2H5*    G  24          2H5*        G  24  -5.182  -1.621  10.247
  248    H4*    G  24           H4*        G  24  -6.670  -0.786   8.362
  249    H3*    G  24           H3*        G  24  -4.949  -3.231   7.902
  250    H2*    G  24           H2*        G  24  -6.053  -3.417   5.755
  251   2HO*    G  24          2HO*        G  24  -8.144  -2.694   6.555
  252    H1*    G  24           H1*        G  24  -5.691  -0.812   5.102
  253    H8     G  24           H8         G  24  -2.592  -1.539   7.070
  254    H1     G  24           H1         G  24  -2.644  -4.332   1.306
  255   1H2     G  24          1H2         G  24  -6.073  -3.822   1.466
  256   2H2     G  24          2H2         G  24  -4.721  -4.492   0.582
  257   1H5*    U  25          1H5*        U  25  -8.004  -6.029   5.701
  258   2H5*    U  25          2H5*        U  25  -7.775  -4.371   5.110
  259    H4*    U  25           H4*        U  25 -10.482  -5.620   5.707
  260    H3*    U  25           H3*        U  25  -8.928  -6.565   3.691
  261    H2*    U  25           H2*        U  25  -8.515  -4.642   2.398
  262   2HO*    U  25          2HO*        U  25 -10.338  -5.952   1.328
  263    H1*    U  25           H1*        U  25 -11.138  -3.413   2.895
  264    H3     U  25           H3         U  25  -9.877   0.899   2.668
  265    H5     U  25           H5         U  25  -6.246  -1.165   2.990
  266    H6     U  25           H6         U  25  -7.481  -3.214   3.307
  267   1H5*    A  26          1H5*        A  26 -12.112  -6.695   0.832
  268   2H5*    A  26          2H5*        A  26 -12.277  -8.414   0.417
  269    H4*    A  26           H4*        A  26 -11.638  -7.059  -1.551
  270    H3*    A  26           H3*        A  26  -9.509  -8.961  -0.546
  271    H2*    A  26           H2*        A  26  -8.302  -8.344  -2.594
  272   2HO*    A  26          2HO*        A  26 -10.261  -8.195  -3.878
  273    H1*    A  26           H1*        A  26  -8.650  -5.670  -2.164
  274    H8     A  26           H8         A  26  -8.428  -6.819   1.312
  275   1H6     A  26          1H6         A  26  -2.281  -7.387   0.421
  276   2H6     A  26          2H6         A  26  -3.554  -7.333   1.635
  277    H2     A  26           H2         A  26  -4.218  -7.009  -3.535
  278   1H5*    U  27          1H5*        U  27 -10.103  -9.864  -4.650
  279   2H5*    U  27          2H5*        U  27 -10.200 -11.622  -4.907
  280    H4*    U  27           H4*        U  27  -8.457 -10.591  -6.332
  281    H3*    U  27           H3*        U  27  -7.447 -12.455  -4.154
  282    H2*    U  27           H2*        U  27  -5.257 -12.135  -5.151
  283   2HO*    U  27          2HO*        U  27  -6.121 -12.127  -7.327
  284    H1*    U  27           H1*        U  27  -5.461  -9.439  -5.340
  285    H3     U  27           H3         U  27  -2.717 -10.737  -1.870
  286    H5     U  27           H5         U  27  -6.542 -10.312  -0.199
  287    H6     U  27           H6         U  27  -7.427 -10.066  -2.423
  288   1H5*    A  28          1H5*        A  28  -5.668 -13.931  -7.896
  289   2H5*    A  28          2H5*        A  28  -5.750 -15.702  -7.850
  290    H4*    A  28           H4*        A  28  -3.462 -14.931  -8.272
  291    H3*    A  28           H3*        A  28  -3.831 -16.263  -5.566
  292    H2*    A  28           H2*        A  28  -1.416 -16.080  -5.383
  293   2HO*    A  28          2HO*        A  28  -1.095 -16.501  -7.691
  294    H1*    A  28           H1*        A  28  -1.339 -13.482  -6.103
  295    H8     A  28           H8         A  28  -4.645 -13.737  -4.340
  296   1H6     A  28          1H6         A  28  -1.404 -13.406   0.935
  297   2H6     A  28          2H6         A  28  -2.993 -13.256   0.215
  298    H2     A  28           H2         A  28   1.421 -14.364  -2.353
  299   1H5*    U  29          1H5*        U  29  -0.494 -17.988  -7.408
  300   2H5*    U  29          2H5*        U  29  -0.427 -19.746  -7.195
  301    H4*    U  29           H4*        U  29   1.639 -18.632  -6.408
  302    H3*    U  29           H3*        U  29  -0.013 -19.958  -4.227
  303    H2*    U  29           H2*        U  29   1.901 -19.423  -2.796
  304   2HO*    U  29          2HO*        U  29   3.444 -19.809  -4.544
  305    H1*    U  29           H1*        U  29   2.027 -16.848  -3.577
  306    H3     U  29           H3         U  29  -0.043 -17.268   0.537
  307    H5     U  29           H5         U  29  -3.119 -17.409  -2.340
  308    H6     U  29           H6         U  29  -1.452 -17.519  -4.059
  309   1H5*    C  30          1H5*        C  30   3.983 -21.247  -3.909
  310   2H5*    C  30          2H5*        C  30   4.116 -22.987  -3.592
  311    H4*    C  30           H4*        C  30   5.336 -21.638  -1.909
  312    H3*    C  30           H3*        C  30   2.934 -23.179  -0.850
  313    H2*    C  30           H2*        C  30   3.663 -22.424   1.339
  314   2HO*    C  30          2HO*        C  30   5.968 -22.579   0.621
  315    H1*    C  30           H1*        C  30   3.965 -19.841   0.603
  316   1H4     C  30          1H4         C  30  -2.098 -20.227   2.352
  317   2H4     C  30          2H4         C  30  -2.584 -20.367   0.666
  318    H5     C  30           H5         C  30  -0.958 -20.720  -1.144
  319    H6     C  30           H6         C  30   1.387 -20.867  -1.653
  320   1H5*    C  31          1H5*        C  31   6.044 -23.822   1.782
  321   2H5*    C  31          2H5*        C  31   6.282 -25.559   2.061
  322    H4*    C  31           H4*        C  31   6.035 -24.451   4.214
  323    H3*    C  31           H3*        C  31   3.572 -26.033   3.371
  324    H2*    C  31           H2*        C  31   2.784 -25.644   5.621
  325   2HO*    C  31          2HO*        C  31   4.980 -25.884   6.524
  326    H1*    C  31           H1*        C  31   3.449 -22.993   5.596
  327   1H4     C  31          1H4         C  31  -2.569 -23.287   3.743
  328   2H4     C  31          2H4         C  31  -2.092 -23.450   2.059
  329    H5     C  31           H5         C  31   0.260 -23.720   1.375
  330    H6     C  31           H6         C  31   2.532 -23.836   2.175
  331    H3T    C  31           H3T        C  31   5.462 -27.267   3.650
  Start of MODEL   12
    1   1H5*    G   1          1H5*        G   1  -9.146 -19.979   6.380
    2   2H5*    G   1          2H5*        G   1  -8.383 -21.060   5.222
    3    H4*    G   1           H4*        G   1  -7.931 -21.148   8.241
    4    H3*    G   1           H3*        G   1  -6.416 -19.775   6.019
    5    H2*    G   1           H2*        G   1  -4.367 -20.308   7.199
    6   2HO*    G   1          2HO*        G   1  -5.342 -19.988   9.294
    7    H1*    G   1           H1*        G   1  -4.934 -22.874   7.545
    8    H8     G   1           H8         G   1  -6.753 -22.041   4.393
    9    H1     G   1           H1         G   1  -0.388 -22.569   3.630
   10   1H2     G   1          1H2         G   1   0.555 -22.641   5.635
   11   2H2     G   1          2H2         G   1  -0.440 -22.549   7.092
   12    H5T    G   1           H5T        G   1  -9.312 -22.821   6.460
   13   1H5*    G   2          1H5*        G   2  -4.642 -18.490   9.521
   14   2H5*    G   2          2H5*        G   2  -4.382 -16.743   9.513
   15    H4*    G   2           H4*        G   2  -2.315 -17.958   9.994
   16    H3*    G   2           H3*        G   2  -2.346 -16.468   7.366
   17    H2*    G   2           H2*        G   2  -0.004 -17.153   7.161
   18   2HO*    G   2          2HO*        G   2   0.281 -16.911   9.496
   19    H1*    G   2           H1*        G   2  -0.409 -19.708   7.753
   20    H8     G   2           H8         G   2  -3.566 -18.844   5.976
   21    H1     G   2           H1         G   2   1.558 -19.212   2.083
   22   1H2     G   2          1H2         G   2   3.382 -19.205   3.320
   23   2H2     G   2          2H2         G   2   3.272 -19.258   5.094
   24   1H5*    A   3          1H5*        A   3   1.328 -15.640   9.286
   25   2H5*    A   3          2H5*        A   3   1.708 -13.921   9.219
   26    H4*    A   3           H4*        A   3   3.537 -15.286   8.323
   27    H3*    A   3           H3*        A   3   2.146 -13.474   6.327
   28    H2*    A   3           H2*        A   3   3.803 -14.213   4.735
   29   2HO*    A   3          2HO*        A   3   5.458 -14.282   6.456
   30    H1*    A   3           H1*        A   3   3.568 -16.808   5.237
   31    H8     A   3           H8         A   3   0.084 -15.622   5.832
   32   1H6     A   3          1H6         A   3  -0.521 -15.619  -0.346
   33   2H6     A   3          2H6         A   3  -1.353 -15.417   1.213
   34    H2     A   3           H2         A   3   3.749 -16.126   0.579
   35   1H5*    U   4          1H5*        U   4   6.278 -12.914   5.867
   36   2H5*    U   4          2H5*        U   4   6.686 -11.204   5.696
   37    H4*    U   4           H4*        U   4   7.495 -12.518   3.794
   38    H3*    U   4           H3*        U   4   5.310 -10.528   3.075
   39    H2*    U   4           H2*        U   4   5.773 -11.192   0.796
   40   2HO*    U   4          2HO*        U   4   8.045 -11.369   1.191
   41    H1*    U   4           H1*        U   4   5.715 -13.823   1.255
   42    H3     U   4           H3         U   4   1.842 -12.487  -0.815
   43    H5     U   4           H5         U   4   1.067 -12.121   3.286
   44    H6     U   4           H6         U   4   3.393 -12.536   3.730
   45   1H5*    A   5          1H5*        A   5   8.676  -9.843   0.475
   46   2H5*    A   5          2H5*        A   5   8.892  -8.101   0.236
   47    H4*    A   5           H4*        A   5   8.685  -9.246  -1.896
   48    H3*    A   5           H3*        A   5   6.328  -7.418  -1.283
   49    H2*    A   5           H2*        A   5   5.609  -7.945  -3.525
   50   2HO*    A   5          2HO*        A   5   7.799  -7.967  -4.343
   51    H1*    A   5           H1*        A   5   5.862 -10.575  -3.262
   52    H8     A   5           H8         A   5   5.024  -9.481   0.232
   53   1H6     A   5          1H6         A   5  -0.860  -9.680  -1.725
   54   2H6     A   5          2H6         A   5   0.198  -9.636  -0.309
   55    H2     A   5           H2         A   5   1.722  -9.655  -5.276
   56   1H5*    U   6          1H5*        U   6   7.733  -6.495  -5.199
   57   2H5*    U   6          2H5*        U   6   7.725  -4.737  -5.405
   58    H4*    U   6           H4*        U   6   6.380  -5.922  -7.125
   59    H3*    U   6           H3*        U   6   4.886  -4.027  -5.286
   60    H2*    U   6           H2*        U   6   2.966  -4.463  -6.633
   61   2HO*    U   6          2HO*        U   6   4.059  -4.413  -8.615
   62    H1*    U   6           H1*        U   6   3.289  -7.138  -6.796
   63    H3     U   6           H3         U   6  -0.229  -6.316  -4.048
   64    H5     U   6           H5         U   6   3.101  -6.113  -1.526
   65    H6     U   6           H6         U   6   4.526  -6.259  -3.460
   66   1H5*    A   7          1H5*        A   7   2.984  -0.379  -8.197
   67   2H5*    A   7          2H5*        A   7   2.471  -1.257  -6.770
   68    H4*    A   7           H4*        A   7   1.634  -1.844  -9.643
   69    H3*    A   7           H3*        A   7   0.504  -0.262  -7.403
   70    H2*    A   7           H2*        A   7  -1.538  -1.332  -7.243
   71   2HO*    A   7          2HO*        A   7  -1.886  -1.252  -9.561
   72    H1*    A   7           H1*        A   7  -0.850  -3.889  -7.757
   73    H8     A   7           H8         A   7   2.065  -2.939  -5.655
   74   1H6     A   7          1H6         A   7  -2.008  -2.751  -0.937
   75   2H6     A   7          2H6         A   7  -0.279  -2.705  -1.360
   76    H2     A   7           H2         A   7  -4.278  -3.298  -4.596
   77   1H5*    U   8          1H5*        U   8  -2.906   2.793  -8.059
   78   2H5*    U   8          2H5*        U   8  -2.141   1.853  -6.799
   79    H4*    U   8           H4*        U   8  -4.824   1.225  -8.143
   80    H3*    U   8           H3*        U   8  -3.931   2.346  -5.509
   81    H2*    U   8           H2*        U   8  -5.944   1.436  -4.472
   82   2HO*    U   8          2HO*        U   8  -7.096   1.283  -6.759
   83    H1*    U   8           H1*        U   8  -5.214  -0.982  -5.217
   84    H3     U   8           H3         U   8  -3.274   0.293  -1.095
   85    H5     U   8           H5         U   8  -0.272   0.212  -4.049
   86    H6     U   8           H6         U   8  -1.973   0.028  -5.732
   87   1H5*    G   9          1H5*        G   9  -7.840   5.260  -4.829
   88   2H5*    G   9          2H5*        G   9  -6.318   4.495  -4.406
   89    H4*    G   9           H4*        G   9  -9.061   3.649  -3.359
   90    H3*    G   9           H3*        G   9  -6.858   5.428  -2.358
   91    H2*    G   9           H2*        G   9  -7.183   4.637  -0.099
   92   2HO*    G   9          2HO*        G   9  -9.525   4.466  -0.441
   93    H1*    G   9           H1*        G   9  -7.133   2.053  -0.715
   94    H8     G   9           H8         G   9  -5.045   3.216  -3.475
   95    H1     G   9           H1         G   9  -2.034   3.813   2.191
   96   1H2     G   9          1H2         G   9  -3.490   3.734   3.808
   97   2H2     G   9          2H2         G   9  -5.176   3.372   3.443
   98   1H5*    A  10          1H5*        A  10  -9.725   5.896   0.679
   99   2H5*    A  10          2H5*        A  10  -9.952   7.621   1.012
  100    H4*    A  10           H4*        A  10  -9.204   6.374   3.012
  101    H3*    A  10           H3*        A  10  -7.188   8.310   1.865
  102    H2*    A  10           H2*        A  10  -5.917   7.968   3.887
  103   2HO*    A  10          2HO*        A  10  -7.819   7.484   5.305
  104    H1*    A  10           H1*        A  10  -5.958   5.369   3.583
  105    H8     A  10           H8         A  10  -6.125   6.409   0.020
  106   1H6     A  10          1H6         A  10  -0.026   7.454   0.569
  107   2H6     A  10          2H6         A  10  -1.355   7.327  -0.584
  108    H2     A  10           H2         A  10  -1.657   7.033   4.582
  109   1H5*    U  11          1H5*        U  11  -7.898  11.242   5.887
  110   2H5*    U  11          2H5*        U  11  -7.011  10.583   4.529
  111    H4*    U  11           H4*        U  11  -6.441   9.888   7.446
  112    H3*    U  11           H3*        U  11  -5.311  12.006   5.615
  113    H2*    U  11           H2*        U  11  -3.129  11.596   6.588
  114   2HO*    U  11          2HO*        U  11  -4.072  11.293   8.697
  115    H1*    U  11           H1*        U  11  -3.219   8.948   6.443
  116    H3     U  11           H3         U  11  -0.507  10.456   3.096
  117    H5     U  11           H5         U  11  -4.338  10.239   1.398
  118    H6     U  11           H6         U  11  -5.261   9.836   3.610
  119   1H5*    A  12          1H5*        A  12  -3.443  12.689   9.528
  120   2H5*    A  12          2H5*        A  12  -3.556  14.437   9.802
  121    H4*    A  12           H4*        A  12  -1.227  13.607   9.977
  122    H3*    A  12           H3*        A  12  -1.933  15.588   7.817
  123    H2*    A  12           H2*        A  12   0.322  15.507   7.084
  124   2HO*    A  12          2HO*        A  12   0.996  15.545   9.397
  125    H1*    A  12           H1*        A  12   0.815  12.926   7.369
  126    H8     A  12           H8         A  12  -2.590  13.414   5.907
  127   1H6     A  12          1H6         A  12   0.479  13.466   0.478
  128   2H6     A  12          2H6         A  12  -1.120  13.460   1.227
  129    H2     A  12           H2         A  12   3.428  13.781   3.701
  130   1H5*    U  13          1H5*        U  13   1.900  17.111   9.388
  131   2H5*    U  13          2H5*        U  13   1.649  18.857   9.537
  132    H4*    U  13           H4*        U  13   3.543  18.368   8.089
  133    H3*    U  13           H3*        U  13   1.178  19.661   6.673
  134    H2*    U  13           H2*        U  13   2.432  19.650   4.752
  135   2HO*    U  13          2HO*        U  13   4.414  20.284   6.004
  136    H1*    U  13           H1*        U  13   3.598  17.329   4.904
  137    H3     U  13           H3         U  13   0.744  16.900   1.451
  138    H5     U  13           H5         U  13  -1.702  16.534   4.840
  139    H6     U  13           H6         U  13   0.154  17.269   6.195
  140   1H5*    A  14          1H5*        A  14   1.949  22.175   4.513
  141   2H5*    A  14          2H5*        A  14   3.409  21.315   4.752
  142    H4*    A  14           H4*        A  14   4.555  23.634   4.159
  143    H3*    A  14           H3*        A  14   1.972  23.452   2.639
  144    H2*    A  14           H2*        A  14   2.989  23.482   0.580
  145   2HO*    A  14          2HO*        A  14   4.646  25.122   1.138
  146    H1*    A  14           H1*        A  14   4.890  21.724   0.948
  147    H8     A  14           H8         A  14   1.966  20.813   3.133
  148   1H6     A  14          1H6         A  14  -0.119  17.949  -1.947
  149   2H6     A  14          2H6         A  14  -0.448  18.181  -0.226
  150    H2     A  14           H2         A  14   3.121  20.599  -3.147
  151   1H5*    A  15          1H5*        A  15   2.322  25.713  -0.761
  152   2H5*    A  15          2H5*        A  15   1.666  27.303  -0.435
  153    H4*    A  15           H4*        A  15  -0.489  26.699  -1.005
  154    H3*    A  15           H3*        A  15  -0.600  24.499   0.431
  155    H2*    A  15           H2*        A  15   1.434  23.683  -0.619
  156   2HO*    A  15          2HO*        A  15  -0.743  22.200  -0.784
  157    H1*    A  15           H1*        A  15   0.008  23.809  -3.246
  158    H8     A  15           H8         A  15   3.336  24.236  -1.487
  159   1H6     A  15          1H6         A  15   5.615  22.417  -6.952
  160   2H6     A  15          2H6         A  15   6.051  22.797  -5.275
  161    H2     A  15           H2         A  15   1.362  22.853  -7.374
  162   1H5*    U  16          1H5*        U  16  -3.261  20.758  -2.379
  163   2H5*    U  16          2H5*        U  16  -1.506  20.680  -2.206
  164    H4*    U  16           H4*        U  16  -2.244  19.490  -4.178
  165    H3*    U  16           H3*        U  16  -0.436  21.772  -4.498
  166    H2*    U  16           H2*        U  16  -0.905  22.148  -6.804
  167   2HO*    U  16          2HO*        U  16  -0.631  20.091  -7.467
  168    H1*    U  16           H1*        U  16  -3.491  21.520  -6.946
  169    H3     U  16           H3         U  16  -5.355  25.565  -5.861
  170    H5     U  16           H5         U  16  -1.353  25.953  -4.732
  171    H6     U  16           H6         U  16  -1.056  23.595  -5.120
  172   1H5*    U  17          1H5*        U  17   0.871  17.828  -8.051
  173   2H5*    U  17          2H5*        U  17  -0.354  18.001  -6.818
  174    H4*    U  17           H4*        U  17   1.727  15.830  -6.755
  175    H3*    U  17           H3*        U  17  -0.728  16.012  -8.359
  176    H2*    U  17           H2*        U  17  -2.159  14.586  -7.238
  177   2HO*    U  17          2HO*        U  17  -0.148  13.056  -7.464
  178    H1*    U  17           H1*        U  17  -1.049  14.477  -4.702
  179    H3     U  17           H3         U  17  -4.393  16.921  -2.923
  180    H5     U  17           H5         U  17  -3.948  18.607  -6.731
  181    H6     U  17           H6         U  17  -2.097  17.169  -7.114
  182   1H5*    U  18          1H5*        U  18   3.386  13.167  -8.379
  183   2H5*    U  18          2H5*        U  18   2.808  14.101  -7.037
  184    H4*    U  18           H4*        U  18   5.458  14.597  -8.463
  185    H3*    U  18           H3*        U  18   4.706  12.711  -6.360
  186    H2*    U  18           H2*        U  18   5.897  13.600  -4.552
  187   2HO*    U  18          2HO*        U  18   7.876  13.640  -5.761
  188    H1*    U  18           H1*        U  18   5.910  16.246  -5.115
  189    H3     U  18           H3         U  18   2.358  17.542  -2.710
  190    H5     U  18           H5         U  18   1.467  13.547  -3.689
  191    H6     U  18           H6         U  18   3.387  13.484  -5.051
  192   1H5*    G  19          1H5*        G  19   9.154  10.281  -4.827
  193   2H5*    G  19          2H5*        G  19   7.565  10.474  -4.128
  194    H4*    G  19           H4*        G  19  10.008  12.215  -3.684
  195    H3*    G  19           H3*        G  19   8.591  10.145  -2.088
  196    H2*    G  19           H2*        G  19   7.966  11.408  -0.292
  197   2HO*    G  19          2HO*        G  19  10.211  12.030   0.006
  198    H1*    G  19           H1*        G  19   7.840  13.950  -1.332
  199    H8     G  19           H8         G  19   6.043  11.190  -3.236
  200    H1     G  19           H1         G  19   2.487  14.630   0.813
  201   1H2     G  19          1H2         G  19   3.835  16.145   1.843
  202   2H2     G  19          2H2         G  19   5.566  16.017   1.592
  203   1H5*    A  20          1H5*        A  20   9.579   7.911   0.776
  204   2H5*    A  20          2H5*        A  20   8.423   9.032   0.076
  205    H4*    A  20           H4*        A  20   9.593   9.376   2.862
  206    H3*    A  20           H3*        A  20   7.202   7.763   1.955
  207    H2*    A  20           H2*        A  20   6.097   8.470   4.000
  208   2HO*    A  20          2HO*        A  20   8.131   8.377   5.215
  209    H1*    A  20           H1*        A  20   6.620  11.055   3.712
  210    H8     A  20           H8         A  20   6.513   9.949   0.161
  211   1H6     A  20          1H6         A  20   0.294  10.104   0.711
  212   2H6     A  20          2H6         A  20   1.639   9.943  -0.426
  213    H2     A  20           H2         A  20   1.993  10.427   4.723
  214   1H5*    U  21          1H5*        U  21   7.792   7.003   6.084
  215   2H5*    U  21          2H5*        U  21   7.567   5.293   6.493
  216    H4*    U  21           H4*        U  21   5.999   6.791   7.739
  217    H3*    U  21           H3*        U  21   4.758   4.958   5.692
  218    H2*    U  21           H2*        U  21   2.623   5.538   6.665
  219   2HO*    U  21          2HO*        U  21   3.402   5.940   8.876
  220    H1*    U  21           H1*        U  21   3.107   8.107   6.458
  221    H3     U  21           H3         U  21   0.368   6.806   3.060
  222    H5     U  21           H5         U  21   4.239   6.340   1.556
  223    H6     U  21           H6         U  21   5.085   6.801   3.741
  224   1H5*    C  22          1H5*        C  22   2.808   2.264   9.472
  225   2H5*    C  22          2H5*        C  22   2.944   2.844   7.824
  226    H4*    C  22           H4*        C  22   0.830   3.776   9.817
  227    H3*    C  22           H3*        C  22   0.813   1.549   7.763
  228    H2*    C  22           H2*        C  22  -1.410   2.076   7.210
  229   2HO*    C  22          2HO*        C  22  -2.082   2.381   9.361
  230    H1*    C  22           H1*        C  22  -1.180   4.730   7.080
  231   1H4     C  22          1H4         C  22   0.071   3.148   1.155
  232   2H4     C  22          2H4         C  22   1.784   3.027   1.514
  233    H5     C  22           H5         C  22   2.682   3.240   3.751
  234    H6     C  22           H6         C  22   2.086   3.644   6.084
  235   1H5*    A  23          1H5*        A  23  -2.975  -1.598   9.402
  236   2H5*    A  23          2H5*        A  23  -2.249  -1.126   7.874
  237    H4*    A  23           H4*        A  23  -4.760   0.057   9.137
  238    H3*    A  23           H3*        A  23  -4.016  -1.729   6.883
  239    H2*    A  23           H2*        A  23  -5.704  -0.771   5.409
  240   2HO*    A  23          2HO*        A  23  -7.154  -0.513   7.332
  241    H1*    A  23           H1*        A  23  -4.979   1.759   5.858
  242    H8     A  23           H8         A  23  -1.649   0.259   6.489
  243   1H6     A  23          1H6         A  23  -1.081  -0.144   0.330
  244   2H6     A  23          2H6         A  23  -0.252  -0.298   1.900
  245    H2     A  23           H2         A  23  -5.294   0.505   1.170
  246   1H5*    G  24          1H5*        G  24  -7.686  -2.449   5.991
  247   2H5*    G  24          2H5*        G  24  -8.064  -4.184   6.018
  248    H4*    G  24           H4*        G  24  -8.301  -3.279   3.776
  249    H3*    G  24           H3*        G  24  -6.014  -5.219   4.083
  250    H2*    G  24           H2*        G  24  -5.611  -4.939   1.706
  251   2HO*    G  24          2HO*        G  24  -7.930  -4.682   1.195
  252    H1*    G  24           H1*        G  24  -5.518  -2.290   1.750
  253    H8     G  24           H8         G  24  -4.488  -2.444   5.130
  254    H1     G  24           H1         G  24   0.075  -5.068   1.484
  255   1H2     G  24          1H2         G  24  -2.482  -5.296  -0.809
  256   2H2     G  24          2H2         G  24  -0.806  -5.651  -0.479
  257   1H5*    U  25          1H5*        U  25  -9.062  -7.844  -0.072
  258   2H5*    U  25          2H5*        U  25  -7.880  -6.637  -0.555
  259    H4*    U  25           H4*        U  25 -10.903  -6.305  -0.511
  260    H3*    U  25           H3*        U  25  -9.595  -7.592  -2.474
  261    H2*    U  25           H2*        U  25  -7.949  -6.068  -2.975
  262   2HO*    U  25          2HO*        U  25  -9.696  -5.888  -4.808
  263    H1*    U  25           H1*        U  25  -9.474  -3.646  -2.751
  264    H3     U  25           H3         U  25  -6.279  -0.918  -1.138
  265    H5     U  25           H5         U  25  -4.483  -4.686  -1.076
  266    H6     U  25           H6         U  25  -6.556  -5.669  -1.692
  267   1H5*    A  26          1H5*        A  26 -10.252  -9.158  -5.903
  268   2H5*    A  26          2H5*        A  26  -9.166  -8.435  -4.725
  269    H4*    A  26           H4*        A  26  -9.414  -7.572  -7.644
  270    H3*    A  26           H3*        A  26  -7.545  -9.459  -6.228
  271    H2*    A  26           H2*        A  26  -5.681  -8.604  -7.474
  272   2HO*    A  26          2HO*        A  26  -7.076  -8.383  -9.414
  273    H1*    A  26           H1*        A  26  -6.234  -6.012  -7.171
  274    H8     A  26           H8         A  26  -7.471  -7.597  -4.039
  275   1H6     A  26          1H6         A  26  -1.582  -7.157  -2.062
  276   2H6     A  26          2H6         A  26  -3.242  -7.579  -1.602
  277    H2     A  26           H2         A  26  -1.649  -6.136  -6.319
  278   1H5*    U  27          1H5*        U  27  -6.248  -9.780 -10.135
  279   2H5*    U  27          2H5*        U  27  -5.956 -11.476 -10.534
  280    H4*    U  27           H4*        U  27  -3.933 -10.165 -10.815
  281    H3*    U  27           H3*        U  27  -3.749 -12.120  -8.497
  282    H2*    U  27           H2*        U  27  -1.414 -11.467  -8.462
  283   2HO*    U  27          2HO*        U  27  -1.270 -11.336 -10.760
  284    H1*    U  27           H1*        U  27  -1.881  -8.831  -8.576
  285    H3     U  27           H3         U  27  -0.712  -9.880  -4.282
  286    H5     U  27           H5         U  27  -4.831 -10.621  -4.462
  287    H6     U  27           H6         U  27  -4.745 -10.301  -6.861
  288   1H5*    A  28          1H5*        A  28  -0.447 -12.889 -11.137
  289   2H5*    A  28          2H5*        A  28  -0.167 -14.635 -11.222
  290    H4*    A  28           H4*        A  28   1.861 -13.456 -10.571
  291    H3*    A  28           H3*        A  28   0.717 -15.213  -8.370
  292    H2*    A  28           H2*        A  28   2.722 -14.639  -7.152
  293   2HO*    A  28          2HO*        A  28   3.984 -14.646  -9.193
  294    H1*    A  28           H1*        A  28   2.521 -12.005  -7.559
  295    H8     A  28           H8         A  28  -1.056 -13.142  -7.529
  296   1H6     A  28          1H6         A  28  -0.604 -12.867  -1.364
  297   2H6     A  28          2H6         A  28  -1.699 -12.946  -2.753
  298    H2     A  28           H2         A  28   3.479 -12.704  -2.999
  299   1H5*    U  29          1H5*        U  29   4.754 -16.151  -8.729
  300   2H5*    U  29          2H5*        U  29   5.030 -17.892  -8.605
  301    H4*    U  29           H4*        U  29   6.333 -16.658  -6.956
  302    H3*    U  29           H3*        U  29   4.164 -18.397  -5.696
  303    H2*    U  29           H2*        U  29   5.223 -17.760  -3.623
  304   2HO*    U  29          2HO*        U  29   7.349 -17.823  -4.491
  305    H1*    U  29           H1*        U  29   5.264 -15.149  -4.134
  306    H3     U  29           H3         U  29   1.789 -16.065  -1.300
  307    H5     U  29           H5         U  29   0.169 -16.457  -5.142
  308    H6     U  29           H6         U  29   2.382 -16.264  -6.056
  309   1H5*    C  30          1H5*        C  30   7.880 -19.323  -3.977
  310   2H5*    C  30          2H5*        C  30   8.059 -21.058  -3.691
  311    H4*    C  30           H4*        C  30   8.397 -19.754  -1.645
  312    H3*    C  30           H3*        C  30   5.908 -21.524  -1.549
  313    H2*    C  30           H2*        C  30   5.822 -20.828   0.772
  314   2HO*    C  30          2HO*        C  30   8.230 -20.772   0.811
  315    H1*    C  30           H1*        C  30   6.046 -18.221   0.248
  316   1H4     C  30          1H4         C  30  -0.100 -19.245  -0.155
  317   2H4     C  30          2H4         C  30  -0.022 -19.280  -1.930
  318    H5     C  30           H5         C  30   2.102 -19.481  -3.103
  319    H6     C  30           H6         C  30   4.481 -19.396  -2.822
  320   1H5*    C  31          1H5*        C  31   8.155 -22.141   1.910
  321   2H5*    C  31          2H5*        C  31   8.388 -23.871   2.193
  322    H4*    C  31           H4*        C  31   7.448 -22.836   4.191
  323    H3*    C  31           H3*        C  31   5.486 -24.588   2.656
  324    H2*    C  31           H2*        C  31   4.024 -24.336   4.535
  325   2HO*    C  31          2HO*        C  31   5.861 -24.373   6.068
  326    H1*    C  31           H1*        C  31   4.363 -21.646   4.694
  327   1H4     C  31          1H4         C  31  -0.576 -22.447   0.974
  328   2H4     C  31          2H4         C  31   0.439 -22.381  -0.484
  329    H5     C  31           H5         C  31   2.858 -22.490  -0.371
  330    H6     C  31           H6         C  31   4.728 -22.439   1.119
  331    H3T    C  31           H3T        C  31   7.305 -25.661   3.483
  Start of MODEL   13
    1   1H5*    G   1          1H5*        G   1  -3.489 -23.100   8.937
    2   2H5*    G   1          2H5*        G   1  -2.887 -23.865   7.470
    3    H4*    G   1           H4*        G   1  -1.459 -23.933  10.169
    4    H3*    G   1           H3*        G   1  -1.210 -22.073   7.795
    5    H2*    G   1           H2*        G   1   1.179 -21.985   8.240
    6   2HO*    G   1          2HO*        G   1   0.916 -22.058  10.555
    7    H1*    G   1           H1*        G   1   1.477 -24.629   8.386
    8    H8     G   1           H8         G   1  -1.412 -24.235   6.056
    9    H1     G   1           H1         G   1   4.244 -22.809   3.374
   10   1H2     G   1          1H2         G   1   5.788 -22.678   4.961
   11   2H2     G   1          2H2         G   1   5.375 -22.945   6.640
   12    H5T    G   1           H5T        G   1  -2.865 -25.861   8.658
   13   1H5*    G   2          1H5*        G   2   1.152 -20.420  10.797
   14   2H5*    G   2          2H5*        G   2   0.905 -18.675  10.937
   15    H4*    G   2           H4*        G   2   3.277 -19.236  10.633
   16    H3*    G   2           H3*        G   2   2.015 -17.721   8.317
   17    H2*    G   2           H2*        G   2   4.263 -17.654   7.392
   18   2HO*    G   2          2HO*        G   2   5.223 -17.385   9.512
   19    H1*    G   2           H1*        G   2   4.774 -20.253   7.769
   20    H8     G   2           H8         G   2   1.116 -20.311   7.088
   21    H1     G   2           H1         G   2   4.616 -18.974   1.871
   22   1H2     G   2          1H2         G   2   6.683 -18.483   2.486
   23   2H2     G   2          2H2         G   2   7.185 -18.592   4.175
   24   1H5*    A   3          1H5*        A   3   5.690 -15.859   9.253
   25   2H5*    A   3          2H5*        A   3   5.503 -14.108   9.346
   26    H4*    A   3           H4*        A   3   7.323 -14.735   7.826
   27    H3*    A   3           H3*        A   3   4.917 -13.414   6.521
   28    H2*    A   3           H2*        A   3   6.234 -13.453   4.480
   29   2HO*    A   3          2HO*        A   3   8.229 -13.023   5.704
   30    H1*    A   3           H1*        A   3   6.983 -16.006   4.687
   31    H8     A   3           H8         A   3   3.614 -16.146   6.272
   32   1H6     A   3          1H6         A   3   1.294 -16.136   0.523
   33   2H6     A   3          2H6         A   3   0.977 -16.393   2.223
   34    H2     A   3           H2         A   3   5.564 -14.914   0.273
   35   1H5*    U   4          1H5*        U   4   8.361 -11.506   5.040
   36   2H5*    U   4          2H5*        U   4   8.186  -9.751   5.011
   37    H4*    U   4           H4*        U   4   8.737 -10.653   2.783
   38    H3*    U   4           H3*        U   4   5.967  -9.414   3.023
   39    H2*    U   4           H2*        U   4   5.863  -9.743   0.614
   40   2HO*    U   4          2HO*        U   4   8.137  -9.228   0.354
   41    H1*    U   4           H1*        U   4   6.742 -12.286   0.678
   42    H3     U   4           H3         U   4   2.205 -12.167  -0.055
   43    H5     U   4           H5         U   4   2.669 -12.440   4.099
   44    H6     U   4           H6         U   4   5.022 -12.024   3.834
   45   1H5*    A   5          1H5*        A   5   7.918  -7.715  -0.362
   46   2H5*    A   5          2H5*        A   5   7.548  -5.993  -0.504
   47    H4*    A   5           H4*        A   5   6.969  -7.214  -2.552
   48    H3*    A   5           H3*        A   5   4.551  -6.117  -1.057
   49    H2*    A   5           H2*        A   5   3.330  -6.831  -3.035
   50   2HO*    A   5          2HO*        A   5   5.002  -6.297  -4.538
   51    H1*    A   5           H1*        A   5   4.354  -9.296  -3.028
   52    H8     A   5           H8         A   5   4.412  -8.435   0.608
   53   1H6     A   5          1H6         A   5  -1.634  -9.807   0.653
   54   2H6     A   5          2H6         A   5  -0.211  -9.529   1.662
   55    H2     A   5           H2         A   5  -0.402  -9.297  -3.548
   56   1H5*    U   6          1H5*        U   6   4.548  -4.752  -5.123
   57   2H5*    U   6          2H5*        U   6   3.904  -3.105  -5.257
   58    H4*    U   6           H4*        U   6   2.651  -4.788  -6.635
   59    H3*    U   6           H3*        U   6   1.127  -3.569  -4.327
   60    H2*    U   6           H2*        U   6  -0.831  -4.564  -5.415
   61   2HO*    U   6          2HO*        U   6  -0.060  -4.448  -7.624
   62    H1*    U   6           H1*        U   6   0.306  -6.905  -5.453
   63    H3     U   6           H3         U   6  -2.596  -6.568  -1.926
   64    H5     U   6           H5         U   6   1.161  -5.497  -0.397
   65    H6     U   6           H6         U   6   2.014  -5.477  -2.619
   66   1H5*    A   7          1H5*        A   7  -1.601  -1.212  -8.315
   67   2H5*    A   7          2H5*        A   7  -1.350  -1.633  -6.627
   68    H4*    A   7           H4*        A   7  -3.014  -3.223  -8.628
   69    H3*    A   7           H3*        A   7  -3.600  -1.119  -6.601
   70    H2*    A   7           H2*        A   7  -5.287  -2.336  -5.484
   71   2HO*    A   7          2HO*        A   7  -6.337  -2.935  -7.454
   72    H1*    A   7           H1*        A   7  -4.244  -4.832  -5.613
   73    H8     A   7           H8         A   7  -1.286  -2.658  -4.937
   74   1H6     A   7          1H6         A   7  -3.027  -2.875   1.017
   75   2H6     A   7          2H6         A   7  -1.778  -2.336  -0.103
   76    H2     A   7           H2         A   7  -6.204  -4.714  -1.421
   77   1H5*    U   8          1H5*        U   8  -7.705   1.097  -6.671
   78   2H5*    U   8          2H5*        U   8  -6.359   0.616  -5.645
   79    H4*    U   8           H4*        U   8  -9.104  -0.719  -5.717
   80    H3*    U   8           H3*        U   8  -7.635   1.178  -3.888
   81    H2*    U   8           H2*        U   8  -8.908   0.317  -2.015
   82   2HO*    U   8          2HO*        U   8 -10.678  -0.535  -3.783
   83    H1*    U   8           H1*        U   8  -8.122  -2.145  -2.557
   84    H3     U   8           H3         U   8  -5.232  -0.044   0.434
   85    H5     U   8           H5         U   8  -3.399   0.054  -3.329
   86    H6     U   8           H6         U   8  -5.462  -0.683  -4.307
   87   1H5*    G   9          1H5*        G   9 -11.943   3.673  -3.032
   88   2H5*    G   9          2H5*        G   9 -10.269   3.238  -2.735
   89    H4*    G   9           H4*        G   9 -12.627   2.600  -0.917
   90    H3*    G   9           H3*        G   9 -10.410   4.645  -0.969
   91    H2*    G   9           H2*        G   9 -10.177   4.490   1.434
   92   2HO*    G   9          2HO*        G   9 -12.519   4.197   1.702
   93    H1*    G   9           H1*        G   9 -10.048   1.840   1.506
   94    H8     G   9           H8         G   9  -8.657   2.339  -1.890
   95    H1     G   9           H1         G   9  -4.627   4.239   2.740
   96   1H2     G   9          1H2         G   9  -5.715   4.400   4.662
   97   2H2     G   9          2H2         G   9  -7.407   3.931   4.760
   98   1H5*    A  10          1H5*        A  10 -12.564   5.806   2.424
   99   2H5*    A  10          2H5*        A  10 -12.923   7.538   2.338
  100    H4*    A  10           H4*        A  10 -11.736   6.929   4.417
  101    H3*    A  10           H3*        A  10 -10.255   8.778   2.495
  102    H2*    A  10           H2*        A  10  -8.567   8.925   4.176
  103   2HO*    A  10          2HO*        A  10 -10.159   8.905   5.914
  104    H1*    A  10           H1*        A  10  -8.401   6.334   4.705
  105    H8     A  10           H8         A  10  -9.214   6.298   1.082
  106   1H6     A  10          1H6         A  10  -3.168   7.293   0.134
  107   2H6     A  10          2H6         A  10  -4.708   6.849  -0.597
  108    H2     A  10           H2         A  10  -4.028   8.068   4.413
  109   1H5*    U  11          1H5*        U  11  -9.972  10.376   6.386
  110   2H5*    U  11          2H5*        U  11 -10.180  12.123   6.358
  111    H4*    U  11           H4*        U  11  -7.987  11.439   7.311
  112    H3*    U  11           H3*        U  11  -7.942  12.965   4.691
  113    H2*    U  11           H2*        U  11  -5.543  13.070   5.047
  114   2HO*    U  11          2HO*        U  11  -5.617  13.424   7.276
  115    H1*    U  11           H1*        U  11  -5.274  10.490   5.789
  116    H3     U  11           H3         U  11  -3.384  10.972   1.666
  117    H5     U  11           H5         U  11  -7.482  10.399   0.925
  118    H6     U  11           H6         U  11  -7.901  10.607   3.302
  119   1H5*    A  12          1H5*        A  12  -5.611  14.729   8.130
  120   2H5*    A  12          2H5*        A  12  -5.635  16.493   7.979
  121    H4*    A  12           H4*        A  12  -3.311  15.563   8.204
  122    H3*    A  12           H3*        A  12  -4.110  17.034   5.686
  123    H2*    A  12           H2*        A  12  -1.877  16.776   4.961
  124   2HO*    A  12          2HO*        A  12  -0.934  17.252   7.036
  125    H1*    A  12           H1*        A  12  -1.511  14.261   5.708
  126    H8     A  12           H8         A  12  -4.914  14.743   4.252
  127   1H6     A  12          1H6         A  12  -2.176  13.866  -1.219
  128   2H6     A  12          2H6         A  12  -3.681  13.969  -0.360
  129    H2     A  12           H2         A  12   1.008  14.386   1.922
  130   1H5*    U  13          1H5*        U  13  -0.275  18.633   7.554
  131   2H5*    U  13          2H5*        U  13  -0.230  20.368   7.207
  132    H4*    U  13           H4*        U  13   1.837  19.231   6.460
  133    H3*    U  13           H3*        U  13   0.096  20.332   4.227
  134    H2*    U  13           H2*        U  13   1.983  19.838   2.827
  135   2HO*    U  13          2HO*        U  13   3.671  20.389   4.162
  136    H1*    U  13           H1*        U  13   2.363  17.343   3.809
  137    H3     U  13           H3         U  13   0.500  16.995  -0.325
  138    H5     U  13           H5         U  13  -2.730  17.768   2.243
  139    H6     U  13           H6         U  13  -1.175  18.255   3.959
  140   1H5*    A  14          1H5*        A  14   4.266  21.969   4.496
  141   2H5*    A  14          2H5*        A  14   4.294  23.626   3.820
  142    H4*    A  14           H4*        A  14   6.050  22.159   2.829
  143    H3*    A  14           H3*        A  14   3.852  23.071   0.951
  144    H2*    A  14           H2*        A  14   5.127  21.990  -0.789
  145   2HO*    A  14          2HO*        A  14   7.183  22.630  -0.138
  146    H1*    A  14           H1*        A  14   5.784  19.788   0.707
  147    H8     A  14           H8         A  14   2.172  20.832   1.156
  148   1H6     A  14          1H6         A  14   1.227  17.264  -3.863
  149   2H6     A  14          2H6         A  14   0.411  18.147  -2.574
  150    H2     A  14           H2         A  14   5.566  17.791  -3.344
  151   1H5*    A  15          1H5*        A  15   8.077  23.824  -0.266
  152   2H5*    A  15          2H5*        A  15   8.236  25.239  -1.281
  153    H4*    A  15           H4*        A  15   9.104  22.929  -2.072
  154    H3*    A  15           H3*        A  15   8.627  25.185  -3.518
  155    H2*    A  15           H2*        A  15   6.257  24.656  -3.650
  156   2HO*    A  15          2HO*        A  15   7.573  23.767  -6.015
  157    H1*    A  15           H1*        A  15   7.091  21.888  -4.572
  158    H8     A  15           H8         A  15   4.582  23.738  -2.495
  159   1H6     A  15          1H6         A  15   0.561  19.872  -5.324
  160   2H6     A  15          2H6         A  15   0.660  21.253  -4.202
  161    H2     A  15           H2         A  15   4.652  18.684  -6.376
  162   1H5*    U  16          1H5*        U  16  12.177  21.397  -6.503
  163   2H5*    U  16          2H5*        U  16  10.782  22.422  -6.883
  164    H4*    U  16           H4*        U  16  10.529  20.146  -7.731
  165    H3*    U  16           H3*        U  16   8.703  21.219  -5.631
  166    H2*    U  16           H2*        U  16   7.494  19.258  -5.350
  167   2HO*    U  16          2HO*        U  16   8.409  18.679  -7.939
  168    H1*    U  16           H1*        U  16   9.512  17.489  -5.870
  169    H3     U  16           H3         U  16  10.346  16.504  -1.557
  170    H5     U  16           H5         U  16   8.628  20.317  -1.344
  171    H6     U  16           H6         U  16   8.710  20.437  -3.758
  172   1H5*    U  17          1H5*        U  17   5.657  19.718  -8.070
  173   2H5*    U  17          2H5*        U  17   6.635  18.596  -8.987
  174    H4*    U  17           H4*        U  17   4.193  19.899 -10.132
  175    H3*    U  17           H3*        U  17   4.490  17.735  -8.242
  176    H2*    U  17           H2*        U  17   4.293  15.819  -9.545
  177   2HO*    U  17          2HO*        U  17   2.246  16.543 -10.437
  178    H1*    U  17           H1*        U  17   5.229  16.548 -11.937
  179    H3     U  17           H3         U  17   9.770  16.321 -11.378
  180    H5     U  17           H5         U  17   8.140  15.450  -7.632
  181    H6     U  17           H6         U  17   6.014  16.186  -8.409
  182   1H5*    U  18          1H5*        U  18   1.377  14.637  -7.793
  183   2H5*    U  18          2H5*        U  18   2.648  14.884  -8.923
  184    H4*    U  18           H4*        U  18  -0.178  14.133  -9.752
  185    H3*    U  18           H3*        U  18   2.048  12.556  -8.705
  186    H2*    U  18           H2*        U  18   2.450  11.216 -10.401
  187   2HO*    U  18          2HO*        U  18   0.336  10.535 -10.744
  188    H1*    U  18           H1*        U  18   1.895  12.855 -12.561
  189    H3     U  18           H3         U  18   6.195  13.752 -13.354
  190    H5     U  18           H5         U  18   6.079  13.366  -9.174
  191    H6     U  18           H6         U  18   3.744  13.173  -9.317
  192   1H5*    G  19          1H5*        G  19   3.122  10.681  -8.615
  193   2H5*    G  19          2H5*        G  19   3.191   9.238  -7.610
  194    H4*    G  19           H4*        G  19   4.959  10.772  -6.925
  195    H3*    G  19           H3*        G  19   2.610  10.695  -5.049
  196    H2*    G  19           H2*        G  19   3.934  12.044  -3.504
  197   2HO*    G  19          2HO*        G  19   6.091  11.255  -4.598
  198    H1*    G  19           H1*        G  19   4.187  13.919  -5.325
  199    H8     G  19           H8         G  19   1.258  12.644  -6.952
  200    H1     G  19           H1         G  19  -0.223  14.602  -1.032
  201   1H2     G  19          1H2         G  19   1.655  15.012   0.086
  202   2H2     G  19          2H2         G  19   3.218  14.802  -0.663
  203   1H5*    A  20          1H5*        A  20   6.659  11.168  -2.409
  204   2H5*    A  20          2H5*        A  20   7.020   9.613  -1.630
  205    H4*    A  20           H4*        A  20   6.481  11.345   0.021
  206    H3*    A  20           H3*        A  20   4.439   9.095  -0.180
  207    H2*    A  20           H2*        A  20   3.405  10.138   1.746
  208   2HO*    A  20          2HO*        A  20   5.478  10.699   2.691
  209    H1*    A  20           H1*        A  20   3.447  12.628   0.764
  210    H8     A  20           H8         A  20   3.033  10.663  -2.351
  211   1H6     A  20          1H6         A  20  -2.948  10.029  -0.802
  212   2H6     A  20          2H6         A  20  -1.754   9.856  -2.087
  213    H2     A  20           H2         A  20  -0.753  11.467   2.761
  214   1H5*    U  21          1H5*        U  21   5.456   9.608   3.957
  215   2H5*    U  21          2H5*        U  21   5.588   8.027   4.738
  216    H4*    U  21           H4*        U  21   3.909   9.540   5.797
  217    H3*    U  21           H3*        U  21   2.867   6.915   4.630
  218    H2*    U  21           H2*        U  21   0.785   7.540   5.664
  219   2HO*    U  21          2HO*        U  21   1.914   8.461   7.524
  220    H1*    U  21           H1*        U  21   0.779  10.075   4.784
  221    H3     U  21           H3         U  21  -2.194   7.622   2.343
  222    H5     U  21           H5         U  21   1.424   7.375   0.242
  223    H6     U  21           H6         U  21   2.537   8.412   2.090
  224   1H5*    C  22          1H5*        C  22   1.352   7.280   8.564
  225   2H5*    C  22          2H5*        C  22   1.474   5.723   9.388
  226    H4*    C  22           H4*        C  22  -0.851   6.607   9.323
  227    H3*    C  22           H3*        C  22  -0.320   3.980   7.871
  228    H2*    C  22           H2*        C  22  -2.659   3.890   7.492
  229   2HO*    C  22          2HO*        C  22  -3.266   4.554   9.571
  230    H1*    C  22           H1*        C  22  -3.012   6.518   6.895
  231   1H4     C  22          1H4         C  22  -2.549   3.683   1.300
  232   2H4     C  22          2H4         C  22  -0.794   3.873   1.301
  233    H5     C  22           H5         C  22   0.433   4.753   3.232
  234    H6     C  22           H6         C  22   0.220   5.630   5.460
  235   1H5*    A  23          1H5*        A  23  -3.108   0.460  10.245
  236   2H5*    A  23          2H5*        A  23  -2.598   0.898   8.616
  237    H4*    A  23           H4*        A  23  -5.273   1.573   9.916
  238    H3*    A  23           H3*        A  23  -4.324  -0.322   7.799
  239    H2*    A  23           H2*        A  23  -6.379   0.000   6.559
  240   2HO*    A  23          2HO*        A  23  -7.774   0.251   8.358
  241    H1*    A  23           H1*        A  23  -6.102   2.623   6.501
  242    H8     A  23           H8         A  23  -2.504   2.020   6.942
  243   1H6     A  23          1H6         A  23  -2.391   0.012   1.073
  244   2H6     A  23          2H6         A  23  -1.404   0.513   2.469
  245    H2     A  23           H2         A  23  -6.598   0.057   2.389
  246   1H5*    G  24          1H5*        G  24  -7.676  -1.873   6.084
  247   2H5*    G  24          2H5*        G  24  -7.879  -3.508   6.739
  248    H4*    G  24           H4*        G  24  -7.277  -3.657   4.405
  249    H3*    G  24           H3*        G  24  -5.081  -4.501   6.313
  250    H2*    G  24           H2*        G  24  -3.854  -5.199   4.370
  251   2HO*    G  24          2HO*        G  24  -5.546  -6.149   3.266
  252    H1*    G  24           H1*        G  24  -4.413  -2.974   2.877
  253    H8     G  24           H8         G  24  -4.020  -1.413   6.185
  254    H1     G  24           H1         G  24   1.493  -4.007   4.140
  255   1H2     G  24          1H2         G  24   1.074  -5.306   2.359
  256   2H2     G  24          2H2         G  24  -0.548  -5.492   1.747
  257   1H5*    U  25          1H5*        U  25  -7.347  -9.866   4.703
  258   2H5*    U  25          2H5*        U  25  -7.163  -8.392   3.759
  259    H4*    U  25           H4*        U  25  -9.651  -9.050   5.398
  260    H3*    U  25           H3*        U  25  -8.789  -9.426   2.615
  261    H2*    U  25           H2*        U  25 -10.954  -8.895   1.740
  262   2HO*    U  25          2HO*        U  25 -12.142 -10.013   3.390
  263    H1*    U  25           H1*        U  25 -11.305  -6.786   3.326
  264    H3     U  25           H3         U  25 -10.745  -5.452  -0.953
  265    H5     U  25           H5         U  25  -6.910  -5.520   0.715
  266    H6     U  25           H6         U  25  -7.820  -6.610   2.682
  267   1H5*    A  26          1H5*        A  26 -12.132 -10.391   0.523
  268   2H5*    A  26          2H5*        A  26 -11.762 -11.979  -0.163
  269    H4*    A  26           H4*        A  26 -11.697 -10.233  -1.860
  270    H3*    A  26           H3*        A  26  -9.022 -11.500  -1.250
  271    H2*    A  26           H2*        A  26  -8.175 -10.166  -3.122
  272   2HO*    A  26          2HO*        A  26 -10.198 -10.527  -4.320
  273    H1*    A  26           H1*        A  26  -9.346  -7.841  -2.331
  274    H8     A  26           H8         A  26  -8.690  -9.546   0.789
  275   1H6     A  26          1H6         A  26  -2.877  -7.332   0.397
  276   2H6     A  26          2H6         A  26  -4.045  -8.125   1.444
  277    H2     A  26           H2         A  26  -4.815  -6.912  -3.555
  278   1H5*    U  27          1H5*        U  27  -9.194 -11.622  -5.442
  279   2H5*    U  27          2H5*        U  27  -8.700 -13.226  -6.009
  280    H4*    U  27           H4*        U  27  -7.291 -11.480  -6.984
  281    H3*    U  27           H3*        U  27  -5.814 -13.285  -5.021
  282    H2*    U  27           H2*        U  27  -3.852 -12.096  -5.755
  283   2HO*    U  27          2HO*        U  27  -4.535 -11.996  -7.958
  284    H1*    U  27           H1*        U  27  -4.918  -9.639  -5.564
  285    H3     U  27           H3         U  27  -2.073 -10.393  -2.036
  286    H5     U  27           H5         U  27  -5.810 -11.777  -0.749
  287    H6     U  27           H6         U  27  -6.651 -11.476  -2.998
  288   1H5*    A  28          1H5*        A  28  -3.623 -13.248  -8.780
  289   2H5*    A  28          2H5*        A  28  -2.989 -14.873  -9.094
  290    H4*    A  28           H4*        A  28  -1.203 -13.191  -9.139
  291    H3*    A  28           H3*        A  28  -0.999 -15.165  -6.823
  292    H2*    A  28           H2*        A  28   1.104 -14.073  -6.366
  293   2HO*    A  28          2HO*        A  28   1.621 -13.805  -8.624
  294    H1*    A  28           H1*        A  28   0.147 -11.586  -6.494
  295    H8     A  28           H8         A  28  -2.767 -13.577  -5.207
  296   1H6     A  28          1H6         A  28  -0.121 -13.082   0.364
  297   2H6     A  28          2H6         A  28  -1.594 -13.489  -0.518
  298    H2     A  28           H2         A  28   2.874 -11.870  -2.655
  299   1H5*    U  29          1H5*        U  29   2.697 -14.995  -8.887
  300   2H5*    U  29          2H5*        U  29   3.485 -16.574  -8.991
  301    H4*    U  29           H4*        U  29   4.927 -14.885  -7.898
  302    H3*    U  29           H3*        U  29   4.016 -17.158  -6.068
  303    H2*    U  29           H2*        U  29   5.544 -16.142  -4.467
  304   2HO*    U  29          2HO*        U  29   7.074 -15.552  -6.141
  305    H1*    U  29           H1*        U  29   4.613 -13.650  -4.790
  306    H3     U  29           H3         U  29   2.965 -15.395  -0.911
  307    H5     U  29           H5         U  29   0.200 -16.525  -3.849
  308    H6     U  29           H6         U  29   1.708 -15.711  -5.521
  309   1H5*    C  30          1H5*        C  30   8.169 -16.700  -5.713
  310   2H5*    C  30          2H5*        C  30   9.011 -18.252  -5.730
  311    H4*    C  30           H4*        C  30   9.590 -16.912  -3.738
  312    H3*    C  30           H3*        C  30   8.051 -19.496  -3.159
  313    H2*    C  30           H2*        C  30   8.455 -18.959  -0.843
  314   2HO*    C  30          2HO*        C  30  10.588 -18.030  -1.428
  315    H1*    C  30           H1*        C  30   7.664 -16.397  -1.017
  316   1H4     C  30          1H4         C  30   2.347 -19.498   0.248
  317   2H4     C  30          2H4         C  30   1.888 -19.458  -1.461
  318    H5     C  30           H5         C  30   3.463 -18.777  -3.200
  319    H6     C  30           H6         C  30   5.640 -17.882  -3.597
  320   1H5*    C  31          1H5*        C  31  11.267 -19.344  -0.548
  321   2H5*    C  31          2H5*        C  31  12.199 -20.841  -0.629
  322    H4*    C  31           H4*        C  31  11.612 -20.429   1.687
  323    H3*    C  31           H3*        C  31   9.966 -22.653   0.402
  324    H2*    C  31           H2*        C  31   9.167 -23.102   2.631
  325   2HO*    C  31          2HO*        C  31  11.297 -22.619   3.582
  326    H1*    C  31           H1*        C  31   8.677 -20.478   3.201
  327   1H4     C  31          1H4         C  31   3.288 -22.759   0.942
  328   2H4     C  31          2H4         C  31   3.743 -22.329  -0.705
  329    H5     C  31           H5         C  31   5.953 -21.479  -1.279
  330    H6     C  31           H6         C  31   8.092 -20.841  -0.405
  331    H3T    C  31           H3T        C  31  12.202 -23.036   0.524
  Start of MODEL   14
    1   1H5*    G   1          1H5*        G   1  -6.743 -22.969   7.691
    2   2H5*    G   1          2H5*        G   1  -5.912 -23.831   6.405
    3    H4*    G   1           H4*        G   1  -5.158 -24.022   9.358
    4    H3*    G   1           H3*        G   1  -4.238 -22.171   7.164
    5    H2*    G   1           H2*        G   1  -1.985 -22.336   8.053
    6   2HO*    G   1          2HO*        G   1  -2.690 -22.401  10.270
    7    H1*    G   1           H1*        G   1  -1.947 -24.984   8.179
    8    H8     G   1           H8         G   1  -4.320 -24.568   5.356
    9    H1     G   1           H1         G   1   1.703 -22.969   3.789
   10   1H2     G   1          1H2         G   1   2.906 -22.770   5.647
   11   2H2     G   1          2H2         G   1   2.195 -23.094   7.215
   12    H5T    G   1           H5T        G   1  -7.184 -25.011   8.661
   13   1H5*    G   2          1H5*        G   2  -2.343 -20.825  10.612
   14   2H5*    G   2          2H5*        G   2  -2.461 -19.070  10.776
   15    H4*    G   2           H4*        G   2  -0.127 -19.837  10.858
   16    H3*    G   2           H3*        G   2  -0.853 -18.145   8.442
   17    H2*    G   2           H2*        G   2   1.534 -18.235   7.922
   18   2HO*    G   2          2HO*        G   2   2.107 -18.163  10.209
   19    H1*    G   2           H1*        G   2   1.746 -20.879   8.211
   20    H8     G   2           H8         G   2  -1.744 -20.617   6.963
   21    H1     G   2           H1         G   2   2.626 -19.292   2.442
   22   1H2     G   2          1H2         G   2   4.599 -18.985   3.400
   23   2H2     G   2          2H2         G   2   4.805 -19.208   5.136
   24   1H5*    A   3          1H5*        A   3   2.735 -16.643  10.098
   25   2H5*    A   3          2H5*        A   3   2.716 -14.882  10.203
   26    H4*    A   3           H4*        A   3   4.696 -15.693   8.999
   27    H3*    A   3           H3*        A   3   2.716 -14.110   7.321
   28    H2*    A   3           H2*        A   3   4.387 -14.275   5.564
   29   2HO*    A   3          2HO*        A   3   6.160 -14.104   7.129
   30    H1*    A   3           H1*        A   3   4.757 -16.904   5.811
   31    H8     A   3           H8         A   3   1.172 -16.631   6.790
   32   1H6     A   3          1H6         A   3  -0.104 -16.125   0.763
   33   2H6     A   3          2H6         A   3  -0.755 -16.357   2.381
   34    H2     A   3           H2         A   3   4.265 -15.534   1.271
   35   1H5*    U   4          1H5*        U   4   6.559 -12.542   6.650
   36   2H5*    U   4          2H5*        U   4   6.562 -10.775   6.600
   37    H4*    U   4           H4*        U   4   7.511 -11.775   4.544
   38    H3*    U   4           H3*        U   4   4.916 -10.242   4.175
   39    H2*    U   4           H2*        U   4   5.317 -10.601   1.786
   40   2HO*    U   4          2HO*        U   4   7.632 -10.407   2.025
   41    H1*    U   4           H1*        U   4   5.788 -13.228   2.034
   42    H3     U   4           H3         U   4   1.559 -12.374   0.409
   43    H5     U   4           H5         U   4   1.143 -12.720   4.565
   44    H6     U   4           H6         U   4   3.520 -12.697   4.770
   45   1H5*    A   5          1H5*        A   5   7.720  -8.986   1.304
   46   2H5*    A   5          2H5*        A   5   7.669  -7.248   1.023
   47    H4*    A   5           H4*        A   5   7.377  -8.536  -1.067
   48    H3*    A   5           H3*        A   5   4.967  -6.892  -0.186
   49    H2*    A   5           H2*        A   5   4.018  -7.547  -2.336
   50   2HO*    A   5          2HO*        A   5   6.065  -7.471  -3.439
   51    H1*    A   5           H1*        A   5   4.506 -10.150  -2.009
   52    H8     A   5           H8         A   5   4.060  -9.089   1.531
   53   1H6     A   5          1H6         A   5  -2.029  -9.156   0.488
   54   2H6     A   5          2H6         A   5  -0.765  -9.108   1.721
   55    H2     A   5           H2         A   5   0.013  -9.192  -3.440
   56   1H5*    U   6          1H5*        U   6   5.805  -6.079  -4.238
   57   2H5*    U   6          2H5*        U   6   5.663  -4.354  -4.600
   58    H4*    U   6           H4*        U   6   4.211  -5.789  -6.044
   59    H3*    U   6           H3*        U   6   2.872  -3.748  -4.233
   60    H2*    U   6           H2*        U   6   0.808  -4.398  -5.235
   61   2HO*    U   6          2HO*        U   6   1.589  -4.543  -7.356
   62    H1*    U   6           H1*        U   6   1.229  -7.067  -5.179
   63    H3     U   6           H3         U   6  -1.889  -5.962  -2.023
   64    H5     U   6           H5         U   6   1.813  -5.725  -0.064
   65    H6     U   6           H6         U   6   2.890  -5.946  -2.181
   66   1H5*    A   7          1H5*        A   7   0.266  -0.770  -7.459
   67   2H5*    A   7          2H5*        A   7   0.080  -1.403  -5.831
   68    H4*    A   7           H4*        A   7  -1.046  -2.677  -8.357
   69    H3*    A   7           H3*        A   7  -2.031  -0.643  -6.458
   70    H2*    A   7           H2*        A   7  -3.924  -1.773  -5.702
   71   2HO*    A   7          2HO*        A   7  -4.611  -2.215  -7.876
   72    H1*    A   7           H1*        A   7  -3.111  -4.345  -5.757
   73    H8     A   7           H8         A   7  -0.030  -2.813  -4.354
   74   1H6     A   7          1H6         A   7  -3.234  -2.242   0.950
   75   2H6     A   7          2H6         A   7  -1.621  -2.204   0.231
   76    H2     A   7           H2         A   7  -6.076  -3.323  -2.202
   77   1H5*    U   8          1H5*        U   8  -5.629   1.956  -7.190
   78   2H5*    U   8          2H5*        U   8  -4.490   1.364  -5.999
   79    H4*    U   8           H4*        U   8  -7.330   0.327  -6.425
   80    H3*    U   8           H3*        U   8  -5.989   2.269  -4.558
   81    H2*    U   8           H2*        U   8  -7.378   1.523  -2.728
   82   2HO*    U   8          2HO*        U   8  -9.220   1.204  -4.187
   83    H1*    U   8           H1*        U   8  -6.901  -1.072  -3.089
   84    H3     U   8           H3         U   8  -4.033   0.725   0.106
   85    H5     U   8           H5         U   8  -1.885   0.451  -3.491
   86    H6     U   8           H6         U   8  -3.946  -0.016  -4.636
   87   1H5*    G   9          1H5*        G   9  -9.967   2.995  -3.329
   88   2H5*    G   9          2H5*        G   9 -10.224   4.751  -3.426
   89    H4*    G   9           H4*        G   9 -10.670   3.917  -1.171
   90    H3*    G   9           H3*        G   9  -8.219   5.709  -1.389
   91    H2*    G   9           H2*        G   9  -8.179   5.579   1.040
   92   2HO*    G   9          2HO*        G   9 -10.537   5.590   1.147
   93    H1*    G   9           H1*        G   9  -8.425   2.913   1.148
   94    H8     G   9           H8         G   9  -6.520   3.313  -2.033
   95    H1     G   9           H1         G   9  -2.959   4.539   3.172
   96   1H2     G   9          1H2         G   9  -4.269   4.867   4.921
   97   2H2     G   9          2H2         G   9  -6.007   4.652   4.789
   98   1H5*    A  10          1H5*        A  10 -10.561   7.049   1.920
   99   2H5*    A  10          2H5*        A  10 -10.717   8.805   1.841
  100    H4*    A  10           H4*        A  10  -9.850   8.042   4.021
  101    H3*    A  10           H3*        A  10  -7.979   9.770   2.337
  102    H2*    A  10           H2*        A  10  -6.492   9.725   4.161
  103   2HO*    A  10          2HO*        A  10  -8.070   9.960   5.797
  104    H1*    A  10           H1*        A  10  -6.658   7.090   4.686
  105    H8     A  10           H8         A  10  -7.055   7.230   0.968
  106   1H6     A  10          1H6         A  10  -0.893   7.596   0.649
  107   2H6     A  10          2H6         A  10  -2.401   7.364  -0.243
  108    H2     A  10           H2         A  10  -2.053   8.273   4.872
  109   1H5*    U  11          1H5*        U  11  -7.251  13.887   5.351
  110   2H5*    U  11          2H5*        U  11  -6.400  12.999   4.089
  111    H4*    U  11           H4*        U  11  -6.168  12.517   7.083
  112    H3*    U  11           H3*        U  11  -4.489  13.720   4.889
  113    H2*    U  11           H2*        U  11  -2.467  12.995   5.966
  114   2HO*    U  11          2HO*        U  11  -3.942  12.833   8.196
  115    H1*    U  11           H1*        U  11  -3.307  10.503   6.117
  116    H3     U  11           H3         U  11  -0.803  11.207   2.273
  117    H5     U  11           H5         U  11  -4.846  11.163   1.132
  118    H6     U  11           H6         U  11  -5.482  11.250   3.432
  119   1H5*    A  12          1H5*        A  12  -2.747  17.108   8.473
  120   2H5*    A  12          2H5*        A  12  -2.904  16.360   6.878
  121    H4*    A  12           H4*        A  12  -0.592  15.962   8.820
  122    H3*    A  12           H3*        A  12  -1.117  17.494   6.276
  123    H2*    A  12           H2*        A  12   0.934  16.857   5.375
  124   2HO*    A  12          2HO*        A  12   1.980  17.360   7.515
  125    H1*    A  12           H1*        A  12   1.145  14.398   6.289
  126    H8     A  12           H8         A  12  -2.320  14.855   5.086
  127   1H6     A  12          1H6         A  12  -0.014  13.428  -0.520
  128   2H6     A  12          2H6         A  12  -1.487  13.620   0.418
  129    H2     A  12           H2         A  12   3.361  14.235   2.223
  130   1H5*    U  13          1H5*        U  13   2.887  18.977   7.002
  131   2H5*    U  13          2H5*        U  13   2.743  20.732   6.756
  132    H4*    U  13           H4*        U  13   4.344  19.818   5.151
  133    H3*    U  13           H3*        U  13   1.697  20.681   3.949
  134    H2*    U  13           H2*        U  13   2.720  20.239   1.811
  135   2HO*    U  13          2HO*        U  13   4.765  21.088   2.374
  136    H1*    U  13           H1*        U  13   3.853  17.902   2.514
  137    H3     U  13           H3         U  13   0.403  16.788  -0.227
  138    H5     U  13           H5         U  13  -1.441  17.695   3.425
  139    H6     U  13           H6         U  13   0.677  18.440   4.252
  140   1H5*    A  14          1H5*        A  14   5.221  22.636   1.855
  141   2H5*    A  14          2H5*        A  14   4.654  24.221   1.299
  142    H4*    A  14           H4*        A  14   5.618  22.852  -0.544
  143    H3*    A  14           H3*        A  14   2.676  23.540  -0.720
  144    H2*    A  14           H2*        A  14   2.740  22.515  -2.902
  145   2HO*    A  14          2HO*        A  14   4.756  23.270  -3.570
  146    H1*    A  14           H1*        A  14   4.198  20.345  -2.163
  147    H8     A  14           H8         A  14   1.767  21.380   0.513
  148   1H6     A  14          1H6         A  14  -2.295  17.826  -2.547
  149   2H6     A  14          2H6         A  14  -2.006  18.687  -1.032
  150    H2     A  14           H2         A  14   1.278  18.293  -5.062
  151   1H5*    A  15          1H5*        A  15   5.351  24.679  -4.075
  152   2H5*    A  15          2H5*        A  15   4.725  25.939  -5.134
  153    H4*    A  15           H4*        A  15   5.328  23.471  -5.973
  154    H3*    A  15           H3*        A  15   4.167  25.487  -7.312
  155    H2*    A  15           H2*        A  15   2.022  25.098  -6.231
  156   2HO*    A  15          2HO*        A  15   2.167  24.628  -8.858
  157    H1*    A  15           H1*        A  15   2.330  22.223  -7.032
  158    H8     A  15           H8         A  15   1.253  24.340  -4.090
  159   1H6     A  15          1H6         A  15  -3.692  20.593  -3.936
  160   2H6     A  15          2H6         A  15  -2.904  21.980  -3.171
  161    H2     A  15           H2         A  15  -1.088  19.317  -7.257
  162   1H5*    U  16          1H5*        U  16   3.953  20.992  -8.724
  163   2H5*    U  16          2H5*        U  16   4.925  21.110 -10.177
  164    H4*    U  16           H4*        U  16   3.165  20.232 -11.514
  165    H3*    U  16           H3*        U  16   1.390  20.879  -9.504
  166    H2*    U  16           H2*        U  16   1.410  19.318  -7.973
  167   2HO*    U  16          2HO*        U  16   0.692  17.583  -9.979
  168    H1*    U  16           H1*        U  16   2.880  17.165  -9.069
  169    H3     U  16           H3         U  16   6.533  17.355  -6.314
  170    H5     U  16           H5         U  16   4.054  20.545  -5.138
  171    H6     U  16           H6         U  16   2.769  20.217  -7.018
  172   1H5*    U  17          1H5*        U  17   2.790  16.706 -10.948
  173   2H5*    U  17          2H5*        U  17   2.367  16.052 -12.506
  174    H4*    U  17           H4*        U  17   2.703  14.341 -10.751
  175    H3*    U  17           H3*        U  17   0.328  14.543 -12.430
  176    H2*    U  17           H2*        U  17  -1.223  13.510 -11.024
  177   2HO*    U  17          2HO*        U  17   0.536  11.750 -10.994
  178    H1*    U  17           H1*        U  17  -0.136  13.786  -8.507
  179    H3     U  17           H3         U  17  -2.940  17.130  -7.329
  180    H5     U  17           H5         U  17  -2.192  17.812 -11.417
  181    H6     U  17           H6         U  17  -0.870  15.898 -11.438
  182   1H5*    U  18          1H5*        U  18   4.706  11.419 -11.847
  183   2H5*    U  18          2H5*        U  18   3.477  12.045 -10.762
  184    H4*    U  18           H4*        U  18   6.190  13.377 -11.155
  185    H3*    U  18           H3*        U  18   5.406  11.063  -9.505
  186    H2*    U  18           H2*        U  18   5.830  12.015  -7.391
  187   2HO*    U  18          2HO*        U  18   7.938  12.714  -8.030
  188    H1*    U  18           H1*        U  18   5.206  14.606  -7.811
  189    H3     U  18           H3         U  18   1.186  14.199  -5.868
  190    H5     U  18           H5         U  18   1.580  10.594  -7.969
  191    H6     U  18           H6         U  18   3.641  11.362  -8.820
  192   1H5*    G  19          1H5*        G  19   8.174   9.209  -6.499
  193   2H5*    G  19          2H5*        G  19   6.681  10.130  -6.732
  194    H4*    G  19           H4*        G  19   9.126  11.248  -5.310
  195    H3*    G  19           H3*        G  19   6.689   9.818  -4.172
  196    H2*    G  19           H2*        G  19   7.042  11.199  -2.208
  197   2HO*    G  19          2HO*        G  19   9.382  11.092  -2.405
  198    H1*    G  19           H1*        G  19   7.292  13.482  -3.655
  199    H8     G  19           H8         G  19   4.883  11.153  -5.368
  200    H1     G  19           H1         G  19   2.331  14.556  -0.568
  201   1H2     G  19          1H2         G  19   3.920  15.755   0.405
  202   2H2     G  19          2H2         G  19   5.606  15.478   0.010
  203   1H5*    A  20          1H5*        A  20   9.436  10.005  -0.975
  204   2H5*    A  20          2H5*        A  20   9.480   8.413  -0.196
  205    H4*    A  20           H4*        A  20   9.014  10.179   1.436
  206    H3*    A  20           H3*        A  20   6.602   8.456   0.829
  207    H2*    A  20           H2*        A  20   5.645   9.484   2.821
  208   2HO*    A  20          2HO*        A  20   7.665   9.830   3.987
  209    H1*    A  20           H1*        A  20   6.144  11.895   1.871
  210    H8     A  20           H8         A  20   5.734   9.974  -1.293
  211   1H6     A  20          1H6         A  20  -0.380  10.281  -0.224
  212   2H6     A  20          2H6         A  20   0.855   9.937  -1.432
  213    H2     A  20           H2         A  20   1.690  11.328   3.516
  214   1H5*    U  21          1H5*        U  21   7.333   6.390   5.476
  215   2H5*    U  21          2H5*        U  21   6.383   6.815   4.066
  216    H4*    U  21           H4*        U  21   6.230   8.234   6.761
  217    H3*    U  21           H3*        U  21   4.567   6.018   5.510
  218    H2*    U  21           H2*        U  21   2.612   7.027   6.510
  219   2HO*    U  21          2HO*        U  21   3.846   7.623   8.440
  220    H1*    U  21           H1*        U  21   3.143   9.520   5.756
  221    H3     U  21           H3         U  21  -0.042   7.793   2.958
  222    H5     U  21           H5         U  21   3.632   6.999   1.094
  223    H6     U  21           H6         U  21   4.776   7.738   3.095
  224   1H5*    C  22          1H5*        C  22   2.985   6.456   9.365
  225   2H5*    C  22          2H5*        C  22   2.846   4.868  10.132
  226    H4*    C  22           H4*        C  22   0.684   6.065  10.091
  227    H3*    C  22           H3*        C  22   0.845   3.543   8.403
  228    H2*    C  22           H2*        C  22  -1.497   3.823   8.070
  229   2HO*    C  22          2HO*        C  22  -2.043   4.508  10.169
  230    H1*    C  22           H1*        C  22  -1.410   6.414   7.523
  231   1H4     C  22          1H4         C  22  -0.871   3.725   1.873
  232   2H4     C  22          2H4         C  22   0.875   3.691   2.015
  233    H5     C  22           H5         C  22   2.036   4.378   4.032
  234    H6     C  22           H6         C  22   1.753   5.220   6.262
  235   1H5*    A  23          1H5*        A  23  -1.732  -0.137   9.845
  236   2H5*    A  23          2H5*        A  23  -1.466   0.127   8.130
  237    H4*    A  23           H4*        A  23  -3.604   1.380   9.910
  238    H3*    A  23           H3*        A  23  -3.343  -0.368   7.556
  239    H2*    A  23           H2*        A  23  -5.315   0.433   6.475
  240   2HO*    A  23          2HO*        A  23  -6.571   0.765   8.344
  241    H1*    A  23           H1*        A  23  -4.535   2.933   6.595
  242    H8     A  23           H8         A  23  -1.186   1.858   6.899
  243   1H6     A  23          1H6         A  23  -1.280   0.106   0.929
  244   2H6     A  23          2H6         A  23  -0.254   0.343   2.370
  245    H2     A  23           H2         A  23  -5.458   0.699   2.267
  246   1H5*    G  24          1H5*        G  24  -6.504  -1.203   5.793
  247   2H5*    G  24          2H5*        G  24  -7.216  -2.732   6.330
  248    H4*    G  24           H4*        G  24  -6.433  -3.009   4.079
  249    H3*    G  24           H3*        G  24  -4.893  -4.456   6.209
  250    H2*    G  24           H2*        G  24  -3.346  -5.249   4.641
  251   2HO*    G  24          2HO*        G  24  -4.932  -6.042   3.238
  252    H1*    G  24           H1*        G  24  -3.357  -3.106   2.869
  253    H8     G  24           H8         G  24  -2.939  -1.353   6.030
  254    H1     G  24           H1         G  24   2.211  -4.965   4.667
  255   1H2     G  24          1H2         G  24   1.741  -6.251   2.893
  256   2H2     G  24          2H2         G  24   0.180  -6.177   2.128
  257   1H5*    U  25          1H5*        U  25  -7.796  -8.581   3.246
  258   2H5*    U  25          2H5*        U  25  -7.576  -6.886   2.866
  259    H4*    U  25           H4*        U  25 -10.117  -7.966   4.090
  260    H3*    U  25           H3*        U  25  -9.407  -8.747   1.634
  261    H2*    U  25           H2*        U  25  -8.803  -6.721   0.685
  262   2HO*    U  25          2HO*        U  25 -10.971  -7.405  -0.301
  263    H1*    U  25           H1*        U  25 -10.875  -5.090   1.781
  264    H3     U  25           H3         U  25  -8.524  -1.240   2.201
  265    H5     U  25           H5         U  25  -5.668  -4.047   1.022
  266    H6     U  25           H6         U  25  -7.258  -5.768   1.306
  267   1H5*    A  26          1H5*        A  26 -11.074 -10.729  -1.431
  268   2H5*    A  26          2H5*        A  26  -9.772  -9.835  -0.674
  269    H4*    A  26           H4*        A  26 -11.351  -8.944  -3.130
  270    H3*    A  26           H3*        A  26  -8.739 -10.343  -2.667
  271    H2*    A  26           H2*        A  26  -7.607  -9.002  -4.302
  272   2HO*    A  26          2HO*        A  26  -9.501  -9.073  -5.732
  273    H1*    A  26           H1*        A  26  -8.599  -6.632  -3.569
  274    H8     A  26           H8         A  26  -8.492  -8.413  -0.328
  275   1H6     A  26          1H6         A  26  -2.535  -6.778   0.009
  276   2H6     A  26          2H6         A  26  -3.895  -7.461   0.865
  277    H2     A  26           H2         A  26  -3.893  -6.128  -4.166
  278   1H5*    U  27          1H5*        U  27  -8.576 -10.386  -6.682
  279   2H5*    U  27          2H5*        U  27  -8.203 -12.010  -7.288
  280    H4*    U  27           H4*        U  27  -6.442 -10.475  -7.940
  281    H3*    U  27           H3*        U  27  -5.539 -12.419  -5.769
  282    H2*    U  27           H2*        U  27  -3.354 -11.494  -6.177
  283   2HO*    U  27          2HO*        U  27  -3.675 -11.310  -8.462
  284    H1*    U  27           H1*        U  27  -4.150  -8.929  -6.095
  285    H3     U  27           H3         U  27  -2.071  -9.989  -2.142
  286    H5     U  27           H5         U  27  -6.087 -11.040  -1.580
  287    H6     U  27           H6         U  27  -6.476 -10.646  -3.933
  288   1H5*    A  28          1H5*        A  28  -2.868 -12.745  -9.127
  289   2H5*    A  28          2H5*        A  28  -2.423 -14.442  -9.372
  290    H4*    A  28           H4*        A  28  -0.435 -13.017  -9.172
  291    H3*    A  28           H3*        A  28  -0.817 -15.001  -6.893
  292    H2*    A  28           H2*        A  28   1.315 -14.198  -6.100
  293   2HO*    A  28          2HO*        A  28   2.184 -14.017  -8.264
  294    H1*    A  28           H1*        A  28   0.772 -11.605  -6.360
  295    H8     A  28           H8         A  28  -2.560 -13.094  -5.466
  296   1H6     A  28          1H6         A  28  -0.663 -12.676   0.421
  297   2H6     A  28          2H6         A  28  -2.029 -12.881  -0.649
  298    H2     A  28           H2         A  28   2.899 -12.196  -2.195
  299   1H5*    U  29          1H5*        U  29   3.125 -15.290  -8.375
  300   2H5*    U  29          2H5*        U  29   3.722 -16.950  -8.390
  301    H4*    U  29           H4*        U  29   5.160 -15.445  -7.046
  302    H3*    U  29           H3*        U  29   3.730 -17.625  -5.448
  303    H2*    U  29           H2*        U  29   5.109 -16.815  -3.609
  304   2HO*    U  29          2HO*        U  29   6.924 -16.371  -5.026
  305    H1*    U  29           H1*        U  29   4.530 -14.230  -3.988
  306    H3     U  29           H3         U  29   2.127 -15.807  -0.422
  307    H5     U  29           H5         U  29  -0.291 -16.532  -3.761
  308    H6     U  29           H6         U  29   1.537 -15.907  -5.187
  309   1H5*    C  30          1H5*        C  30   7.781 -17.650  -4.437
  310   2H5*    C  30          2H5*        C  30   8.437 -19.285  -4.327
  311    H4*    C  30           H4*        C  30   8.800 -18.008  -2.251
  312    H3*    C  30           H3*        C  30   6.896 -20.385  -1.961
  313    H2*    C  30           H2*        C  30   6.995 -19.865   0.402
  314   2HO*    C  30          2HO*        C  30   9.288 -19.193   0.152
  315    H1*    C  30           H1*        C  30   6.534 -17.238   0.107
  316   1H4     C  30          1H4         C  30   0.785 -19.797   0.484
  317   2H4     C  30          2H4         C  30   0.643 -19.789  -1.276
  318    H5     C  30           H5         C  30   2.528 -19.277  -2.729
  319    H6     C  30           H6         C  30   4.811 -18.570  -2.770
  320   1H5*    C  31          1H5*        C  31   9.671 -20.561   1.130
  321   2H5*    C  31          2H5*        C  31  10.403 -22.167   1.220
  322    H4*    C  31           H4*        C  31   9.506 -21.585   3.407
  323    H3*    C  31           H3*        C  31   7.854 -23.668   1.918
  324    H2*    C  31           H2*        C  31   6.632 -23.923   3.976
  325   2HO*    C  31          2HO*        C  31   8.599 -23.651   5.286
  326    H1*    C  31           H1*        C  31   6.362 -21.240   4.394
  327   1H4     C  31          1H4         C  31   1.242 -23.061   1.230
  328   2H4     C  31          2H4         C  31   2.035 -22.756  -0.316
  329    H5     C  31           H5         C  31   4.386 -22.159  -0.492
  330    H6     C  31           H6         C  31   6.380 -21.700   0.754
  331    H3T    C  31           H3T        C  31   9.978 -24.286   2.442
  Start of MODEL   15
    1   1H5*    G   1          1H5*        G   1  -7.315 -24.505   7.242
    2   2H5*    G   1          2H5*        G   1  -7.255 -22.843   7.864
    3    H4*    G   1           H4*        G   1  -5.405 -24.062   8.817
    4    H3*    G   1           H3*        G   1  -4.547 -22.152   6.623
    5    H2*    G   1           H2*        G   1  -2.276 -22.690   7.264
    6   2HO*    G   1          2HO*        G   1  -2.749 -22.814   9.544
    7    H1*    G   1           H1*        G   1  -2.683 -25.353   7.275
    8    H8     G   1           H8         G   1  -5.025 -24.306   4.579
    9    H1     G   1           H1         G   1   1.133 -23.753   2.855
   10   1H2     G   1          1H2         G   1   2.423 -23.933   4.652
   11   2H2     G   1          2H2         G   1   1.744 -24.217   6.243
   12    H5T    G   1           H5T        G   1  -6.349 -22.174   5.925
   13   1H5*    G   2          1H5*        G   2  -2.240 -21.223  10.018
   14   2H5*    G   2          2H5*        G   2  -2.136 -19.471  10.255
   15    H4*    G   2           H4*        G   2   0.096 -20.507  10.203
   16    H3*    G   2           H3*        G   2  -0.534 -18.666   7.883
   17    H2*    G   2           H2*        G   2   1.777 -19.010   7.204
   18   2HO*    G   2          2HO*        G   2   2.549 -19.034   9.421
   19    H1*    G   2           H1*        G   2   1.725 -21.685   7.481
   20    H8     G   2           H8         G   2  -1.760 -20.989   6.355
   21    H1     G   2           H1         G   2   2.579 -20.086   1.712
   22   1H2     G   2          1H2         G   2   4.609 -19.973   2.599
   23   2H2     G   2          2H2         G   2   4.869 -20.222   4.317
   24   1H5*    A   3          1H5*        A   3   3.316 -17.600   9.428
   25   2H5*    A   3          2H5*        A   3   3.457 -15.844   9.607
   26    H4*    A   3           H4*        A   3   5.321 -16.766   8.295
   27    H3*    A   3           H3*        A   3   3.422 -14.941   6.790
   28    H2*    A   3           H2*        A   3   4.933 -15.182   4.906
   29   2HO*    A   3          2HO*        A   3   6.832 -15.189   6.324
   30    H1*    A   3           H1*        A   3   5.146 -17.853   5.062
   31    H8     A   3           H8         A   3   1.643 -17.319   6.252
   32   1H6     A   3          1H6         A   3   0.054 -16.798   0.302
   33   2H6     A   3          2H6         A   3  -0.528 -17.005   1.951
   34    H2     A   3           H2         A   3   4.481 -16.476   0.563
   35   1H5*    U   4          1H5*        U   4   7.337 -13.725   5.908
   36   2H5*    U   4          2H5*        U   4   7.530 -11.966   5.902
   37    H4*    U   4           H4*        U   4   8.212 -12.984   3.751
   38    H3*    U   4           H3*        U   4   5.758 -11.195   3.599
   39    H2*    U   4           H2*        U   4   5.952 -11.520   1.190
   40   2HO*    U   4          2HO*        U   4   8.318 -11.514   1.293
   41    H1*    U   4           H1*        U   4   6.275 -14.198   1.346
   42    H3     U   4           H3         U   4   2.042 -13.164  -0.097
   43    H5     U   4           H5         U   4   1.778 -13.412   4.084
   44    H6     U   4           H6         U   4   4.180 -13.520   4.190
   45   1H5*    A   5          1H5*        A   5   8.431 -10.094   0.579
   46   2H5*    A   5          2H5*        A   5   8.584  -8.339   0.435
   47    H4*    A   5           H4*        A   5   8.023  -9.360  -1.717
   48    H3*    A   5           H3*        A   5   5.856  -7.572  -0.556
   49    H2*    A   5           H2*        A   5   4.664  -7.920  -2.584
   50   2HO*    A   5          2HO*        A   5   6.501  -7.783  -3.957
   51    H1*    A   5           H1*        A   5   5.045 -10.594  -2.701
   52    H8     A   5           H8         A   5   4.839  -9.913   0.983
   53   1H6     A   5          1H6         A   5  -1.316 -10.086   0.251
   54   2H6     A   5          2H6         A   5  -0.006 -10.066   1.428
   55    H2     A   5           H2         A   5   0.530  -9.795  -3.765
   56   1H5*    U   6          1H5*        U   6   5.414  -3.772  -4.017
   57   2H5*    U   6          2H5*        U   6   4.395  -4.639  -2.861
   58    H4*    U   6           H4*        U   6   4.742  -5.315  -5.816
   59    H3*    U   6           H3*        U   6   2.680  -3.975  -4.089
   60    H2*    U   6           H2*        U   6   0.882  -5.021  -5.305
   61   2HO*    U   6          2HO*        U   6   2.078  -4.829  -7.354
   62    H1*    U   6           H1*        U   6   1.910  -7.499  -5.213
   63    H3     U   6           H3         U   6  -1.295  -6.774  -1.960
   64    H5     U   6           H5         U   6   2.451  -6.322  -0.097
   65    H6     U   6           H6         U   6   3.491  -6.357  -2.270
   66   1H5*    A   7          1H5*        A   7   0.684  -3.438  -7.651
   67   2H5*    A   7          2H5*        A   7   0.303  -1.712  -7.820
   68    H4*    A   7           H4*        A   7  -1.738  -3.092  -7.907
   69    H3*    A   7           H3*        A   7  -1.437  -1.276  -5.506
   70    H2*    A   7           H2*        A   7  -3.683  -1.992  -4.878
   71   2HO*    A   7          2HO*        A   7  -4.391  -1.985  -7.134
   72    H1*    A   7           H1*        A   7  -3.273  -4.619  -5.349
   73    H8     A   7           H8         A   7   0.035  -3.524  -4.009
   74   1H6     A   7          1H6         A   7  -2.570  -3.928   1.615
   75   2H6     A   7          2H6         A   7  -1.050  -3.728   0.747
   76    H2     A   7           H2         A   7  -5.796  -4.103  -1.405
   77   1H5*    U   8          1H5*        U   8  -5.459  -0.622  -6.757
   78   2H5*    U   8          2H5*        U   8  -5.729   1.129  -6.846
   79    H4*    U   8           H4*        U   8  -7.373   0.021  -5.357
   80    H3*    U   8           H3*        U   8  -5.361   1.794  -3.965
   81    H2*    U   8           H2*        U   8  -6.836   1.614  -2.032
   82   2HO*    U   8          2HO*        U   8  -8.868   1.346  -3.167
   83    H1*    U   8           H1*        U   8  -6.752  -1.051  -2.173
   84    H3     U   8           H3         U   8  -3.750   0.712   0.890
   85    H5     U   8           H5         U   8  -1.597   0.041  -2.654
   86    H6     U   8           H6         U   8  -3.696  -0.358  -3.776
   87   1H5*    G   9          1H5*        G   9  -9.311   5.002  -3.221
   88   2H5*    G   9          2H5*        G   9  -7.766   4.285  -2.761
   89    H4*    G   9           H4*        G   9 -10.404   3.810  -1.302
   90    H3*    G   9           H3*        G   9  -8.157   5.774  -0.916
   91    H2*    G   9           H2*        G   9  -8.298   5.476   1.483
   92   2HO*    G   9          2HO*        G   9 -10.671   5.270   1.364
   93    H1*    G   9           H1*        G   9  -8.305   2.803   1.431
   94    H8     G   9           H8         G   9  -6.307   3.445  -1.639
   95    H1     G   9           H1         G   9  -3.037   4.817   3.715
   96   1H2     G   9          1H2         G   9  -4.416   4.971   5.438
   97   2H2     G   9          2H2         G   9  -6.132   4.635   5.262
   98   1H5*    A  10          1H5*        A  10 -10.813   6.705   2.199
   99   2H5*    A  10          2H5*        A  10 -11.073   8.455   2.285
  100    H4*    A  10           H4*        A  10 -10.201   7.500   4.412
  101    H3*    A  10           H3*        A  10  -8.477   9.524   2.953
  102    H2*    A  10           H2*        A  10  -6.977   9.404   4.848
  103   2HO*    A  10          2HO*        A  10  -8.816   9.199   6.345
  104    H1*    A  10           H1*        A  10  -6.929   6.738   5.005
  105    H8     A  10           H8         A  10  -7.285   7.254   1.324
  106   1H6     A  10          1H6         A  10  -1.148   8.247   1.298
  107   2H6     A  10          2H6         A  10  -2.567   7.982   0.293
  108    H2     A  10           H2         A  10  -2.549   8.341   5.496
  109   1H5*    U  11          1H5*        U  11  -8.462  10.618   7.079
  110   2H5*    U  11          2H5*        U  11  -8.765  12.359   7.199
  111    H4*    U  11           H4*        U  11  -6.626  11.724   8.294
  112    H3*    U  11           H3*        U  11  -6.509  13.473   5.830
  113    H2*    U  11           H2*        U  11  -4.150  13.668   6.214
  114   2HO*    U  11          2HO*        U  11  -4.310  13.939   8.491
  115    H1*    U  11           H1*        U  11  -3.749  11.046   6.923
  116    H3     U  11           H3         U  11  -1.615  11.618   2.944
  117    H5     U  11           H5         U  11  -5.646  11.062   1.912
  118    H6     U  11           H6         U  11  -6.212  11.166   4.258
  119   1H5*    A  12          1H5*        A  12  -4.313  17.858   7.853
  120   2H5*    A  12          2H5*        A  12  -3.993  16.876   6.415
  121    H4*    A  12           H4*        A  12  -2.397  16.885   9.013
  122    H3*    A  12           H3*        A  12  -2.136  18.071   6.291
  123    H2*    A  12           H2*        A  12  -0.014  17.208   5.870
  124   2HO*    A  12          2HO*        A  12   0.708  17.937   8.054
  125    H1*    A  12           H1*        A  12  -0.117  14.846   7.029
  126    H8     A  12           H8         A  12  -3.397  15.289   5.354
  127   1H6     A  12          1H6         A  12  -0.467  13.804   0.104
  128   2H6     A  12          2H6         A  12  -2.048  13.943   0.876
  129    H2     A  12           H2         A  12   2.582  14.536   3.234
  130   1H5*    U  13          1H5*        U  13   1.734  19.431   7.795
  131   2H5*    U  13          2H5*        U  13   1.896  21.103   7.217
  132    H4*    U  13           H4*        U  13   3.671  19.660   6.268
  133    H3*    U  13           H3*        U  13   1.595  20.457   4.225
  134    H2*    U  13           H2*        U  13   3.212  19.607   2.617
  135   2HO*    U  13          2HO*        U  13   5.119  20.036   4.259
  136    H1*    U  13           H1*        U  13   3.340  17.281   3.909
  137    H3     U  13           H3         U  13   0.522  16.862   0.318
  138    H5     U  13           H5         U  13  -1.861  18.227   3.498
  139    H6     U  13           H6         U  13   0.160  18.703   4.703
  140   1H5*    A  14          1H5*        A  14   6.490  20.604   2.888
  141   2H5*    A  14          2H5*        A  14   6.743  22.177   2.117
  142    H4*    A  14           H4*        A  14   6.864  20.185   0.574
  143    H3*    A  14           H3*        A  14   4.754  22.272  -0.023
  144    H2*    A  14           H2*        A  14   4.327  20.995  -2.024
  145   2HO*    A  14          2HO*        A  14   6.500  20.585  -2.566
  146    H1*    A  14           H1*        A  14   4.588  18.521  -0.839
  147    H8     A  14           H8         A  14   2.550  20.880   1.285
  148   1H6     A  14          1H6         A  14  -2.195  19.236  -2.383
  149   2H6     A  14          2H6         A  14  -1.775  19.999  -0.851
  150    H2     A  14           H2         A  14   1.542  17.794  -4.227
  151   1H5*    A  15          1H5*        A  15   7.521  21.131  -3.408
  152   2H5*    A  15          2H5*        A  15   7.852  22.559  -4.379
  153    H4*    A  15           H4*        A  15   7.062  20.393  -5.559
  154    H3*    A  15           H3*        A  15   7.019  22.937  -6.443
  155    H2*    A  15           H2*        A  15   4.934  23.394  -5.281
  156   2HO*    A  15          2HO*        A  15   4.939  23.561  -7.870
  157    H1*    A  15           H1*        A  15   3.882  20.872  -6.583
  158    H8     A  15           H8         A  15   3.820  22.857  -3.325
  159   1H6     A  15          1H6         A  15  -2.327  21.989  -3.561
  160   2H6     A  15          2H6         A  15  -1.017  22.715  -2.627
  161    H2     A  15           H2         A  15  -0.499  19.892  -6.991
  162   1H5*    U  16          1H5*        U  16   4.356  19.729  -8.835
  163   2H5*    U  16          2H5*        U  16   5.109  19.799 -10.437
  164    H4*    U  16           H4*        U  16   2.767  19.110 -10.630
  165    H3*    U  16           H3*        U  16   3.865  21.514 -11.889
  166    H2*    U  16           H2*        U  16   2.104  22.907 -11.735
  167   2HO*    U  16          2HO*        U  16   1.228  21.041 -13.286
  168    H1*    U  16           H1*        U  16   0.186  21.183 -10.385
  169    H3     U  16           H3         U  16  -0.956  24.760  -7.846
  170    H5     U  16           H5         U  16   3.120  25.395  -8.653
  171    H6     U  16           H6         U  16   3.169  23.307  -9.803
  172   1H5*    U  17          1H5*        U  17   1.679  16.629 -13.842
  173   2H5*    U  17          2H5*        U  17   0.875  18.043 -13.140
  174    H4*    U  17           H4*        U  17   1.570  15.533 -11.571
  175    H3*    U  17           H3*        U  17  -0.597  16.000 -13.464
  176    H2*    U  17           H2*        U  17  -2.429  16.317 -12.062
  177   2HO*    U  17          2HO*        U  17  -1.573  14.175 -11.046
  178    H1*    U  17           H1*        U  17  -1.295  17.147  -9.703
  179    H3     U  17           H3         U  17  -2.305  21.475 -10.269
  180    H5     U  17           H5         U  17  -1.959  20.071 -14.208
  181    H6     U  17           H6         U  17  -1.193  17.966 -13.326
  182   1H5*    U  18          1H5*        U  18   1.713  11.803 -11.278
  183   2H5*    U  18          2H5*        U  18   1.243  13.375 -10.631
  184    H4*    U  18           H4*        U  18   4.120  12.574 -11.237
  185    H3*    U  18           H3*        U  18   2.369  12.008  -8.944
  186    H2*    U  18           H2*        U  18   3.514  13.203  -7.282
  187   2HO*    U  18          2HO*        U  18   5.553  12.245  -7.757
  188    H1*    U  18           H1*        U  18   4.548  15.274  -8.725
  189    H3     U  18           H3         U  18   1.399  18.180  -7.457
  190    H5     U  18           H5         U  18  -0.751  14.591  -7.854
  191    H6     U  18           H6         U  18   1.244  13.539  -8.617
  192   1H5*    G  19          1H5*        G  19   5.653   9.139  -5.730
  193   2H5*    G  19          2H5*        G  19   4.360  10.261  -5.268
  194    H4*    G  19           H4*        G  19   7.339  10.891  -5.443
  195    H3*    G  19           H3*        G  19   5.407  10.566  -3.138
  196    H2*    G  19           H2*        G  19   6.700  12.215  -1.919
  197   2HO*    G  19          2HO*        G  19   8.795  11.650  -2.920
  198    H1*    G  19           H1*        G  19   6.504  14.005  -3.879
  199    H8     G  19           H8         G  19   3.522  11.978  -4.774
  200    H1     G  19           H1         G  19   2.536  15.582   0.423
  201   1H2     G  19          1H2         G  19   4.454  16.417   1.144
  202   2H2     G  19          2H2         G  19   5.983  15.995   0.386
  203   1H5*    A  20          1H5*        A  20   8.800  11.648  -0.250
  204   2H5*    A  20          2H5*        A  20   9.119  10.116   0.582
  205    H4*    A  20           H4*        A  20   8.266  11.787   2.114
  206    H3*    A  20           H3*        A  20   6.284   9.537   1.639
  207    H2*    A  20           H2*        A  20   5.072  10.582   3.485
  208   2HO*    A  20          2HO*        A  20   7.028  11.169   4.636
  209    H1*    A  20           H1*        A  20   5.211  13.063   2.446
  210    H8     A  20           H8         A  20   5.140  11.079  -0.681
  211   1H6     A  20          1H6         A  20  -0.944  10.257   0.363
  212   2H6     A  20          2H6         A  20   0.337  10.120  -0.839
  213    H2     A  20           H2         A  20   0.914  11.686   4.108
  214   1H5*    U  21          1H5*        U  21   6.813   9.989   5.877
  215   2H5*    U  21          2H5*        U  21   6.921   8.383   6.628
  216    H4*    U  21           H4*        U  21   5.105   9.768   7.624
  217    H3*    U  21           H3*        U  21   4.145   7.397   5.997
  218    H2*    U  21           H2*        U  21   2.000   7.826   7.049
  219   2HO*    U  21          2HO*        U  21   2.815   8.725   9.076
  220    H1*    U  21           H1*        U  21   2.087  10.376   6.266
  221    H3     U  21           H3         U  21  -0.519   7.829   3.482
  222    H5     U  21           H5         U  21   3.302   7.859   1.743
  223    H6     U  21           H6         U  21   4.154   8.880   3.741
  224   1H5*    C  22          1H5*        C  22   2.884   5.236  10.397
  225   2H5*    C  22          2H5*        C  22   2.758   5.520   8.659
  226    H4*    C  22           H4*        C  22   0.704   6.444  10.718
  227    H3*    C  22           H3*        C  22   0.946   3.959   9.017
  228    H2*    C  22           H2*        C  22  -1.407   4.007   8.606
  229   2HO*    C  22          2HO*        C  22  -1.972   4.563  10.774
  230    H1*    C  22           H1*        C  22  -1.620   6.682   8.176
  231   1H4     C  22          1H4         C  22  -0.745   4.305   2.386
  232   2H4     C  22          2H4         C  22   0.992   4.496   2.540
  233    H5     C  22           H5         C  22   2.063   5.183   4.643
  234    H6     C  22           H6         C  22   1.655   5.863   6.925
  235   1H5*    A  23          1H5*        A  23  -1.963   0.326  10.784
  236   2H5*    A  23          2H5*        A  23  -1.337   0.991   9.267
  237    H4*    A  23           H4*        A  23  -4.062   1.593  10.495
  238    H3*    A  23           H3*        A  23  -3.084  -0.139   8.239
  239    H2*    A  23           H2*        A  23  -5.049   0.401   6.950
  240   2HO*    A  23          2HO*        A  23  -6.539   0.526   8.709
  241    H1*    A  23           H1*        A  23  -4.697   3.017   7.193
  242    H8     A  23           H8         A  23  -1.152   2.193   7.685
  243   1H6     A  23          1H6         A  23  -0.882   0.934   1.607
  244   2H6     A  23          2H6         A  23   0.074   1.220   3.064
  245    H2     A  23           H2         A  23  -5.139   1.126   2.783
  246   1H5*    G  24          1H5*        G  24  -6.215  -1.204   6.278
  247   2H5*    G  24          2H5*        G  24  -6.710  -2.853   6.679
  248    H4*    G  24           H4*        G  24  -5.924  -2.775   4.403
  249    H3*    G  24           H3*        G  24  -4.221  -4.305   6.343
  250    H2*    G  24           H2*        G  24  -2.679  -4.790   4.627
  251   2HO*    G  24          2HO*        G  24  -4.262  -5.482   3.137
  252    H1*    G  24           H1*        G  24  -2.881  -2.407   3.197
  253    H8     G  24           H8         G  24  -2.557  -1.004   6.515
  254    H1     G  24           H1         G  24   2.758  -4.252   4.909
  255   1H2     G  24          1H2         G  24   2.338  -5.541   3.128
  256   2H2     G  24          2H2         G  24   0.769  -5.558   2.363
  257   1H5*    U  25          1H5*        U  25  -6.760  -8.274   2.942
  258   2H5*    U  25          2H5*        U  25  -6.831  -6.526   2.765
  259    H4*    U  25           H4*        U  25  -9.148  -8.164   3.838
  260    H3*    U  25           H3*        U  25  -8.283  -8.574   1.389
  261    H2*    U  25           H2*        U  25  -7.826  -6.406   0.704
  262   2HO*    U  25          2HO*        U  25  -9.569  -7.237  -0.713
  263    H1*    U  25           H1*        U  25 -10.337  -5.264   1.716
  264    H3     U  25           H3         U  25  -8.854  -1.159   2.965
  265    H5     U  25           H5         U  25  -5.428  -3.145   1.601
  266    H6     U  25           H6         U  25  -6.683  -5.136   1.432
  267   1H5*    A  26          1H5*        A  26 -11.590  -8.417  -1.254
  268   2H5*    A  26          2H5*        A  26 -11.617 -10.090  -1.848
  269    H4*    A  26           H4*        A  26 -10.898  -8.564  -3.624
  270    H3*    A  26           H3*        A  26  -8.695 -10.362  -2.577
  271    H2*    A  26           H2*        A  26  -7.281  -9.375  -4.291
  272   2HO*    A  26          2HO*        A  26  -9.089  -9.296  -5.831
  273    H1*    A  26           H1*        A  26  -7.999  -6.805  -3.746
  274    H8     A  26           H8         A  26  -8.130  -8.593  -0.488
  275   1H6     A  26          1H6         A  26  -2.053  -7.493  -0.036
  276   2H6     A  26          2H6         A  26  -3.501  -7.974   0.830
  277    H2     A  26           H2         A  26  -3.291  -6.763  -4.241
  278   1H5*    U  27          1H5*        U  27  -8.351 -10.474  -6.726
  279   2H5*    U  27          2H5*        U  27  -8.051 -12.116  -7.312
  280    H4*    U  27           H4*        U  27  -6.284 -10.553  -8.030
  281    H3*    U  27           H3*        U  27  -5.370 -12.682  -6.062
  282    H2*    U  27           H2*        U  27  -3.142 -11.811  -6.475
  283   2HO*    U  27          2HO*        U  27  -3.559 -11.454  -8.744
  284    H1*    U  27           H1*        U  27  -3.841  -9.211  -6.232
  285    H3     U  27           H3         U  27  -1.551 -10.527  -2.484
  286    H5     U  27           H5         U  27  -5.576 -11.423  -1.697
  287    H6     U  27           H6         U  27  -6.089 -10.932  -3.998
  288   1H5*    A  28          1H5*        A  28  -2.738 -12.752  -9.494
  289   2H5*    A  28          2H5*        A  28  -2.313 -14.427  -9.889
  290    H4*    A  28           H4*        A  28  -0.309 -13.034  -9.565
  291    H3*    A  28           H3*        A  28  -0.704 -15.196  -7.462
  292    H2*    A  28           H2*        A  28   1.477 -14.509  -6.642
  293   2HO*    A  28          2HO*        A  28   2.273 -14.110  -8.843
  294    H1*    A  28           H1*        A  28   0.923 -11.874  -6.658
  295    H8     A  28           H8         A  28  -2.398 -13.470  -5.880
  296   1H6     A  28          1H6         A  28  -0.418 -13.751  -0.015
  297   2H6     A  28          2H6         A  28  -1.801 -13.918  -1.084
  298    H2     A  28           H2         A  28   3.079 -12.834  -2.596
  299   1H5*    U  29          1H5*        U  29   3.233 -15.484  -8.868
  300   2H5*    U  29          2H5*        U  29   3.759 -17.163  -9.076
  301    H4*    U  29           H4*        U  29   5.258 -15.905  -7.570
  302    H3*    U  29           H3*        U  29   3.692 -18.120  -6.184
  303    H2*    U  29           H2*        U  29   5.113 -17.584  -4.278
  304   2HO*    U  29          2HO*        U  29   6.974 -17.144  -5.663
  305    H1*    U  29           H1*        U  29   4.715 -14.919  -4.449
  306    H3     U  29           H3         U  29   2.239 -16.633  -1.002
  307    H5     U  29           H5         U  29  -0.247 -16.876  -4.373
  308    H6     U  29           H6         U  29   1.629 -16.264  -5.754
  309   1H5*    C  30          1H5*        C  30   7.734 -18.533  -5.212
  310   2H5*    C  30          2H5*        C  30   8.260 -20.221  -5.194
  311    H4*    C  30           H4*        C  30   8.716 -19.092  -3.047
  312    H3*    C  30           H3*        C  30   6.618 -21.299  -2.883
  313    H2*    C  30           H2*        C  30   6.785 -20.939  -0.481
  314   2HO*    C  30          2HO*        C  30   9.134 -20.447  -0.704
  315    H1*    C  30           H1*        C  30   6.553 -18.253  -0.658
  316   1H4     C  30          1H4         C  30   0.624 -20.378  -0.210
  317   2H4     C  30          2H4         C  30   0.439 -20.301  -1.958
  318    H5     C  30           H5         C  30   2.340 -19.870  -3.459
  319    H6     C  30           H6         C  30   4.688 -19.341  -3.538
  320   1H5*    C  31          1H5*        C  31   9.312 -21.888   0.191
  321   2H5*    C  31          2H5*        C  31   9.867 -23.570   0.233
  322    H4*    C  31           H4*        C  31   8.999 -22.945   2.433
  323    H3*    C  31           H3*        C  31   7.192 -24.829   0.868
  324    H2*    C  31           H2*        C  31   5.939 -25.036   2.926
  325   2HO*    C  31          2HO*        C  31   7.904 -24.954   4.259
  326    H1*    C  31           H1*        C  31   5.911 -22.346   3.398
  327   1H4     C  31          1H4         C  31   0.615 -23.645   0.240
  328   2H4     C  31          2H4         C  31   1.413 -23.355  -1.302
  329    H5     C  31           H5         C  31   3.832 -22.941  -1.477
  330    H6     C  31           H6         C  31   5.873 -22.693  -0.221
  331    H3T    C  31           H3T        C  31   9.254 -25.650   1.394
  Start of MODEL   16
    1   1H5*    G   1          1H5*        G   1  -3.495 -20.634   9.822
    2   2H5*    G   1          2H5*        G   1  -3.027 -21.601   8.433
    3    H4*    G   1           H4*        G   1  -1.471 -21.451  11.060
    4    H3*    G   1           H3*        G   1  -1.166 -19.939   8.471
    5    H2*    G   1           H2*        G   1   1.232 -20.034   8.777
    6   2HO*    G   1          2HO*        G   1   1.059 -19.804  11.096
    7    H1*    G   1           H1*        G   1   1.330 -22.636   9.231
    8    H8     G   1           H8         G   1  -1.676 -22.364   7.046
    9    H1     G   1           H1         G   1   3.878 -21.582   3.874
   10   1H2     G   1          1H2         G   1   5.475 -21.289   5.367
   11   2H2     G   1          2H2         G   1   5.083 -21.329   7.093
   12    H5T    G   1           H5T        G   1  -3.048 -23.447   9.903
   13   1H5*    G   2          1H5*        G   2   1.466 -18.101  11.132
   14   2H5*    G   2          2H5*        G   2   1.320 -16.344  11.030
   15    H4*    G   2           H4*        G   2   3.622 -17.066  10.716
   16    H3*    G   2           H3*        G   2   2.395 -15.801   8.255
   17    H2*    G   2           H2*        G   2   4.564 -16.060   7.229
   18   2HO*    G   2          2HO*        G   2   5.608 -15.573   9.275
   19    H1*    G   2           H1*        G   2   4.927 -18.601   7.916
   20    H8     G   2           H8         G   2   1.233 -18.459   7.446
   21    H1     G   2           H1         G   2   4.519 -18.099   1.917
   22   1H2     G   2          1H2         G   2   6.601 -17.617   2.392
   23   2H2     G   2          2H2         G   2   7.155 -17.572   4.084
   24   1H5*    A   3          1H5*        A   3   6.218 -14.054   8.759
   25   2H5*    A   3          2H5*        A   3   6.099 -12.297   8.628
   26    H4*    A   3           H4*        A   3   7.797 -13.168   7.131
   27    H3*    A   3           H3*        A   3   5.407 -11.932   5.777
   28    H2*    A   3           H2*        A   3   6.534 -12.323   3.686
   29   2HO*    A   3          2HO*        A   3   8.628 -11.830   4.750
   30    H1*    A   3           H1*        A   3   7.228 -14.838   4.152
   31    H8     A   3           H8         A   3   3.971 -14.619   5.952
   32   1H6     A   3          1H6         A   3   1.438 -15.489   0.334
   33   2H6     A   3          2H6         A   3   1.197 -15.492   2.073
   34    H2     A   3           H2         A   3   5.654 -14.367  -0.269
   35   1H5*    U   4          1H5*        U   4   8.788 -10.371   3.805
   36   2H5*    U   4          2H5*        U   4   8.662  -8.632   3.541
   37    H4*    U   4           H4*        U   4   9.014  -9.826   1.449
   38    H3*    U   4           H3*        U   4   6.320  -8.464   1.658
   39    H2*    U   4           H2*        U   4   5.981  -9.187  -0.632
   40   2HO*    U   4          2HO*        U   4   8.233  -8.793  -1.116
   41    H1*    U   4           H1*        U   4   6.782 -11.714  -0.287
   42    H3     U   4           H3         U   4   2.212 -11.533  -0.677
   43    H5     U   4           H5         U   4   2.979 -11.187   3.428
   44    H6     U   4           H6         U   4   5.316 -10.904   2.938
   45   1H5*    A   5          1H5*        A   5   7.922  -7.448  -2.111
   46   2H5*    A   5          2H5*        A   5   7.633  -5.748  -2.483
   47    H4*    A   5           H4*        A   5   6.777  -7.200  -4.236
   48    H3*    A   5           H3*        A   5   4.609  -5.698  -2.744
   49    H2*    A   5           H2*        A   5   3.077  -6.662  -4.298
   50   2HO*    A   5          2HO*        A   5   4.574  -6.446  -6.088
   51    H1*    A   5           H1*        A   5   3.997  -9.175  -4.119
   52    H8     A   5           H8         A   5   4.529  -7.807  -0.675
   53   1H6     A   5          1H6         A   5  -1.539  -8.958   0.072
   54   2H6     A   5          2H6         A   5  -0.029  -8.511   0.914
   55    H2     A   5           H2         A   5  -0.688  -9.171  -4.161
   56   1H5*    U   6          1H5*        U   6   3.803  -4.929  -6.905
   57   2H5*    U   6          2H5*        U   6   3.252  -3.245  -6.998
   58    H4*    U   6           H4*        U   6   1.611  -4.850  -7.887
   59    H3*    U   6           H3*        U   6   0.719  -3.512  -5.342
   60    H2*    U   6           H2*        U   6  -1.489  -4.397  -5.947
   61   2HO*    U   6          2HO*        U   6  -1.134  -4.364  -8.314
   62    H1*    U   6           H1*        U   6  -0.504  -6.834  -6.143
   63    H3     U   6           H3         U   6  -2.661  -6.145  -2.185
   64    H5     U   6           H5         U   6   1.315  -5.034  -1.427
   65    H6     U   6           H6         U   6   1.782  -5.252  -3.787
   66   1H5*    A   7          1H5*        A   7  -2.578  -0.786  -8.334
   67   2H5*    A   7          2H5*        A   7  -2.083  -1.467  -6.795
   68    H4*    A   7           H4*        A   7  -4.271  -2.584  -8.615
   69    H3*    A   7           H3*        A   7  -4.277  -0.803  -6.205
   70    H2*    A   7           H2*        A   7  -6.057  -1.955  -5.170
   71   2HO*    A   7          2HO*        A   7  -7.106  -2.209  -7.334
   72    H1*    A   7           H1*        A   7  -5.243  -4.459  -5.640
   73    H8     A   7           H8         A   7  -2.007  -2.665  -5.167
   74   1H6     A   7          1H6         A   7  -3.449  -2.871   0.885
   75   2H6     A   7          2H6         A   7  -2.137  -2.587  -0.285
   76    H2     A   7           H2         A   7  -6.989  -3.981  -1.367
   77   1H5*    U   8          1H5*        U   8  -8.358  -0.918  -6.382
   78   2H5*    U   8          2H5*        U   8  -8.864   0.772  -6.416
   79    H4*    U   8           H4*        U   8  -9.841  -0.359  -4.524
   80    H3*    U   8           H3*        U   8  -7.685   1.588  -3.678
   81    H2*    U   8           H2*        U   8  -8.477   1.310  -1.456
   82   2HO*    U   8          2HO*        U   8 -10.803   0.923  -2.105
   83    H1*    U   8           H1*        U   8  -8.415  -1.330  -1.613
   84    H3     U   8           H3         U   8  -4.794   0.212   0.709
   85    H5     U   8           H5         U   8  -3.564   0.125  -3.299
   86    H6     U   8           H6         U   8  -5.852  -0.301  -3.940
   87   1H5*    G   9          1H5*        G   9 -11.258   4.773  -2.303
   88   2H5*    G   9          2H5*        G   9  -9.678   4.045  -2.103
   89    H4*    G   9           H4*        G   9 -11.974   3.926  -0.094
   90    H3*    G   9           H3*        G   9  -9.545   5.692  -0.339
   91    H2*    G   9           H2*        G   9  -9.191   5.628   1.983
   92   2HO*    G   9          2HO*        G   9 -11.374   5.890   2.523
   93    H1*    G   9           H1*        G   9  -9.510   3.021   2.357
   94    H8     G   9           H8         G   9  -8.083   3.208  -1.130
   95    H1     G   9           H1         G   9  -3.644   4.004   3.434
   96   1H2     G   9          1H2         G   9  -4.606   4.506   5.345
   97   2H2     G   9          2H2         G   9  -6.372   4.421   5.484
   98   1H5*    A  10          1H5*        A  10 -10.660   9.855   2.535
   99   2H5*    A  10          2H5*        A  10  -9.202   9.050   1.986
  100    H4*    A  10           H4*        A  10 -10.642   8.648   4.645
  101    H3*    A  10           H3*        A  10  -8.085   9.813   3.630
  102    H2*    A  10           H2*        A  10  -6.831   9.065   5.510
  103   2HO*    A  10          2HO*        A  10  -8.723   9.392   6.959
  104    H1*    A  10           H1*        A  10  -7.623   6.559   5.362
  105    H8     A  10           H8         A  10  -8.133   7.317   1.798
  106   1H6     A  10          1H6         A  10  -2.036   6.750   1.160
  107   2H6     A  10          2H6         A  10  -3.607   6.830   0.342
  108    H2     A  10           H2         A  10  -2.773   7.358   5.395
  109   1H5*    U  11          1H5*        U  11  -7.944  10.877   7.569
  110   2H5*    U  11          2H5*        U  11  -7.630  12.601   7.828
  111    H4*    U  11           H4*        U  11  -5.880  11.152   8.835
  112    H3*    U  11           H3*        U  11  -5.041  12.857   6.492
  113    H2*    U  11           H2*        U  11  -2.761  12.250   6.952
  114   2HO*    U  11          2HO*        U  11  -3.064  12.032   9.335
  115    H1*    U  11           H1*        U  11  -3.260   9.734   7.031
  116    H3     U  11           H3         U  11  -1.519  10.614   2.882
  117    H5     U  11           H5         U  11  -5.666  10.816   2.427
  118    H6     U  11           H6         U  11  -5.872  10.678   4.797
  119   1H5*    A  12          1H5*        A  12  -2.415  15.731  10.026
  120   2H5*    A  12          2H5*        A  12  -2.917  15.248   8.412
  121    H4*    A  12           H4*        A  12  -0.370  14.375   9.846
  122    H3*    A  12           H3*        A  12  -1.072  16.281   7.626
  123    H2*    A  12           H2*        A  12   0.746  15.612   6.351
  124   2HO*    A  12          2HO*        A  12   2.188  15.568   8.200
  125    H1*    A  12           H1*        A  12   0.674  13.009   6.647
  126    H8     A  12           H8         A  12  -2.812  14.314   6.583
  127   1H6     A  12          1H6         A  12  -2.201  13.922   0.446
  128   2H6     A  12          2H6         A  12  -3.369  14.194   1.769
  129    H2     A  12           H2         A  12   1.725  13.294   2.215
  130   1H5*    U  13          1H5*        U  13   3.298  16.816   8.423
  131   2H5*    U  13          2H5*        U  13   3.601  18.541   8.168
  132    H4*    U  13           H4*        U  13   5.011  17.099   6.741
  133    H3*    U  13           H3*        U  13   3.066  18.873   5.257
  134    H2*    U  13           H2*        U  13   4.254  18.148   3.303
  135   2HO*    U  13          2HO*        U  13   6.313  18.143   4.161
  136    H1*    U  13           H1*        U  13   4.242  15.523   3.891
  137    H3     U  13           H3         U  13   1.205  16.300   0.540
  138    H5     U  13           H5         U  13  -0.840  17.153   4.101
  139    H6     U  13           H6         U  13   1.252  17.156   5.249
  140   1H5*    A  14          1H5*        A  14   7.406  19.440   4.244
  141   2H5*    A  14          2H5*        A  14   7.587  21.118   3.662
  142    H4*    A  14           H4*        A  14   8.551  19.439   2.164
  143    H3*    A  14           H3*        A  14   6.231  20.972   0.904
  144    H2*    A  14           H2*        A  14   6.853  19.912  -1.035
  145   2HO*    A  14          2HO*        A  14   9.133  20.145  -0.449
  146    H1*    A  14           H1*        A  14   6.964  17.455  -0.066
  147    H8     A  14           H8         A  14   4.328  19.366   1.807
  148   1H6     A  14          1H6         A  14   0.800  18.409  -3.242
  149   2H6     A  14          2H6         A  14   0.730  18.959  -1.531
  150    H2     A  14           H2         A  14   4.797  17.437  -4.301
  151   1H5*    A  15          1H5*        A  15  10.099  20.979  -1.837
  152   2H5*    A  15          2H5*        A  15   9.953  22.644  -2.396
  153    H4*    A  15           H4*        A  15  10.216  21.638  -4.376
  154    H3*    A  15           H3*        A  15   7.504  22.362  -3.980
  155    H2*    A  15           H2*        A  15   6.703  20.233  -3.770
  156   2HO*    A  15          2HO*        A  15   6.921  20.795  -6.520
  157    H1*    A  15           H1*        A  15   8.709  19.214  -5.773
  158    H8     A  15           H8         A  15   8.403  18.326  -2.186
  159   1H6     A  15          1H6         A  15   6.502  12.760  -4.289
  160   2H6     A  15          2H6         A  15   7.036  13.604  -2.817
  161    H2     A  15           H2         A  15   6.528  15.472  -7.609
  162   1H5*    U  16          1H5*        U  16   8.162  22.453  -9.620
  163   2H5*    U  16          2H5*        U  16   6.863  22.839  -8.486
  164    H4*    U  16           H4*        U  16   5.923  21.990 -10.439
  165    H3*    U  16           H3*        U  16   5.542  20.546  -8.027
  166    H2*    U  16           H2*        U  16   5.958  18.447  -8.407
  167   2HO*    U  16          2HO*        U  16   4.362  18.744 -10.700
  168    H1*    U  16           H1*        U  16   6.546  18.423 -11.234
  169    H3     U  16           H3         U  16  10.937  17.194 -11.021
  170    H5     U  16           H5         U  16   9.901  18.056  -7.062
  171    H6     U  16           H6         U  16   7.812  18.867  -7.798
  172   1H5*    U  17          1H5*        U  17   1.819  19.081  -9.321
  173   2H5*    U  17          2H5*        U  17   2.437  18.530 -10.870
  174    H4*    U  17           H4*        U  17  -0.404  19.425 -10.489
  175    H3*    U  17           H3*        U  17   0.775  17.011  -9.484
  176    H2*    U  17           H2*        U  17   0.589  15.431 -11.109
  177   2HO*    U  17          2HO*        U  17  -1.866  16.412 -10.978
  178    H1*    U  17           H1*        U  17  -0.074  16.810 -13.417
  179    H3     U  17           H3         U  17   4.027  17.150 -15.351
  180    H5     U  17           H5         U  17   4.767  15.806 -11.449
  181    H6     U  17           H6         U  17   2.560  16.209 -10.881
  182   1H5*    U  18          1H5*        U  18  -2.104  14.964  -9.004
  183   2H5*    U  18          2H5*        U  18  -2.866  15.030  -7.434
  184    H4*    U  18           H4*        U  18  -0.746  13.743  -6.580
  185    H3*    U  18           H3*        U  18  -0.187  13.835  -9.412
  186    H2*    U  18           H2*        U  18  -0.681  11.735 -10.134
  187   2HO*    U  18          2HO*        U  18   0.656  10.638  -8.881
  188    H1*    U  18           H1*        U  18  -2.686  10.899  -8.456
  189    H3     U  18           H3         U  18  -6.412  13.160 -10.047
  190    H5     U  18           H5         U  18  -3.271  14.451 -12.440
  191    H6     U  18           H6         U  18  -1.702  13.352 -10.977
  192   1H5*    G  19          1H5*        G  19   4.314  13.674  -7.607
  193   2H5*    G  19          2H5*        G  19   5.211  12.192  -7.253
  194    H4*    G  19           H4*        G  19   4.475  13.408  -5.285
  195    H3*    G  19           H3*        G  19   3.220  10.602  -5.272
  196    H2*    G  19           H2*        G  19   2.514  11.113  -3.278
  197   2HO*    G  19          2HO*        G  19   4.602  12.087  -2.599
  198    H1*    G  19           H1*        G  19   1.700  13.644  -3.739
  199    H8     G  19           H8         G  19   0.846  11.322  -6.615
  200    H1     G  19           H1         G  19  -2.977  10.699  -1.480
  201   1H2     G  19          1H2         G  19  -2.061  11.756   0.157
  202   2H2     G  19          2H2         G  19  -0.577  12.701  -0.048
  203   1H5*    A  20          1H5*        A  20   7.180  10.588  -2.678
  204   2H5*    A  20          2H5*        A  20   7.511   8.871  -2.318
  205    H4*    A  20           H4*        A  20   7.424  10.301  -0.289
  206    H3*    A  20           H3*        A  20   5.108   8.363  -0.461
  207    H2*    A  20           H2*        A  20   4.570   9.053   1.782
  208   2HO*    A  20          2HO*        A  20   6.925   9.647   2.341
  209    H1*    A  20           H1*        A  20   4.467  11.581   1.028
  210    H8     A  20           H8         A  20   3.553   9.871  -2.191
  211   1H6     A  20          1H6         A  20  -1.968   8.964   0.567
  212   2H6     A  20          2H6         A  20  -1.091   8.836  -0.972
  213    H2     A  20           H2         A  20   0.755  10.372   3.588
  214   1H5*    U  21          1H5*        U  21   7.025   5.842   3.528
  215   2H5*    U  21          2H5*        U  21   5.729   6.342   2.455
  216    H4*    U  21           H4*        U  21   6.208   7.462   5.259
  217    H3*    U  21           H3*        U  21   4.383   5.243   4.301
  218    H2*    U  21           H2*        U  21   2.700   5.964   5.714
  219   2HO*    U  21          2HO*        U  21   4.084   6.419   7.496
  220    H1*    U  21           H1*        U  21   2.867   8.599   5.225
  221    H3     U  21           H3         U  21  -0.829   6.869   3.146
  222    H5     U  21           H5         U  21   2.263   6.506   0.354
  223    H6     U  21           H6         U  21   3.855   7.192   2.055
  224   1H5*    C  22          1H5*        C  22   2.990   2.642   8.495
  225   2H5*    C  22          2H5*        C  22   2.436   2.897   6.854
  226    H4*    C  22           H4*        C  22   1.673   4.551   9.298
  227    H3*    C  22           H3*        C  22   0.368   2.488   7.563
  228    H2*    C  22           H2*        C  22  -1.773   3.601   7.724
  229   2HO*    C  22          2HO*        C  22  -1.293   4.256   9.955
  230    H1*    C  22           H1*        C  22  -0.843   6.016   7.048
  231   1H4     C  22          1H4         C  22  -1.734   3.251   1.516
  232   2H4     C  22          2H4         C  22   0.012   3.010   1.313
  233    H5     C  22           H5         C  22   1.569   3.478   3.143
  234    H6     C  22           H6         C  22   1.718   4.220   5.421
  235   1H5*    A  23          1H5*        A  23  -2.636   2.710  10.609
  236   2H5*    A  23          2H5*        A  23  -2.939   1.044  11.135
  237    H4*    A  23           H4*        A  23  -4.975   2.112  10.297
  238    H3*    A  23           H3*        A  23  -3.989  -0.162   8.601
  239    H2*    A  23           H2*        A  23  -6.076   0.089   7.357
  240   2HO*    A  23          2HO*        A  23  -7.297   0.944   9.333
  241    H1*    A  23           H1*        A  23  -5.662   2.662   6.918
  242    H8     A  23           H8         A  23  -2.091   1.682   7.205
  243   1H6     A  23          1H6         A  23  -2.569  -0.168   1.347
  244   2H6     A  23          2H6         A  23  -1.483   0.142   2.720
  245    H2     A  23           H2         A  23  -6.650   0.223   2.919
  246   1H5*    G  24          1H5*        G  24  -8.250  -0.667   7.998
  247   2H5*    G  24          2H5*        G  24  -8.944  -2.041   8.865
  248    H4*    G  24           H4*        G  24  -9.133  -2.249   6.436
  249    H3*    G  24           H3*        G  24  -7.470  -4.325   7.847
  250    H2*    G  24           H2*        G  24  -7.210  -5.369   5.691
  251   2HO*    G  24          2HO*        G  24  -9.305  -4.841   4.888
  252    H1*    G  24           H1*        G  24  -6.376  -3.201   4.395
  253    H8     G  24           H8         G  24  -4.886  -1.773   7.166
  254    H1     G  24           H1         G  24  -2.221  -7.587   6.488
  255   1H2     G  24          1H2         G  24  -3.574  -8.845   5.138
  256   2H2     G  24          2H2         G  24  -5.039  -8.088   4.505
  257   1H5*    U  25          1H5*        U  25 -11.805  -5.161   5.666
  258   2H5*    U  25          2H5*        U  25 -12.088  -6.909   5.734
  259    H4*    U  25           H4*        U  25 -12.697  -5.923   3.573
  260    H3*    U  25           H3*        U  25 -10.491  -8.004   3.352
  261    H2*    U  25           H2*        U  25 -10.376  -7.560   1.116
  262   2HO*    U  25          2HO*        U  25 -12.606  -7.587   0.808
  263    H1*    U  25           H1*        U  25 -10.624  -4.860   1.150
  264    H3     U  25           H3         U  25  -6.201  -4.201   0.764
  265    H5     U  25           H5         U  25  -6.416  -7.042   3.796
  266    H6     U  25           H6         U  25  -8.817  -7.039   3.613
  267   1H5*    A  26          1H5*        A  26 -11.392 -11.376   0.226
  268   2H5*    A  26          2H5*        A  26 -10.200 -10.225   0.794
  269    H4*    A  26           H4*        A  26 -11.926  -9.861  -1.698
  270    H3*    A  26           H3*        A  26  -9.143 -10.905  -1.252
  271    H2*    A  26           H2*        A  26  -8.333  -9.728  -3.181
  272   2HO*    A  26          2HO*        A  26 -10.437 -10.151  -4.282
  273    H1*    A  26           H1*        A  26  -9.445  -7.383  -2.600
  274    H8     A  26           H8         A  26  -8.824  -8.748   0.828
  275   1H6     A  26          1H6         A  26  -2.951  -6.804  -0.125
  276   2H6     A  26          2H6         A  26  -4.117  -7.300   1.096
  277    H2     A  26           H2         A  26  -4.997  -6.666  -3.937
  278   1H5*    U  27          1H5*        U  27  -9.531 -11.390  -5.323
  279   2H5*    U  27          2H5*        U  27  -9.021 -13.011  -5.808
  280    H4*    U  27           H4*        U  27  -7.747 -11.337  -6.987
  281    H3*    U  27           H3*        U  27  -6.060 -12.907  -5.018
  282    H2*    U  27           H2*        U  27  -4.196 -11.723  -5.988
  283   2HO*    U  27          2HO*        U  27  -5.097 -11.826  -8.105
  284    H1*    U  27           H1*        U  27  -5.277  -9.299  -5.816
  285    H3     U  27           H3         U  27  -2.222  -9.876  -2.436
  286    H5     U  27           H5         U  27  -5.849 -11.227  -0.853
  287    H6     U  27           H6         U  27  -6.826 -11.064  -3.054
  288   1H5*    A  28          1H5*        A  28  -4.140 -13.328  -8.869
  289   2H5*    A  28          2H5*        A  28  -3.591 -15.006  -9.050
  290    H4*    A  28           H4*        A  28  -1.764 -13.469  -9.422
  291    H3*    A  28           H3*        A  28  -1.425 -15.113  -6.904
  292    H2*    A  28           H2*        A  28   0.727 -14.042  -6.704
  293   2HO*    A  28          2HO*        A  28   1.019 -14.086  -9.061
  294    H1*    A  28           H1*        A  28  -0.154 -11.556  -7.051
  295    H8     A  28           H8         A  28  -3.069 -13.218  -5.400
  296   1H6     A  28          1H6         A  28  -0.018 -12.179  -0.115
  297   2H6     A  28          2H6         A  28  -1.590 -12.522  -0.852
  298    H2     A  28           H2         A  28   2.850 -11.671  -3.384
  299   1H5*    U  29          1H5*        U  29   2.143 -15.364  -9.132
  300   2H5*    U  29          2H5*        U  29   2.841 -16.988  -9.084
  301    H4*    U  29           H4*        U  29   4.419 -15.296  -8.286
  302    H3*    U  29           H3*        U  29   3.535 -17.246  -6.137
  303    H2*    U  29           H2*        U  29   5.198 -16.123  -4.746
  304   2HO*    U  29          2HO*        U  29   6.596 -15.790  -6.609
  305    H1*    U  29           H1*        U  29   4.329 -13.662  -5.260
  306    H3     U  29           H3         U  29   2.910 -15.082  -1.163
  307    H5     U  29           H5         U  29  -0.148 -16.211  -3.792
  308    H6     U  29           H6         U  29   1.272 -15.611  -5.633
  309   1H5*    C  30          1H5*        C  30   7.706 -16.988  -6.060
  310   2H5*    C  30          2H5*        C  30   8.459 -18.579  -5.925
  311    H4*    C  30           H4*        C  30   9.224 -17.056  -4.166
  312    H3*    C  30           H3*        C  30   7.619 -19.424  -3.147
  313    H2*    C  30           H2*        C  30   8.166 -18.602  -0.932
  314   2HO*    C  30          2HO*        C  30  10.275 -17.836  -1.863
  315    H1*    C  30           H1*        C  30   7.427 -16.079  -1.392
  316   1H4     C  30          1H4         C  30   2.190 -18.807   0.510
  317   2H4     C  30          2H4         C  30   1.559 -18.951  -1.151
  318    H5     C  30           H5         C  30   3.024 -18.601  -3.056
  319    H6     C  30           H6         C  30   5.211 -17.798  -3.683
  320   1H5*    C  31          1H5*        C  31  10.936 -19.106  -0.727
  321   2H5*    C  31          2H5*        C  31  11.787 -20.648  -0.666
  322    H4*    C  31           H4*        C  31  11.340 -19.940   1.589
  323    H3*    C  31           H3*        C  31   9.525 -22.222   0.699
  324    H2*    C  31           H2*        C  31   8.801 -22.363   2.957
  325   2HO*    C  31          2HO*        C  31  11.042 -21.852   3.719
  326    H1*    C  31           H1*        C  31   8.450 -19.682   3.243
  327   1H4     C  31          1H4         C  31   2.909 -21.872   1.559
  328   2H4     C  31          2H4         C  31   3.254 -21.710  -0.177
  329    H5     C  31           H5         C  31   5.467 -21.136  -0.989
  330    H6     C  31           H6         C  31   7.677 -20.457  -0.287
  331    H3T    C  31           H3T        C  31  11.738 -22.717   0.741
  Start of MODEL   17
    1   1H5*    G   1          1H5*        G   1  -5.984 -24.372   7.232
    2   2H5*    G   1          2H5*        G   1  -6.409 -22.665   7.457
    3    H4*    G   1           H4*        G   1  -4.582 -23.185   8.929
    4    H3*    G   1           H3*        G   1  -3.735 -21.514   6.554
    5    H2*    G   1           H2*        G   1  -1.586 -21.343   7.632
    6   2HO*    G   1          2HO*        G   1  -2.454 -21.219   9.767
    7    H1*    G   1           H1*        G   1  -1.341 -23.940   8.103
    8    H8     G   1           H8         G   1  -3.334 -24.056   4.975
    9    H1     G   1           H1         G   1   2.721 -22.112   4.016
   10   1H2     G   1          1H2         G   1   3.623 -21.600   5.965
   11   2H2     G   1          2H2         G   1   2.710 -21.812   7.460
   12    H5T    G   1           H5T        G   1  -5.249 -22.179   5.557
   13   1H5*    G   2          1H5*        G   2  -2.382 -19.612  10.018
   14   2H5*    G   2          2H5*        G   2  -2.620 -17.866   9.944
   15    H4*    G   2           H4*        G   2  -0.281 -18.462  10.422
   16    H3*    G   2           H3*        G   2  -0.765 -17.050   7.783
   17    H2*    G   2           H2*        G   2   1.666 -17.056   7.547
   18   2HO*    G   2          2HO*        G   2   1.939 -16.744   9.863
   19    H1*    G   2           H1*        G   2   1.980 -19.629   8.100
   20    H8     G   2           H8         G   2  -1.352 -19.704   6.457
   21    H1     G   2           H1         G   2   3.456 -18.537   2.338
   22   1H2     G   2          1H2         G   2   5.243 -17.965   3.468
   23   2H2     G   2          2H2         G   2   5.245 -17.996   5.232
   24   1H5*    A   3          1H5*        A   3   2.514 -15.215   9.791
   25   2H5*    A   3          2H5*        A   3   2.419 -13.456   9.725
   26    H4*    A   3           H4*        A   3   4.571 -14.285   8.878
   27    H3*    A   3           H3*        A   3   2.798 -12.910   6.840
   28    H2*    A   3           H2*        A   3   4.638 -13.191   5.291
   29   2HO*    A   3          2HO*        A   3   6.224 -12.827   7.000
   30    H1*    A   3           H1*        A   3   5.061 -15.758   5.810
   31    H8     A   3           H8         A   3   1.371 -15.516   6.308
   32   1H6     A   3          1H6         A   3   0.956 -15.758   0.136
   33   2H6     A   3          2H6         A   3   0.099 -15.847   1.674
   34    H2     A   3           H2         A   3   5.177 -14.943   1.158
   35   1H5*    U   4          1H5*        U   4   6.687 -11.349   6.441
   36   2H5*    U   4          2H5*        U   4   6.682  -9.596   6.243
   37    H4*    U   4           H4*        U   4   7.827 -10.732   4.383
   38    H3*    U   4           H3*        U   4   5.281  -9.248   3.589
   39    H2*    U   4           H2*        U   4   5.895  -9.831   1.334
   40   2HO*    U   4          2HO*        U   4   8.164  -9.554   1.775
   41    H1*    U   4           H1*        U   4   6.382 -12.410   1.822
   42    H3     U   4           H3         U   4   2.327 -11.917  -0.264
   43    H5     U   4           H5         U   4   1.482 -11.818   3.841
   44    H6     U   4           H6         U   4   3.832 -11.680   4.283
   45   1H5*    A   5          1H5*        A   5   8.424  -8.153   0.995
   46   2H5*    A   5          2H5*        A   5   8.425  -6.419   0.693
   47    H4*    A   5           H4*        A   5   8.387  -7.677  -1.390
   48    H3*    A   5           H3*        A   5   5.864  -6.045  -0.909
   49    H2*    A   5           H2*        A   5   5.111  -6.756  -2.989
   50   2HO*    A   5          2HO*        A   5   7.135  -6.494  -4.038
   51    H1*    A   5           H1*        A   5   5.781  -9.353  -2.755
   52    H8     A   5           H8         A   5   4.785  -8.329   0.717
   53   1H6     A   5          1H6         A   5  -0.990  -9.617  -1.149
   54   2H6     A   5          2H6         A   5   0.050  -9.272   0.239
   55    H2     A   5           H2         A   5   1.548  -9.428  -4.739
   56   1H5*    U   6          1H5*        U   6   5.650  -2.773  -4.768
   57   2H5*    U   6          2H5*        U   6   4.576  -3.623  -3.669
   58    H4*    U   6           H4*        U   6   5.430  -4.575  -6.440
   59    H3*    U   6           H3*        U   6   3.028  -3.290  -5.200
   60    H2*    U   6           H2*        U   6   1.518  -4.615  -6.486
   61   2HO*    U   6          2HO*        U   6   2.968  -4.488  -8.355
   62    H1*    U   6           H1*        U   6   2.726  -6.962  -6.037
   63    H3     U   6           H3         U   6  -0.979  -6.549  -3.400
   64    H5     U   6           H5         U   6   2.262  -5.365  -1.014
   65    H6     U   6           H6         U   6   3.668  -5.342  -2.981
   66   1H5*    A   7          1H5*        A   7   1.498  -3.192  -9.018
   67   2H5*    A   7          2H5*        A   7   1.059  -1.505  -9.360
   68    H4*    A   7           H4*        A   7  -0.892  -2.940  -9.536
   69    H3*    A   7           H3*        A   7  -0.973  -1.054  -7.152
   70    H2*    A   7           H2*        A   7  -3.213  -1.864  -6.811
   71   2HO*    A   7          2HO*        A   7  -3.594  -1.935  -9.129
   72    H1*    A   7           H1*        A   7  -2.633  -4.460  -7.101
   73    H8     A   7           H8         A   7   0.432  -3.093  -5.467
   74   1H6     A   7          1H6         A   7  -2.962  -3.381  -0.233
   75   2H6     A   7          2H6         A   7  -1.320  -3.098  -0.876
   76    H2     A   7           H2         A   7  -5.617  -4.145  -3.565
   77   1H5*    U   8          1H5*        U   8  -4.795  -0.267  -8.939
   78   2H5*    U   8          2H5*        U   8  -4.933   1.499  -8.912
   79    H4*    U   8           H4*        U   8  -6.789   0.483  -7.731
   80    H3*    U   8           H3*        U   8  -4.887   1.821  -5.777
   81    H2*    U   8           H2*        U   8  -6.750   1.510  -4.230
   82   2HO*    U   8          2HO*        U   8  -8.359   1.469  -6.235
   83    H1*    U   8           H1*        U   8  -6.856  -1.057  -4.747
   84    H3     U   8           H3         U   8  -4.499  -0.229  -0.879
   85    H5     U   8           H5         U   8  -1.630  -0.173  -3.941
   86    H6     U   8           H6         U   8  -3.437  -0.229  -5.572
   87   1H5*    G   9          1H5*        G   9  -9.867   2.827  -5.488
   88   2H5*    G   9          2H5*        G   9 -10.056   4.582  -5.743
   89    H4*    G   9           H4*        G   9 -10.824   3.877  -3.551
   90    H3*    G   9           H3*        G   9  -8.278   5.527  -3.349
   91    H2*    G   9           H2*        G   9  -8.671   5.370  -0.964
   92   2HO*    G   9          2HO*        G   9 -10.993   5.547  -1.270
   93    H1*    G   9           H1*        G   9  -9.126   2.740  -0.918
   94    H8     G   9           H8         G   9  -6.573   3.321  -3.723
   95    H1     G   9           H1         G   9  -4.131   3.664   2.245
   96   1H2     G   9          1H2         G   9  -5.772   3.797   3.713
   97   2H2     G   9          2H2         G   9  -7.453   3.614   3.181
   98   1H5*    A  10          1H5*        A  10 -11.189   6.967  -0.525
   99   2H5*    A  10          2H5*        A  10 -11.116   8.729  -0.409
  100    H4*    A  10           H4*        A  10 -10.812   7.527   1.763
  101    H3*    A  10           H3*        A  10  -8.564   9.301   0.787
  102    H2*    A  10           H2*        A  10  -7.504   8.830   2.905
  103   2HO*    A  10          2HO*        A  10  -9.591   8.853   4.016
  104    H1*    A  10           H1*        A  10  -7.832   6.191   2.838
  105    H8     A  10           H8         A  10  -7.471   6.948  -0.788
  106   1H6     A  10          1H6         A  10  -1.371   7.242   0.301
  107   2H6     A  10          2H6         A  10  -2.627   7.216  -0.936
  108    H2     A  10           H2         A  10  -3.403   7.383   4.187
  109   1H5*    U  11          1H5*        U  11  -9.352  10.179   4.924
  110   2H5*    U  11          2H5*        U  11  -9.275  11.925   5.183
  111    H4*    U  11           H4*        U  11  -7.655  10.603   6.575
  112    H3*    U  11           H3*        U  11  -6.612  12.663   4.634
  113    H2*    U  11           H2*        U  11  -4.417  12.185   5.553
  114   2HO*    U  11          2HO*        U  11  -5.266  12.018   7.696
  115    H1*    U  11           H1*        U  11  -4.656   9.514   5.599
  116    H3     U  11           H3         U  11  -1.643  10.566   2.369
  117    H5     U  11           H5         U  11  -5.372  10.673   0.455
  118    H6     U  11           H6         U  11  -6.449  10.485   2.606
  119   1H5*    A  12          1H5*        A  12  -4.686  13.308   8.612
  120   2H5*    A  12          2H5*        A  12  -4.668  15.063   8.841
  121    H4*    A  12           H4*        A  12  -2.417  14.065   9.068
  122    H3*    A  12           H3*        A  12  -2.893  16.011   6.814
  123    H2*    A  12           H2*        A  12  -0.590  15.743   6.251
  124   2HO*    A  12          2HO*        A  12  -0.052  15.765   8.598
  125    H1*    A  12           H1*        A  12  -0.353  13.140   6.612
  126    H8     A  12           H8         A  12  -3.614  13.897   4.952
  127   1H6     A  12          1H6         A  12  -0.252  13.750  -0.310
  128   2H6     A  12          2H6         A  12  -1.902  13.762   0.361
  129    H2     A  12           H2         A  12   2.515  13.930   3.079
  130   1H5*    U  13          1H5*        U  13   0.949  17.150   8.719
  131   2H5*    U  13          2H5*        U  13   0.879  18.911   8.916
  132    H4*    U  13           H4*        U  13   2.864  18.213   7.619
  133    H3*    U  13           H3*        U  13   0.759  19.902   6.274
  134    H2*    U  13           H2*        U  13   2.148  19.865   4.298
  135   2HO*    U  13          2HO*        U  13   4.077  20.157   5.519
  136    H1*    U  13           H1*        U  13   2.935  17.398   4.353
  137    H3     U  13           H3         U  13   0.281  17.281   0.748
  138    H5     U  13           H5         U  13  -2.359  16.964   4.003
  139    H6     U  13           H6         U  13  -0.534  17.550   5.459
  140   1H5*    A  14          1H5*        A  14   4.787  21.449   5.365
  141   2H5*    A  14          2H5*        A  14   4.761  23.183   5.609
  142    H4*    A  14           H4*        A  14   5.571  22.469   3.382
  143    H3*    A  14           H3*        A  14   3.773  24.531   4.063
  144    H2*    A  14           H2*        A  14   1.937  23.661   3.231
  145   2HO*    A  14          2HO*        A  14   3.146  25.106   1.314
  146    H1*    A  14           H1*        A  14   3.241  22.291   0.924
  147    H8     A  14           H8         A  14   1.230  21.634   4.040
  148   1H6     A  14          1H6         A  14  -2.963  19.207   0.134
  149   2H6     A  14          2H6         A  14  -2.653  19.637   1.813
  150    H2     A  14           H2         A  14   0.489  20.513  -2.207
  151   1H5*    A  15          1H5*        A  15   7.812  23.870  -0.141
  152   2H5*    A  15          2H5*        A  15   6.068  24.107  -0.231
  153    H4*    A  15           H4*        A  15   7.231  21.330   0.176
  154    H3*    A  15           H3*        A  15   8.006  22.711  -1.955
  155    H2*    A  15           H2*        A  15   5.918  23.676  -2.389
  156   2HO*    A  15          2HO*        A  15   6.856  22.228  -4.295
  157    H1*    A  15           H1*        A  15   4.608  20.973  -2.317
  158    H8     A  15           H8         A  15   3.952  23.938  -0.111
  159   1H6     A  15          1H6         A  15  -0.970  24.934  -3.787
  160   2H6     A  15          2H6         A  15  -0.114  25.486  -2.320
  161    H2     A  15           H2         A  15   1.271  21.629  -5.478
  162   1H5*    U  16          1H5*        U  16   7.750  18.294  -5.634
  163   2H5*    U  16          2H5*        U  16   7.686  19.903  -6.382
  164    H4*    U  16           H4*        U  16   6.079  18.377  -7.328
  165    H3*    U  16           H3*        U  16   5.086  20.780  -5.786
  166    H2*    U  16           H2*        U  16   3.012  20.158  -5.567
  167   2HO*    U  16          2HO*        U  16   3.194  19.161  -8.185
  168    H1*    U  16           H1*        U  16   3.289  17.438  -6.552
  169    H3     U  16           H3         U  16   0.540  16.492  -3.046
  170    H5     U  16           H5         U  16   3.398  19.049  -1.338
  171    H6     U  16           H6         U  16   4.461  19.241  -3.530
  172   1H5*    U  17          1H5*        U  17   4.584  17.747 -10.911
  173   2H5*    U  17          2H5*        U  17   3.099  18.462 -10.354
  174    H4*    U  17           H4*        U  17   4.368  15.921  -9.219
  175    H3*    U  17           H3*        U  17   2.565  16.290 -11.516
  176    H2*    U  17           H2*        U  17   0.646  15.278 -10.717
  177   2HO*    U  17          2HO*        U  17   2.305  13.448 -10.201
  178    H1*    U  17           H1*        U  17   0.952  15.387  -7.957
  179    H3     U  17           H3         U  17  -2.254  18.570  -7.696
  180    H5     U  17           H5         U  17  -0.062  19.724 -11.084
  181    H6     U  17           H6         U  17   1.364  17.833 -10.711
  182   1H5*    U  18          1H5*        U  18   6.508  12.794 -10.121
  183   2H5*    U  18          2H5*        U  18   5.002  13.316  -9.426
  184    H4*    U  18           H4*        U  18   7.683  14.520  -8.599
  185    H3*    U  18           H3*        U  18   6.362  11.991  -7.693
  186    H2*    U  18           H2*        U  18   6.375  12.532  -5.451
  187   2HO*    U  18          2HO*        U  18   8.622  13.190  -5.453
  188    H1*    U  18           H1*        U  18   5.959  15.229  -5.554
  189    H3     U  18           H3         U  18   1.791  14.183  -4.133
  190    H5     U  18           H5         U  18   2.344  11.686  -7.449
  191    H6     U  18           H6         U  18   4.478  12.570  -7.720
  192   1H5*    G  19          1H5*        G  19   8.648   9.583  -4.384
  193   2H5*    G  19          2H5*        G  19   7.231  10.604  -4.663
  194    H4*    G  19           H4*        G  19   9.566  11.405  -2.881
  195    H3*    G  19           H3*        G  19   6.960  10.004  -2.263
  196    H2*    G  19           H2*        G  19   6.879  11.229  -0.175
  197   2HO*    G  19          2HO*        G  19   9.247  11.046   0.032
  198    H1*    G  19           H1*        G  19   7.432  13.615  -1.289
  199    H8     G  19           H8         G  19   5.481  11.095  -3.357
  200    H1     G  19           H1         G  19   1.980  15.489  -0.245
  201   1H2     G  19          1H2         G  19   3.345  16.783   0.973
  202   2H2     G  19          2H2         G  19   5.066  16.465   0.951
  203   1H5*    A  20          1H5*        A  20   9.058   9.628   1.468
  204   2H5*    A  20          2H5*        A  20   8.892   7.922   1.929
  205    H4*    A  20           H4*        A  20   8.138   9.396   3.716
  206    H3*    A  20           H3*        A  20   5.939   7.745   2.437
  207    H2*    A  20           H2*        A  20   4.533   8.643   4.212
  208   2HO*    A  20          2HO*        A  20   6.256   8.555   5.773
  209    H1*    A  20           H1*        A  20   5.229  11.180   3.843
  210    H8     A  20           H8         A  20   5.583   9.828   0.393
  211   1H6     A  20          1H6         A  20  -0.601  10.184  -0.006
  212   2H6     A  20          2H6         A  20   0.914   9.988  -0.914
  213    H2     A  20           H2         A  20   0.467  10.571   4.218
  214   1H5*    U  21          1H5*        U  21   5.764   7.228   6.679
  215   2H5*    U  21          2H5*        U  21   5.458   5.528   7.085
  216    H4*    U  21           H4*        U  21   3.786   7.109   8.053
  217    H3*    U  21           H3*        U  21   2.752   5.016   6.109
  218    H2*    U  21           H2*        U  21   0.566   5.836   6.686
  219   2HO*    U  21          2HO*        U  21   1.117   6.164   8.900
  220    H1*    U  21           H1*        U  21   1.114   8.405   6.370
  221    H3     U  21           H3         U  21  -1.170   6.835   2.710
  222    H5     U  21           H5         U  21   2.871   6.529   1.698
  223    H6     U  21           H6         U  21   3.427   7.043   3.968
  224   1H5*    C  22          1H5*        C  22   0.375   4.871   9.670
  225   2H5*    C  22          2H5*        C  22   0.150   3.184  10.161
  226    H4*    C  22           H4*        C  22  -1.993   4.374   9.878
  227    H3*    C  22           H3*        C  22  -1.505   2.042   7.993
  228    H2*    C  22           H2*        C  22  -3.689   2.420   7.184
  229   2HO*    C  22          2HO*        C  22  -4.649   2.780   9.196
  230    H1*    C  22           H1*        C  22  -3.564   5.091   6.993
  231   1H4     C  22          1H4         C  22  -1.764   3.159   1.274
  232   2H4     C  22          2H4         C  22  -0.065   3.161   1.773
  233    H5     C  22           H5         C  22   0.620   3.546   4.049
  234    H6     C  22           H6         C  22  -0.149   4.056   6.251
  235   1H5*    A  23          1H5*        A  23  -5.457  -1.154   9.220
  236   2H5*    A  23          2H5*        A  23  -4.524  -0.702   7.804
  237    H4*    A  23           H4*        A  23  -7.188   0.503   8.667
  238    H3*    A  23           H3*        A  23  -6.189  -1.218   6.425
  239    H2*    A  23           H2*        A  23  -7.870  -0.249   4.948
  240   2HO*    A  23          2HO*        A  23  -9.341   0.369   6.898
  241    H1*    A  23           H1*        A  23  -6.889   2.156   5.369
  242    H8     A  23           H8         A  23  -3.734   0.607   6.442
  243   1H6     A  23          1H6         A  23  -2.594  -0.676   0.509
  244   2H6     A  23          2H6         A  23  -1.953  -0.644   2.157
  245    H2     A  23           H2         A  23  -6.889   0.270   0.825
  246   1H5*    G  24          1H5*        G  24 -10.320  -0.361   5.149
  247   2H5*    G  24          2H5*        G  24 -11.548  -1.596   5.423
  248    H4*    G  24           H4*        G  24 -11.137  -1.099   3.023
  249    H3*    G  24           H3*        G  24 -10.574  -3.872   4.044
  250    H2*    G  24           H2*        G  24 -10.046  -4.454   1.810
  251   2HO*    G  24          2HO*        G  24 -11.577  -3.219   0.715
  252    H1*    G  24           H1*        G  24  -8.299  -2.499   1.381
  253    H8     G  24           H8         G  24  -7.248  -2.304   4.623
  254    H1     G  24           H1         G  24  -6.559  -8.463   2.897
  255   1H2     G  24          1H2         G  24  -7.891  -8.901   1.118
  256   2H2     G  24          2H2         G  24  -8.933  -7.710   0.507
  257   1H5*    U  25          1H5*        U  25 -12.378  -6.899   0.840
  258   2H5*    U  25          2H5*        U  25 -10.965  -5.896   0.975
  259    H4*    U  25           H4*        U  25 -12.880  -5.986  -1.376
  260    H3*    U  25           H3*        U  25 -10.143  -7.066  -0.802
  261    H2*    U  25           H2*        U  25  -9.492  -6.586  -3.094
  262   2HO*    U  25          2HO*        U  25 -11.639  -7.243  -3.840
  263    H1*    U  25           H1*        U  25 -10.523  -4.136  -3.199
  264    H3     U  25           H3         U  25  -7.382  -1.598  -1.138
  265    H5     U  25           H5         U  25  -6.288  -5.537  -0.256
  266    H6     U  25           H6         U  25  -8.361  -6.298  -1.211
  267   1H5*    A  26          1H5*        A  26 -11.344  -8.729  -4.582
  268   2H5*    A  26          2H5*        A  26 -10.820 -10.419  -4.677
  269    H4*    A  26           H4*        A  26  -9.977  -8.990  -6.545
  270    H3*    A  26           H3*        A  26  -7.933 -10.289  -4.726
  271    H2*    A  26           H2*        A  26  -6.277  -9.413  -6.273
  272   2HO*    A  26          2HO*        A  26  -7.630  -9.790  -8.132
  273    H1*    A  26           H1*        A  26  -7.233  -6.941  -6.333
  274    H8     A  26           H8         A  26  -8.131  -7.994  -2.868
  275   1H6     A  26          1H6         A  26  -2.217  -6.854  -1.393
  276   2H6     A  26          2H6         A  26  -3.825  -7.267  -0.778
  277    H2     A  26           H2         A  26  -2.537  -6.795  -5.780
  278   1H5*    U  27          1H5*        U  27  -6.934 -11.154  -8.735
  279   2H5*    U  27          2H5*        U  27  -6.402 -12.829  -8.936
  280    H4*    U  27           H4*        U  27  -4.699 -11.217  -9.726
  281    H3*    U  27           H3*        U  27  -3.892 -12.902  -7.326
  282    H2*    U  27           H2*        U  27  -1.725 -11.843  -7.569
  283   2HO*    U  27          2HO*        U  27  -1.826 -11.854  -9.874
  284    H1*    U  27           H1*        U  27  -2.648  -9.347  -7.799
  285    H3     U  27           H3         U  27  -0.847  -9.985  -3.639
  286    H5     U  27           H5         U  27  -4.878 -11.032  -3.244
  287    H6     U  27           H6         U  27  -5.114 -10.886  -5.630
  288   1H5*    A  28          1H5*        A  28  -0.783 -13.164 -10.247
  289   2H5*    A  28          2H5*        A  28  -0.156 -14.816 -10.333
  290    H4*    A  28           H4*        A  28   1.626 -13.210  -9.898
  291    H3*    A  28           H3*        A  28   1.100 -15.091  -7.569
  292    H2*    A  28           H2*        A  28   3.057 -14.060  -6.587
  293   2HO*    A  28          2HO*        A  28   4.136 -13.881  -8.655
  294    H1*    A  28           H1*        A  28   2.255 -11.555  -6.999
  295    H8     A  28           H8         A  28  -0.996 -13.360  -6.557
  296   1H6     A  28          1H6         A  28   0.110 -12.918  -0.480
  297   2H6     A  28          2H6         A  28  -1.080 -13.320  -1.721
  298    H2     A  28           H2         A  28   3.880 -12.037  -2.576
  299   1H5*    U  29          1H5*        U  29   5.223 -15.125  -8.422
  300   2H5*    U  29          2H5*        U  29   5.898 -16.754  -8.309
  301    H4*    U  29           H4*        U  29   7.083 -15.159  -6.844
  302    H3*    U  29           H3*        U  29   5.571 -17.365  -5.382
  303    H2*    U  29           H2*        U  29   6.606 -16.437  -3.395
  304   2HO*    U  29          2HO*        U  29   8.589 -15.947  -4.443
  305    H1*    U  29           H1*        U  29   5.960 -13.905  -3.903
  306    H3     U  29           H3         U  29   3.166 -15.601  -0.707
  307    H5     U  29           H5         U  29   1.251 -16.403  -4.337
  308    H6     U  29           H6         U  29   3.233 -15.702  -5.493
  309   1H5*    C  30          1H5*        C  30   9.490 -17.183  -3.886
  310   2H5*    C  30          2H5*        C  30  10.169 -18.784  -3.588
  311    H4*    C  30           H4*        C  30  10.201 -17.383  -1.567
  312    H3*    C  30           H3*        C  30   8.350 -19.801  -1.356
  313    H2*    C  30           H2*        C  30   8.098 -19.109   0.943
  314   2HO*    C  30          2HO*        C  30  10.346 -18.414   1.033
  315    H1*    C  30           H1*        C  30   7.600 -16.547   0.405
  316   1H4     C  30          1H4         C  30   1.957 -19.263   0.256
  317   2H4     C  30          2H4         C  30   2.019 -19.392  -1.513
  318    H5     C  30           H5         C  30   4.065 -18.995  -2.753
  319    H6     C  30           H6         C  30   6.324 -18.209  -2.568
  320   1H5*    C  31          1H5*        C  31  10.849 -19.650   2.022
  321   2H5*    C  31          2H5*        C  31  11.564 -21.237   2.331
  322    H4*    C  31           H4*        C  31  10.438 -20.444   4.348
  323    H3*    C  31           H3*        C  31   8.993 -22.716   2.930
  324    H2*    C  31           H2*        C  31   7.550 -22.799   4.839
  325   2HO*    C  31          2HO*        C  31   9.384 -22.325   6.308
  326    H1*    C  31           H1*        C  31   7.174 -20.100   4.946
  327   1H4     C  31          1H4         C  31   2.508 -22.349   1.423
  328   2H4     C  31          2H4         C  31   3.450 -22.126  -0.063
  329    H5     C  31           H5         C  31   5.799 -21.561  -0.034
  330    H6     C  31           H6         C  31   7.631 -20.956   1.382
  331    H3T    C  31           H3T        C  31  11.050 -23.221   3.724
  Start of MODEL   18
    1   1H5*    G   1          1H5*        G   1  -4.000 -24.836   8.013
    2   2H5*    G   1          2H5*        G   1  -4.070 -23.177   8.630
    3    H4*    G   1           H4*        G   1  -1.960 -24.113   9.265
    4    H3*    G   1           H3*        G   1  -1.706 -22.118   7.013
    5    H2*    G   1           H2*        G   1   0.681 -22.339   7.258
    6   2HO*    G   1          2HO*        G   1   0.580 -22.548   9.573
    7    H1*    G   1           H1*        G   1   0.683 -24.988   7.219
    8    H8     G   1           H8         G   1  -2.270 -24.357   5.064
    9    H1     G   1           H1         G   1   3.278 -22.755   2.233
   10   1H2     G   1          1H2         G   1   4.857 -22.687   3.772
   11   2H2     G   1          2H2         G   1   4.488 -23.099   5.450
   12    H5T    G   1           H5T        G   1  -3.579 -22.430   6.531
   13   1H5*    G   2          1H5*        G   2   0.994 -20.929   9.958
   14   2H5*    G   2          2H5*        G   2   0.925 -19.186  10.220
   15    H4*    G   2           H4*        G   2   3.198 -19.931   9.734
   16    H3*    G   2           H3*        G   2   1.988 -18.128   7.618
   17    H2*    G   2           H2*        G   2   4.170 -18.222   6.549
   18   2HO*    G   2          2HO*        G   2   5.240 -18.253   8.644
   19    H1*    G   2           H1*        G   2   4.413 -20.862   6.646
   20    H8     G   2           H8         G   2   0.726 -20.538   6.289
   21    H1     G   2           H1         G   2   3.904 -18.988   0.915
   22   1H2     G   2          1H2         G   2   6.020 -18.657   1.407
   23   2H2     G   2          2H2         G   2   6.622 -18.969   3.047
   24   1H5*    A   3          1H5*        A   3   5.906 -16.718   8.482
   25   2H5*    A   3          2H5*        A   3   5.912 -14.968   8.705
   26    H4*    A   3           H4*        A   3   7.557 -15.658   7.039
   27    H3*    A   3           H3*        A   3   5.260 -13.999   5.979
   28    H2*    A   3           H2*        A   3   6.424 -14.039   3.853
   29   2HO*    A   3          2HO*        A   3   8.529 -13.947   4.944
   30    H1*    A   3           H1*        A   3   6.869 -16.650   3.814
   31    H8     A   3           H8         A   3   3.619 -16.523   5.635
   32   1H6     A   3          1H6         A   3   1.044 -16.032   0.023
   33   2H6     A   3          2H6         A   3   0.797 -16.372   1.728
   34    H2     A   3           H2         A   3   5.339 -15.110  -0.407
   35   1H5*    U   4          1H5*        U   4   8.834 -12.350   4.490
   36   2H5*    U   4          2H5*        U   4   8.837 -10.585   4.560
   37    H4*    U   4           H4*        U   4   9.223 -11.414   2.279
   38    H3*    U   4           H3*        U   4   6.619  -9.906   2.664
   39    H2*    U   4           H2*        U   4   6.374 -10.144   0.242
   40   2HO*    U   4          2HO*        U   4   8.690  -9.903  -0.051
   41    H1*    U   4           H1*        U   4   6.937 -12.744   0.164
   42    H3     U   4           H3         U   4   2.420 -12.097  -0.349
   43    H5     U   4           H5         U   4   3.003 -12.556   3.762
   44    H6     U   4           H6         U   4   5.378 -12.397   3.421
   45   1H5*    A   5          1H5*        A   5   8.613  -8.464  -0.743
   46   2H5*    A   5          2H5*        A   5   8.504  -6.717  -0.884
   47    H4*    A   5           H4*        A   5   7.671  -7.863  -2.900
   48    H3*    A   5           H3*        A   5   5.624  -6.247  -1.338
   49    H2*    A   5           H2*        A   5   4.094  -6.789  -3.119
   50   2HO*    A   5          2HO*        A   5   5.828  -6.639  -4.730
   51    H1*    A   5           H1*        A   5   4.613  -9.396  -3.200
   52    H8     A   5           H8         A   5   5.097  -8.616   0.414
   53   1H6     A   5          1H6         A   5  -1.057  -9.095   0.875
   54   2H6     A   5          2H6         A   5   0.464  -9.004   1.785
   55    H2     A   5           H2         A   5  -0.121  -8.675  -3.355
   56   1H5*    U   6          1H5*        U   6   5.474  -5.159  -5.449
   57   2H5*    U   6          2H5*        U   6   5.136  -3.432  -5.636
   58    H4*    U   6           H4*        U   6   3.440  -4.921  -6.701
   59    H3*    U   6           H3*        U   6   2.448  -3.102  -4.494
   60    H2*    U   6           H2*        U   6   0.276  -3.924  -5.053
   61   2HO*    U   6          2HO*        U   6   0.501  -3.956  -7.267
   62    H1*    U   6           H1*        U   6   0.893  -6.501  -5.179
   63    H3     U   6           H3         U   6  -1.546  -5.839  -1.397
   64    H5     U   6           H5         U   6   2.427  -5.054  -0.274
   65    H6     U   6           H6         U   6   3.079  -5.167  -2.594
   66   1H5*    A   7          1H5*        A   7  -1.473  -0.856  -7.419
   67   2H5*    A   7          2H5*        A   7  -1.163  -1.101  -5.708
   68    H4*    A   7           H4*        A   7  -2.334  -3.166  -7.603
   69    H3*    A   7           H3*        A   7  -3.501  -1.093  -5.887
   70    H2*    A   7           H2*        A   7  -4.731  -2.448  -4.434
   71   2HO*    A   7          2HO*        A   7  -5.687  -3.508  -6.285
   72    H1*    A   7           H1*        A   7  -3.230  -4.678  -4.306
   73    H8     A   7           H8         A   7  -0.447  -2.282  -4.136
   74   1H6     A   7          1H6         A   7  -1.962  -1.670   1.864
   75   2H6     A   7          2H6         A   7  -0.723  -1.306   0.641
   76    H2     A   7           H2         A   7  -5.234  -3.707  -0.102
   77   1H5*    U   8          1H5*        U   8  -7.536   0.377  -6.154
   78   2H5*    U   8          2H5*        U   8  -6.111   0.169  -5.157
   79    H4*    U   8           H4*        U   8  -8.725  -1.380  -4.839
   80    H3*    U   8           H3*        U   8  -7.635   1.158  -3.639
   81    H2*    U   8           H2*        U   8  -8.515   0.626  -1.513
   82   2HO*    U   8          2HO*        U   8 -10.476  -0.206  -2.378
   83    H1*    U   8           H1*        U   8  -7.663  -1.910  -1.437
   84    H3     U   8           H3         U   8  -4.793   0.693   1.045
   85    H5     U   8           H5         U   8  -3.077   0.405  -2.741
   86    H6     U   8           H6         U   8  -5.140  -0.613  -3.544
   87   1H5*    G   9          1H5*        G   9 -11.128   4.230  -2.163
   88   2H5*    G   9          2H5*        G   9  -9.475   3.809  -1.754
   89    H4*    G   9           H4*        G   9 -12.002   2.982  -0.259
   90    H3*    G   9           H3*        G   9  -9.773   4.950   0.080
   91    H2*    G   9           H2*        G   9  -9.672   4.595   2.457
   92   2HO*    G   9          2HO*        G   9 -12.065   4.296   2.483
   93    H1*    G   9           H1*        G   9  -9.540   1.978   2.328
   94    H8     G   9           H8         G   9  -8.038   2.605  -0.993
   95    H1     G   9           H1         G   9  -4.197   4.420   3.843
   96   1H2     G   9          1H2         G   9  -5.360   4.475   5.725
   97   2H2     G   9          2H2         G   9  -7.066   3.969   5.733
   98   1H5*    A  10          1H5*        A  10 -11.828   5.966   3.478
   99   2H5*    A  10          2H5*        A  10 -12.228   7.693   3.421
  100    H4*    A  10           H4*        A  10 -10.912   7.142   5.404
  101    H3*    A  10           H3*        A  10  -9.559   8.975   3.394
  102    H2*    A  10           H2*        A  10  -7.755   9.143   4.932
  103   2HO*    A  10          2HO*        A  10  -9.294   9.120   6.747
  104    H1*    A  10           H1*        A  10  -7.487   6.573   5.458
  105    H8     A  10           H8         A  10  -8.678   6.460   1.942
  106   1H6     A  10          1H6         A  10  -2.754   7.501   0.413
  107   2H6     A  10          2H6         A  10  -4.354   7.066  -0.212
  108    H2     A  10           H2         A  10  -3.176   8.198   4.714
  109   1H5*    U  11          1H5*        U  11  -9.053  10.690   7.226
  110   2H5*    U  11          2H5*        U  11  -9.343  12.434   7.134
  111    H4*    U  11           H4*        U  11  -7.086  11.891   7.975
  112    H3*    U  11           H3*        U  11  -7.243  13.299   5.304
  113    H2*    U  11           H2*        U  11  -4.836  13.502   5.519
  114   2HO*    U  11          2HO*        U  11  -4.849  13.922   7.744
  115    H1*    U  11           H1*        U  11  -4.389  10.968   6.288
  116    H3     U  11           H3         U  11  -2.843  11.403   1.987
  117    H5     U  11           H5         U  11  -6.938  10.599   1.591
  118    H6     U  11           H6         U  11  -7.196  10.847   3.990
  119   1H5*    A  12          1H5*        A  12  -4.847  15.399   8.523
  120   2H5*    A  12          2H5*        A  12  -4.954  17.142   8.220
  121    H4*    A  12           H4*        A  12  -2.591  16.280   8.385
  122    H3*    A  12           H3*        A  12  -3.546  17.633   5.868
  123    H2*    A  12           H2*        A  12  -1.391  17.296   4.968
  124   2HO*    A  12          2HO*        A  12  -0.300  17.913   6.910
  125    H1*    A  12           H1*        A  12  -0.904  14.843   5.876
  126    H8     A  12           H8         A  12  -4.395  15.127   4.490
  127   1H6     A  12          1H6         A  12  -1.444  14.018  -0.900
  128   2H6     A  12          2H6         A  12  -3.066  14.157  -0.186
  129    H2     A  12           H2         A  12   1.541  14.480   2.139
  130   1H5*    U  13          1H5*        U  13   0.475  19.421   7.149
  131   2H5*    U  13          2H5*        U  13   0.394  21.104   6.609
  132    H4*    U  13           H4*        U  13   2.336  19.924   5.686
  133    H3*    U  13           H3*        U  13   0.315  20.768   3.594
  134    H2*    U  13           H2*        U  13   2.035  20.108   2.029
  135   2HO*    U  13          2HO*        U  13   3.844  20.748   3.091
  136    H1*    U  13           H1*        U  13   2.529  17.730   3.173
  137    H3     U  13           H3         U  13  -0.085  16.841  -0.528
  138    H5     U  13           H5         U  13  -2.771  18.098   2.423
  139    H6     U  13           H6         U  13  -0.929  18.762   3.770
  140   1H5*    A  14          1H5*        A  14   4.454  22.374   3.136
  141   2H5*    A  14          2H5*        A  14   4.415  23.863   2.165
  142    H4*    A  14           H4*        A  14   5.991  22.091   1.311
  143    H3*    A  14           H3*        A  14   3.765  23.019  -0.505
  144    H2*    A  14           H2*        A  14   4.715  21.545  -2.157
  145   2HO*    A  14          2HO*        A  14   6.861  21.867  -1.893
  146    H1*    A  14           H1*        A  14   5.266  19.472  -0.491
  147    H8     A  14           H8         A  14   1.877  20.988   0.207
  148   1H6     A  14          1H6         A  14   0.090  17.007  -4.272
  149   2H6     A  14          2H6         A  14  -0.562  18.070  -2.997
  150    H2     A  14           H2         A  14   4.362  17.002  -4.176
  151   1H5*    A  15          1H5*        A  15   8.086  23.122  -1.918
  152   2H5*    A  15          2H5*        A  15   8.339  24.285  -3.217
  153    H4*    A  15           H4*        A  15   8.914  21.716  -3.505
  154    H3*    A  15           H3*        A  15   8.810  23.618  -5.399
  155    H2*    A  15           H2*        A  15   6.400  23.506  -5.460
  156   2HO*    A  15          2HO*        A  15   7.700  22.779  -7.670
  157    H1*    A  15           H1*        A  15   6.662  20.525  -5.851
  158    H8     A  15           H8         A  15   4.606  23.198  -4.165
  159   1H6     A  15          1H6         A  15  -0.156  19.669  -6.053
  160   2H6     A  15          2H6         A  15   0.218  21.208  -5.190
  161    H2     A  15           H2         A  15   3.370  17.641  -7.116
  162   1H5*    U  16          1H5*        U  16   9.854  19.670  -9.435
  163   2H5*    U  16          2H5*        U  16   8.515  20.715  -9.961
  164    H4*    U  16           H4*        U  16   8.066  18.339 -10.481
  165    H3*    U  16           H3*        U  16   6.297  19.702  -8.466
  166    H2*    U  16           H2*        U  16   5.263  17.678  -7.952
  167   2HO*    U  16          2HO*        U  16   4.761  17.420 -10.163
  168    H1*    U  16           H1*        U  16   7.322  15.913  -8.803
  169    H3     U  16           H3         U  16   7.200  14.057  -4.713
  170    H5     U  16           H5         U  16   6.921  18.159  -3.855
  171    H6     U  16           H6         U  16   7.021  18.606  -6.265
  172   1H5*    U  17          1H5*        U  17   3.934  17.140 -11.767
  173   2H5*    U  17          2H5*        U  17   3.008  18.416 -12.463
  174    H4*    U  17           H4*        U  17   0.984  17.744 -11.246
  175    H3*    U  17           H3*        U  17   2.760  16.282  -9.561
  176    H2*    U  17           H2*        U  17   2.432  14.061 -10.145
  177   2HO*    U  17          2HO*        U  17   0.080  14.311  -9.696
  178    H1*    U  17           H1*        U  17   1.414  14.088 -12.633
  179    H3     U  17           H3         U  17   5.112  14.386 -15.375
  180    H5     U  17           H5         U  17   6.559  14.926 -11.493
  181    H6     U  17           H6         U  17   4.320  14.892 -10.660
  182   1H5*    U  18          1H5*        U  18   0.951  13.223  -6.729
  183   2H5*    U  18          2H5*        U  18   1.403  13.143  -8.395
  184    H4*    U  18           H4*        U  18  -1.305  12.184  -7.337
  185    H3*    U  18           H3*        U  18   1.308  10.897  -7.290
  186    H2*    U  18           H2*        U  18   1.133   9.309  -8.666
  187   2HO*    U  18          2HO*        U  18  -0.698   8.302  -7.826
  188    H1*    U  18           H1*        U  18  -0.799  10.216 -10.501
  189    H3     U  18           H3         U  18   2.148  11.161 -13.752
  190    H5     U  18           H5         U  18   4.335  11.902 -10.250
  191    H6     U  18           H6         U  18   2.361  11.489  -8.989
  192   1H5*    G  19          1H5*        G  19   2.595   9.022  -7.148
  193   2H5*    G  19          2H5*        G  19   3.245   7.921  -5.931
  194    H4*    G  19           H4*        G  19   4.924   9.571  -6.460
  195    H3*    G  19           H3*        G  19   3.645  10.038  -3.791
  196    H2*    G  19           H2*        G  19   5.244  11.819  -3.434
  197   2HO*    G  19          2HO*        G  19   6.998  10.830  -4.621
  198    H1*    G  19           H1*        G  19   4.632  13.054  -5.695
  199    H8     G  19           H8         G  19   1.441  11.421  -5.400
  200    H1     G  19           H1         G  19   2.242  15.764  -0.722
  201   1H2     G  19          1H2         G  19   4.423  16.224  -0.592
  202   2H2     G  19          2H2         G  19   5.571  15.367  -1.629
  203   1H5*    A  20          1H5*        A  20   7.389  11.394  -1.588
  204   2H5*    A  20          2H5*        A  20   7.711   9.919  -0.660
  205    H4*    A  20           H4*        A  20   7.074  11.717   0.809
  206    H3*    A  20           H3*        A  20   5.045   9.488   0.632
  207    H2*    A  20           H2*        A  20   3.884  10.667   2.434
  208   2HO*    A  20          2HO*        A  20   5.894  11.265   3.451
  209    H1*    A  20           H1*        A  20   3.940  13.062   1.264
  210    H8     A  20           H8         A  20   3.866  10.920  -1.748
  211   1H6     A  20          1H6         A  20  -2.206  10.170  -0.571
  212   2H6     A  20          2H6         A  20  -0.926   9.997  -1.798
  213    H2     A  20           H2         A  20  -0.320  11.658   3.069
  214   1H5*    U  21          1H5*        U  21   5.836  10.086   4.859
  215   2H5*    U  21          2H5*        U  21   5.968   8.494   5.630
  216    H4*    U  21           H4*        U  21   4.236   9.932   6.643
  217    H3*    U  21           H3*        U  21   3.198   7.350   5.397
  218    H2*    U  21           H2*        U  21   1.095   7.996   6.348
  219   2HO*    U  21          2HO*        U  21   2.106   8.838   8.261
  220    H1*    U  21           H1*        U  21   1.108  10.490   5.435
  221    H3     U  21           H3         U  21  -1.596   7.854   2.832
  222    H5     U  21           H5         U  21   2.109   7.794   0.930
  223    H6     U  21           H6         U  21   3.067   8.913   2.824
  224   1H5*    C  22          1H5*        C  22   1.708   7.604   9.461
  225   2H5*    C  22          2H5*        C  22   1.963   6.019  10.219
  226    H4*    C  22           H4*        C  22  -0.381   6.750  10.357
  227    H3*    C  22           H3*        C  22   0.126   4.230   8.739
  228    H2*    C  22           H2*        C  22  -2.200   4.068   8.461
  229   2HO*    C  22          2HO*        C  22  -2.692   4.623  10.617
  230    H1*    C  22           H1*        C  22  -2.700   6.671   7.927
  231   1H4     C  22          1H4         C  22  -2.067   4.180   2.233
  232   2H4     C  22          2H4         C  22  -0.340   4.556   2.191
  233    H5     C  22           H5         C  22   0.851   5.343   4.154
  234    H6     C  22           H6         C  22   0.583   6.091   6.419
  235   1H5*    A  23          1H5*        A  23  -2.224   0.442  10.864
  236   2H5*    A  23          2H5*        A  23  -1.832   1.102   9.287
  237    H4*    A  23           H4*        A  23  -4.486   1.448  10.754
  238    H3*    A  23           H3*        A  23  -3.546  -0.258   8.485
  239    H2*    A  23           H2*        A  23  -5.684  -0.016   7.386
  240   2HO*    A  23          2HO*        A  23  -6.997   0.033   9.222
  241    H1*    A  23           H1*        A  23  -5.587   2.597   7.433
  242    H8     A  23           H8         A  23  -1.928   2.227   7.615
  243   1H6     A  23          1H6         A  23  -2.251   0.963   1.545
  244   2H6     A  23          2H6         A  23  -1.186   1.422   2.903
  245    H2     A  23           H2         A  23  -6.247   0.338   3.217
  246   1H5*    G  24          1H5*        G  24  -6.686  -2.123   6.733
  247   2H5*    G  24          2H5*        G  24  -6.744  -3.739   7.459
  248    H4*    G  24           H4*        G  24  -6.091  -3.995   5.185
  249    H3*    G  24           H3*        G  24  -3.836  -4.419   7.150
  250    H2*    G  24           H2*        G  24  -2.439  -5.005   5.353
  251   2HO*    G  24          2HO*        G  24  -3.917  -6.394   4.349
  252    H1*    G  24           H1*        G  24  -3.396  -3.135   3.534
  253    H8     G  24           H8         G  24  -3.105  -1.185   6.679
  254    H1     G  24           H1         G  24   2.652  -2.923   4.314
  255   1H2     G  24          1H2         G  24   2.348  -4.440   2.677
  256   2H2     G  24          2H2         G  24   0.714  -4.856   2.184
  257   1H5*    U  25          1H5*        U  25  -6.426  -9.894   6.165
  258   2H5*    U  25          2H5*        U  25  -5.762  -8.724   5.032
  259    H4*    U  25           H4*        U  25  -8.219  -8.342   6.825
  260    H3*    U  25           H3*        U  25  -7.699  -8.742   3.915
  261    H2*    U  25           H2*        U  25  -9.790  -7.623   3.434
  262   2HO*    U  25          2HO*        U  25 -10.965  -8.629   5.149
  263    H1*    U  25           H1*        U  25  -9.378  -5.740   5.357
  264    H3     U  25           H3         U  25  -9.579  -3.572   1.433
  265    H5     U  25           H5         U  25  -5.624  -4.883   1.729
  266    H6     U  25           H6         U  25  -6.237  -6.192   3.692
  267   1H5*    A  26          1H5*        A  26 -11.539  -8.926   2.143
  268   2H5*    A  26          2H5*        A  26 -11.369 -10.461   1.279
  269    H4*    A  26           H4*        A  26 -11.286  -8.504  -0.195
  270    H3*    A  26           H3*        A  26  -8.746 -10.123  -0.118
  271    H2*    A  26           H2*        A  26  -7.989  -8.651  -1.914
  272   2HO*    A  26          2HO*        A  26 -10.167  -8.596  -2.842
  273    H1*    A  26           H1*        A  26  -8.701  -6.348  -0.666
  274    H8     A  26           H8         A  26  -7.876  -8.560   2.093
  275   1H6     A  26          1H6         A  26  -1.961  -6.918   0.968
  276   2H6     A  26          2H6         A  26  -3.038  -7.694   2.138
  277    H2     A  26           H2         A  26  -4.302  -6.019  -2.588
  278   1H5*    U  27          1H5*        U  27  -9.336  -9.655  -4.226
  279   2H5*    U  27          2H5*        U  27  -9.154 -11.233  -5.007
  280    H4*    U  27           H4*        U  27  -7.642  -9.640  -6.003
  281    H3*    U  27           H3*        U  27  -6.179 -11.769  -4.401
  282    H2*    U  27           H2*        U  27  -4.178 -10.751  -5.280
  283   2HO*    U  27          2HO*        U  27  -5.178 -10.392  -7.350
  284    H1*    U  27           H1*        U  27  -4.857  -8.229  -4.745
  285    H3     U  27           H3         U  27  -1.793  -9.644  -1.626
  286    H5     U  27           H5         U  27  -5.516 -10.718  -0.047
  287    H6     U  27           H6         U  27  -6.550 -10.081  -2.141
  288   1H5*    A  28          1H5*        A  28  -4.450 -11.702  -8.345
  289   2H5*    A  28          2H5*        A  28  -4.066 -13.352  -8.862
  290    H4*    A  28           H4*        A  28  -2.109 -11.909  -8.980
  291    H3*    A  28           H3*        A  28  -1.875 -14.070  -6.857
  292    H2*    A  28           H2*        A  28   0.389 -13.246  -6.585
  293   2HO*    A  28          2HO*        A  28   0.606 -12.857  -8.888
  294    H1*    A  28           H1*        A  28  -0.284 -10.680  -6.389
  295    H8     A  28           H8         A  28  -3.258 -12.443  -4.930
  296   1H6     A  28          1H6         A  28   0.041 -12.697   0.287
  297   2H6     A  28          2H6         A  28  -1.569 -12.812  -0.436
  298    H2     A  28           H2         A  28   2.812 -11.627  -2.957
  299   1H5*    U  29          1H5*        U  29   1.566 -14.168  -9.318
  300   2H5*    U  29          2H5*        U  29   2.121 -15.820  -9.621
  301    H4*    U  29           H4*        U  29   3.878 -14.431  -8.606
  302    H3*    U  29           H3*        U  29   2.909 -16.708  -6.836
  303    H2*    U  29           H2*        U  29   4.715 -16.004  -5.350
  304   2HO*    U  29          2HO*        U  29   6.071 -15.467  -7.195
  305    H1*    U  29           H1*        U  29   4.057 -13.419  -5.349
  306    H3     U  29           H3         U  29   2.640 -15.416  -1.473
  307    H5     U  29           H5         U  29  -0.563 -15.857  -4.127
  308    H6     U  29           H6         U  29   0.838 -15.038  -5.901
  309   1H5*    C  30          1H5*        C  30   7.096 -16.797  -6.891
  310   2H5*    C  30          2H5*        C  30   7.723 -18.438  -7.051
  311    H4*    C  30           H4*        C  30   8.622 -17.302  -5.072
  312    H3*    C  30           H3*        C  30   6.835 -19.677  -4.413
  313    H2*    C  30           H2*        C  30   7.525 -19.271  -2.119
  314   2HO*    C  30          2HO*        C  30   9.672 -18.550  -2.931
  315    H1*    C  30           H1*        C  30   6.978 -16.659  -2.148
  316   1H4     C  30          1H4         C  30   1.548 -19.318  -0.550
  317   2H4     C  30          2H4         C  30   0.930 -19.154  -2.207
  318    H5     C  30           H5         C  30   2.393 -18.580  -4.050
  319    H6     C  30           H6         C  30   4.609 -17.835  -4.601
  320   1H5*    C  31          1H5*        C  31  10.310 -20.005  -2.139
  321   2H5*    C  31          2H5*        C  31  11.019 -21.612  -2.335
  322    H4*    C  31           H4*        C  31  10.727 -21.152   0.034
  323    H3*    C  31           H3*        C  31   8.744 -23.183  -1.068
  324    H2*    C  31           H2*        C  31   8.068 -23.554   1.195
  325   2HO*    C  31          2HO*        C  31  10.326 -23.304   1.965
  326    H1*    C  31           H1*        C  31   7.892 -20.909   1.809
  327   1H4     C  31          1H4         C  31   2.202 -22.642  -0.109
  328   2H4     C  31          2H4         C  31   2.564 -22.225  -1.793
  329    H5     C  31           H5         C  31   4.782 -21.601  -2.516
  330    H6     C  31           H6         C  31   7.020 -21.156  -1.759
  331    H3T    C  31           H3T        C  31  10.914 -23.806  -1.147
  Start of MODEL   19
    1   1H5*    G   1          1H5*        G   1  -0.460 -24.792   3.981
    2   2H5*    G   1          2H5*        G   1   0.113 -25.163   2.360
    3    H4*    G   1           H4*        G   1   1.620 -25.874   4.913
    4    H3*    G   1           H3*        G   1   1.719 -23.426   3.149
    5    H2*    G   1           H2*        G   1   4.106 -23.348   3.532
    6   2HO*    G   1          2HO*        G   1   3.909 -24.046   5.739
    7    H1*    G   1           H1*        G   1   4.545 -25.895   2.960
    8    H8     G   1           H8         G   1   1.563 -25.101   0.874
    9    H1     G   1           H1         G   1   7.036 -22.653  -1.457
   10   1H2     G   1          1H2         G   1   8.596 -22.805   0.116
   11   2H2     G   1          2H2         G   1   8.202 -23.554   1.673
   12    H5T    G   1           H5T        G   1  -1.304 -26.795   3.183
   13   1H5*    G   2          1H5*        G   2   4.071 -22.487   6.452
   14   2H5*    G   2          2H5*        G   2   3.718 -20.857   7.036
   15    H4*    G   2           H4*        G   2   6.093 -21.134   6.542
   16    H3*    G   2           H3*        G   2   4.663 -19.160   4.732
   17    H2*    G   2           H2*        G   2   6.837 -18.724   3.792
   18   2HO*    G   2          2HO*        G   2   7.857 -18.931   5.868
   19    H1*    G   2           H1*        G   2   7.525 -21.263   3.433
   20    H8     G   2           H8         G   2   3.840 -21.415   2.911
   21    H1     G   2           H1         G   2   6.951 -18.485  -1.898
   22   1H2     G   2          1H2         G   2   8.996 -18.029  -1.237
   23   2H2     G   2          2H2         G   2   9.566 -18.560   0.359
   24   1H5*    A   3          1H5*        A   3   8.235 -17.311   6.107
   25   2H5*    A   3          2H5*        A   3   7.894 -15.674   6.671
   26    H4*    A   3           H4*        A   3   9.700 -15.684   5.033
   27    H3*    A   3           H3*        A   3   7.159 -14.311   4.147
   28    H2*    A   3           H2*        A   3   8.387 -13.700   2.157
   29   2HO*    A   3          2HO*        A   3  10.367 -13.390   3.393
   30    H1*    A   3           H1*        A   3   9.366 -16.102   1.645
   31    H8     A   3           H8         A   3   6.084 -16.976   3.187
   32   1H6     A   3          1H6         A   3   3.633 -15.743  -2.390
   33   2H6     A   3          2H6         A   3   3.427 -16.498  -0.819
   34    H2     A   3           H2         A   3   7.722 -14.061  -2.327
   35   1H5*    U   4          1H5*        U   4  10.413 -11.747   3.302
   36   2H5*    U   4          2H5*        U   4  10.060 -10.065   3.698
   37    H4*    U   4           H4*        U   4  10.707 -10.349   1.334
   38    H3*    U   4           H3*        U   4   7.855  -9.404   1.791
   39    H2*    U   4           H2*        U   4   7.773  -9.201  -0.635
   40   2HO*    U   4          2HO*        U   4   9.974  -8.502  -0.755
   41    H1*    U   4           H1*        U   4   8.768 -11.604  -1.153
   42    H3     U   4           H3         U   4   4.221 -11.575  -1.824
   43    H5     U   4           H5         U   4   4.754 -12.824   2.136
   44    H6     U   4           H6         U   4   7.066 -12.223   1.985
   45   1H5*    A   5          1H5*        A   5   9.740  -6.913  -1.087
   46   2H5*    A   5          2H5*        A   5   9.319  -5.218  -0.846
   47    H4*    A   5           H4*        A   5   8.795  -5.957  -3.118
   48    H3*    A   5           H3*        A   5   6.383  -5.216  -1.436
   49    H2*    A   5           H2*        A   5   5.107  -5.587  -3.456
   50   2HO*    A   5          2HO*        A   5   6.731  -4.696  -4.848
   51    H1*    A   5           H1*        A   5   6.159  -7.950  -4.048
   52    H8     A   5           H8         A   5   6.286  -7.924  -0.309
   53   1H6     A   5          1H6         A   5   0.403  -9.805  -0.594
   54   2H6     A   5          2H6         A   5   1.854  -9.637   0.435
   55    H2     A   5           H2         A   5   1.425  -8.203  -4.517
   56   1H5*    U   6          1H5*        U   6   6.080  -3.054  -5.167
   57   2H5*    U   6          2H5*        U   6   5.354  -1.468  -4.853
   58    H4*    U   6           H4*        U   6   4.043  -2.863  -6.433
   59    H3*    U   6           H3*        U   6   2.683  -2.366  -3.788
   60    H2*    U   6           H2*        U   6   0.691  -3.235  -4.920
   61   2HO*    U   6          2HO*        U   6   1.252  -2.525  -7.099
   62    H1*    U   6           H1*        U   6   1.963  -5.401  -5.660
   63    H3     U   6           H3         U   6  -0.670  -6.211  -2.027
   64    H5     U   6           H5         U   6   3.016  -5.033  -0.415
   65    H6     U   6           H6         U   6   3.734  -4.407  -2.622
   66   1H5*    A   7          1H5*        A   7  -0.527   0.713  -6.624
   67   2H5*    A   7          2H5*        A   7  -0.142  -0.251  -5.218
   68    H4*    A   7           H4*        A   7  -1.867  -1.181  -7.578
   69    H3*    A   7           H3*        A   7  -2.412  -0.243  -4.778
   70    H2*    A   7           H2*        A   7  -4.309  -1.697  -4.619
   71   2HO*    A   7          2HO*        A   7  -4.525  -1.727  -7.188
   72    H1*    A   7           H1*        A   7  -2.878  -3.805  -5.262
   73    H8     A   7           H8         A   7  -0.105  -1.777  -3.870
   74   1H6     A   7          1H6         A   7  -2.496  -2.952   1.717
   75   2H6     A   7          2H6         A   7  -1.071  -2.364   0.818
   76    H2     A   7           H2         A   7  -5.488  -4.119  -1.240
   77   1H5*    U   8          1H5*        U   8  -6.944   1.578  -6.007
   78   2H5*    U   8          2H5*        U   8  -5.631   1.182  -4.918
   79    H4*    U   8           H4*        U   8  -8.158  -0.485  -5.344
   80    H3*    U   8           H3*        U   8  -7.285   1.547  -3.304
   81    H2*    U   8           H2*        U   8  -8.367   0.272  -1.565
   82   2HO*    U   8          2HO*        U   8 -10.124  -0.251  -3.017
   83    H1*    U   8           H1*        U   8  -7.364  -2.086  -2.239
   84    H3     U   8           H3         U   8  -4.947  -0.320   1.312
   85    H5     U   8           H5         U   8  -2.851   0.714  -2.160
   86    H6     U   8           H6         U   8  -4.724  -0.043  -3.493
   87   1H5*    G   9          1H5*        G   9 -11.399   0.967  -2.051
   88   2H5*    G   9          2H5*        G   9 -12.046   2.624  -1.945
   89    H4*    G   9           H4*        G   9 -12.290   1.451   0.176
   90    H3*    G   9           H3*        G   9 -10.329   3.776   0.268
   91    H2*    G   9           H2*        G   9 -10.259   3.375   2.624
   92   2HO*    G   9          2HO*        G   9 -12.539   2.868   2.674
   93    H1*    G   9           H1*        G   9  -9.854   0.733   2.446
   94    H8     G   9           H8         G   9  -8.156   2.069  -0.641
   95    H1     G   9           H1         G   9  -4.928   3.299   4.780
   96   1H2     G   9          1H2         G   9  -6.286   3.086   6.479
   97   2H2     G   9          2H2         G   9  -7.923   2.438   6.240
   98   1H5*    A  10          1H5*        A  10 -13.051   4.424   3.547
   99   2H5*    A  10          2H5*        A  10 -13.538   6.127   3.467
  100    H4*    A  10           H4*        A  10 -12.664   5.556   5.671
  101    H3*    A  10           H3*        A  10 -10.942   7.528   4.122
  102    H2*    A  10           H2*        A  10  -9.647   7.699   6.100
  103   2HO*    A  10          2HO*        A  10 -11.322   7.696   7.566
  104    H1*    A  10           H1*        A  10  -9.408   5.105   6.534
  105    H8     A  10           H8         A  10  -9.514   5.241   2.800
  106   1H6     A  10          1H6         A  10  -3.513   6.730   3.180
  107   2H6     A  10          2H6         A  10  -4.860   6.274   2.148
  108    H2     A  10           H2         A  10  -5.216   7.124   7.226
  109   1H5*    U  11          1H5*        U  11 -11.289  11.856   7.080
  110   2H5*    U  11          2H5*        U  11 -10.138  11.231   5.914
  111    H4*    U  11           H4*        U  11 -10.037  10.937   8.945
  112    H3*    U  11           H3*        U  11  -8.411  12.156   6.728
  113    H2*    U  11           H2*        U  11  -6.384  11.880   7.957
  114   2HO*    U  11          2HO*        U  11  -7.757  11.722  10.156
  115    H1*    U  11           H1*        U  11  -6.785   9.325   8.219
  116    H3     U  11           H3         U  11  -4.385  10.282   4.448
  117    H5     U  11           H5         U  11  -8.279   9.469   3.139
  118    H6     U  11           H6         U  11  -8.987   9.479   5.438
  119   1H5*    A  12          1H5*        A  12  -6.987  16.005   9.595
  120   2H5*    A  12          2H5*        A  12  -7.031  14.984   8.151
  121    H4*    A  12           H4*        A  12  -4.769  15.070  10.196
  122    H3*    A  12           H3*        A  12  -5.271  16.239   7.459
  123    H2*    A  12           H2*        A  12  -3.115  15.774   6.816
  124   2HO*    A  12          2HO*        A  12  -2.202  16.516   8.879
  125    H1*    A  12           H1*        A  12  -2.754  13.399   7.830
  126    H8     A  12           H8         A  12  -6.215  13.571   6.596
  127   1H6     A  12          1H6         A  12  -3.705  12.495   1.041
  128   2H6     A  12          2H6         A  12  -5.245  12.481   1.958
  129    H2     A  12           H2         A  12  -0.492  13.514   3.738
  130   1H5*    U  13          1H5*        U  13  -1.505  18.088   8.931
  131   2H5*    U  13          2H5*        U  13  -1.614  19.797   8.479
  132    H4*    U  13           H4*        U  13   0.449  18.764   7.612
  133    H3*    U  13           H3*        U  13  -1.580  19.654   5.566
  134    H2*    U  13           H2*        U  13   0.042  19.082   3.933
  135   2HO*    U  13          2HO*        U  13   1.825  19.943   5.054
  136    H1*    U  13           H1*        U  13   0.842  16.755   4.999
  137    H3     U  13           H3         U  13  -1.382  15.802   1.185
  138    H5     U  13           H5         U  13  -4.400  16.380   4.059
  139    H6     U  13           H6         U  13  -2.758  17.210   5.560
  140   1H5*    A  14          1H5*        A  14   2.498  21.480   4.684
  141   2H5*    A  14          2H5*        A  14   2.145  23.060   3.959
  142    H4*    A  14           H4*        A  14   3.622  21.640   2.551
  143    H3*    A  14           H3*        A  14   0.941  22.384   1.386
  144    H2*    A  14           H2*        A  14   1.686  21.285  -0.617
  145   2HO*    A  14          2HO*        A  14   3.795  22.061  -0.574
  146    H1*    A  14           H1*        A  14   2.817  19.120   0.588
  147    H8     A  14           H8         A  14  -0.376  20.144   2.271
  148   1H6     A  14          1H6         A  14  -2.991  16.572  -2.094
  149   2H6     A  14          2H6         A  14  -3.306  17.365  -0.521
  150    H2     A  14           H2         A  14   1.087  17.236  -3.273
  151   1H5*    A  15          1H5*        A  15   4.455  23.250  -1.246
  152   2H5*    A  15          2H5*        A  15   4.168  24.702  -2.176
  153    H4*    A  15           H4*        A  15   4.753  22.456  -3.392
  154    H3*    A  15           H3*        A  15   3.604  24.720  -4.373
  155    H2*    A  15           H2*        A  15   1.415  24.005  -3.707
  156   2HO*    A  15          2HO*        A  15   1.859  24.181  -6.276
  157    H1*    A  15           H1*        A  15   2.021  21.303  -4.979
  158    H8     A  15           H8         A  15   0.449  22.897  -1.935
  159   1H6     A  15          1H6         A  15  -4.275  19.046  -3.186
  160   2H6     A  15          2H6         A  15  -3.685  20.294  -2.038
  161    H2     A  15           H2         A  15  -1.187  18.329  -6.105
  162   1H5*    U  16          1H5*        U  16   4.381  20.928  -7.103
  163   2H5*    U  16          2H5*        U  16   5.267  21.628  -8.455
  164    H4*    U  16           H4*        U  16   4.261  19.544  -9.132
  165    H3*    U  16           H3*        U  16   3.548  22.036 -10.410
  166    H2*    U  16           H2*        U  16   1.418  21.794 -10.721
  167   2HO*    U  16          2HO*        U  16   1.835  19.168 -11.705
  168    H1*    U  16           H1*        U  16   0.960  19.088  -9.675
  169    H3     U  16           H3         U  16  -2.766  20.534  -7.563
  170    H5     U  16           H5         U  16  -0.367  23.973  -7.798
  171    H6     U  16           H6         U  16   1.378  22.647  -8.685
  172   1H5*    U  17          1H5*        U  17   5.832  18.363  -9.412
  173   2H5*    U  17          2H5*        U  17   7.298  17.933 -10.224
  174    H4*    U  17           H4*        U  17   5.791  16.047 -11.319
  175    H3*    U  17           H3*        U  17   3.916  17.242  -9.534
  176    H2*    U  17           H2*        U  17   3.819  15.712  -7.741
  177   2HO*    U  17          2HO*        U  17   3.501  14.102  -9.550
  178    H1*    U  17           H1*        U  17   6.249  14.587  -7.670
  179    H3     U  17           H3         U  17   9.043  17.942  -6.004
  180    H5     U  17           H5         U  17   5.170  19.431  -5.896
  181    H6     U  17           H6         U  17   4.423  17.601  -7.248
  182   1H5*    U  18          1H5*        U  18   1.579  13.924  -8.977
  183   2H5*    U  18          2H5*        U  18  -0.008  14.444  -9.489
  184    H4*    U  18           H4*        U  18   0.054  15.901  -7.258
  185    H3*    U  18           H3*        U  18   2.388  14.191  -6.971
  186    H2*    U  18           H2*        U  18   1.714  12.789  -5.223
  187   2HO*    U  18          2HO*        U  18   0.837  14.672  -4.032
  188    H1*    U  18           H1*        U  18  -0.841  12.343  -5.864
  189    H3     U  18           H3         U  18  -0.672   9.967  -9.872
  190    H5     U  18           H5         U  18   3.291  10.702  -8.815
  191    H6     U  18           H6         U  18   2.558  12.127  -7.043
  192   1H5*    G  19          1H5*        G  19   3.950  14.033  -2.335
  193   2H5*    G  19          2H5*        G  19   2.708  13.172  -3.223
  194    H4*    G  19           H4*        G  19   2.302  14.828  -0.697
  195    H3*    G  19           H3*        G  19   2.368  11.804  -1.126
  196    H2*    G  19           H2*        G  19   0.615  11.548   0.299
  197   2HO*    G  19          2HO*        G  19   1.631  13.407   1.677
  198    H1*    G  19           H1*        G  19  -0.954  13.423  -0.463
  199    H8     G  19           H8         G  19   1.135  11.964  -3.249
  200    H1     G  19           H1         G  19  -4.277   8.754  -2.151
  201   1H2     G  19          1H2         G  19  -5.189   9.447  -0.221
  202   2H2     G  19          2H2         G  19  -4.408  10.683   0.718
  203   1H5*    A  20          1H5*        A  20   5.682  10.104   2.254
  204   2H5*    A  20          2H5*        A  20   4.065  10.376   1.646
  205    H4*    A  20           H4*        A  20   5.229  11.684   4.140
  206    H3*    A  20           H3*        A  20   3.482   9.235   3.784
  207    H2*    A  20           H2*        A  20   2.289   9.885   5.758
  208   2HO*    A  20          2HO*        A  20   4.296  10.697   6.761
  209    H1*    A  20           H1*        A  20   1.861  12.393   5.042
  210    H8     A  20           H8         A  20   2.037  10.725   1.709
  211   1H6     A  20          1H6         A  20  -3.828   8.988   2.792
  212   2H6     A  20          2H6         A  20  -2.504   8.995   1.633
  213    H2     A  20           H2         A  20  -2.259  10.718   6.497
  214   1H5*    U  21          1H5*        U  21   4.262   9.351   7.906
  215   2H5*    U  21          2H5*        U  21   4.583   7.729   8.521
  216    H4*    U  21           H4*        U  21   2.664   8.845   9.619
  217    H3*    U  21           H3*        U  21   2.008   6.249   8.164
  218    H2*    U  21           H2*        U  21  -0.161   6.500   8.916
  219   2HO*    U  21          2HO*        U  21   0.412   7.163  11.028
  220    H1*    U  21           H1*        U  21  -0.480   9.140   8.461
  221    H3     U  21           H3         U  21  -2.960   6.916   5.380
  222    H5     U  21           H5         U  21   0.889   7.089   3.718
  223    H6     U  21           H6         U  21   1.697   7.939   5.804
  224   1H5*    C  22          1H5*        C  22   0.103   3.155  11.567
  225   2H5*    C  22          2H5*        C  22   0.032   3.510   9.859
  226    H4*    C  22           H4*        C  22  -1.869   4.579  11.988
  227    H3*    C  22           H3*        C  22  -1.908   2.415   9.919
  228    H2*    C  22           H2*        C  22  -4.185   2.848   9.351
  229   2HO*    C  22          2HO*        C  22  -4.689   3.286  11.610
  230    H1*    C  22           H1*        C  22  -3.954   5.517   9.169
  231   1H4     C  22          1H4         C  22  -2.629   3.483   3.455
  232   2H4     C  22          2H4         C  22  -0.883   3.656   3.760
  233    H5     C  22           H5         C  22   0.008   4.162   5.976
  234    H6     C  22           H6         C  22  -0.601   4.620   8.237
  235   1H5*    A  23          1H5*        A  23  -5.645   1.409  11.586
  236   2H5*    A  23          2H5*        A  23  -5.471  -0.267  12.125
  237    H4*    A  23           H4*        A  23  -7.343  -0.092  10.637
  238    H3*    A  23           H3*        A  23  -5.030  -1.561   9.397
  239    H2*    A  23           H2*        A  23  -6.615  -2.142   7.638
  240   2HO*    A  23          2HO*        A  23  -8.540  -2.163   9.104
  241    H1*    A  23           H1*        A  23  -7.341   0.381   7.278
  242    H8     A  23           H8         A  23  -3.891   1.058   8.422
  243   1H6     A  23          1H6         A  23  -2.338  -0.100   2.511
  244   2H6     A  23          2H6         A  23  -1.757   0.550   4.073
  245    H2     A  23           H2         A  23  -6.263  -1.841   3.194
  246   1H5*    G  24          1H5*        G  24  -8.098  -4.520   7.604
  247   2H5*    G  24          2H5*        G  24  -7.924  -5.913   8.657
  248    H4*    G  24           H4*        G  24  -7.172  -6.426   6.363
  249    H3*    G  24           H3*        G  24  -5.321  -6.596   8.683
  250    H2*    G  24           H2*        G  24  -3.410  -6.339   7.510
  251   2HO*    G  24          2HO*        G  24  -4.374  -8.408   6.449
  252    H1*    G  24           H1*        G  24  -4.528  -5.637   4.904
  253    H8     G  24           H8         G  24  -4.505  -3.129   7.696
  254    H1     G  24           H1         G  24   0.865  -3.313   4.084
  255   1H2     G  24          1H2         G  24   0.613  -5.029   2.547
  256   2H2     G  24          2H2         G  24  -0.934  -5.859   2.572
  257   1H5*    U  25          1H5*        U  25  -8.361 -10.312   5.758
  258   2H5*    U  25          2H5*        U  25  -6.970  -9.311   5.357
  259    H4*    U  25           H4*        U  25  -9.886  -8.636   4.745
  260    H3*    U  25           H3*        U  25  -7.613  -9.788   3.136
  261    H2*    U  25           H2*        U  25  -8.216  -8.465   1.251
  262   2HO*    U  25          2HO*        U  25 -10.452  -8.903   1.523
  263    H1*    U  25           H1*        U  25  -8.798  -6.186   2.571
  264    H3     U  25           H3         U  25  -4.844  -4.645   1.079
  265    H5     U  25           H5         U  25  -3.726  -7.973   3.327
  266    H6     U  25           H6         U  25  -6.067  -8.440   3.748
  267   1H5*    A  26          1H5*        A  26  -8.995 -12.066  -0.978
  268   2H5*    A  26          2H5*        A  26  -7.639 -11.174  -0.340
  269    H4*    A  26           H4*        A  26  -9.816 -10.104  -2.183
  270    H3*    A  26           H3*        A  26  -6.937 -10.921  -2.401
  271    H2*    A  26           H2*        A  26  -6.399  -9.134  -3.859
  272   2HO*    A  26          2HO*        A  26  -8.515  -9.314  -4.951
  273    H1*    A  26           H1*        A  26  -7.550  -7.202  -2.458
  274    H8     A  26           H8         A  26  -6.715  -9.526   0.308
  275   1H6     A  26          1H6         A  26  -0.911  -7.414  -0.170
  276   2H6     A  26          2H6         A  26  -2.044  -8.400   0.758
  277    H2     A  26           H2         A  26  -3.045  -6.136  -3.760
  278   1H5*    U  27          1H5*        U  27  -7.486 -10.281  -6.334
  279   2H5*    U  27          2H5*        U  27  -7.004 -11.690  -7.296
  280    H4*    U  27           H4*        U  27  -5.714  -9.739  -7.940
  281    H3*    U  27           H3*        U  27  -4.044 -11.855  -6.540
  282    H2*    U  27           H2*        U  27  -2.183 -10.432  -7.071
  283   2HO*    U  27          2HO*        U  27  -3.015  -9.857  -9.131
  284    H1*    U  27           H1*        U  27  -3.264  -8.156  -6.235
  285    H3     U  27           H3         U  27  -0.249  -9.677  -3.103
  286    H5     U  27           H5         U  27  -3.955 -11.243  -1.955
  287    H6     U  27           H6         U  27  -4.879 -10.501  -4.042
  288   1H5*    A  28          1H5*        A  28  -2.156 -10.846 -10.225
  289   2H5*    A  28          2H5*        A  28  -1.453 -12.276 -10.990
  290    H4*    A  28           H4*        A  28   0.209 -10.518 -10.674
  291    H3*    A  28           H3*        A  28   0.733 -12.996  -8.994
  292    H2*    A  28           H2*        A  28   2.771 -11.866  -8.367
  293   2HO*    A  28          2HO*        A  28   3.056 -10.988 -10.509
  294    H1*    A  28           H1*        A  28   1.646  -9.549  -7.741
  295    H8     A  28           H8         A  28  -1.038 -12.024  -6.898
  296   1H6     A  28          1H6         A  28   2.001 -12.732  -1.552
  297   2H6     A  28          2H6         A  28   0.492 -13.013  -2.438
  298    H2     A  28           H2         A  28   4.715 -10.678  -4.336
  299   1H5*    U  29          1H5*        U  29   4.251 -11.954 -11.093
  300   2H5*    U  29          2H5*        U  29   5.141 -13.379 -11.640
  301    H4*    U  29           H4*        U  29   6.511 -11.937 -10.194
  302    H3*    U  29           H3*        U  29   5.895 -14.667  -8.994
  303    H2*    U  29           H2*        U  29   7.431 -13.972  -7.243
  304   2HO*    U  29          2HO*        U  29   8.769 -12.830  -8.800
  305    H1*    U  29           H1*        U  29   6.286 -11.606  -6.820
  306    H3     U  29           H3         U  29   5.047 -14.544  -3.557
  307    H5     U  29           H5         U  29   2.192 -15.073  -6.576
  308    H6     U  29           H6         U  29   3.505 -13.668  -8.004
  309   1H5*    C  30          1H5*        C  30  10.013 -14.003  -8.664
  310   2H5*    C  30          2H5*        C  30  10.936 -15.441  -9.116
  311    H4*    C  30           H4*        C  30  11.528 -14.646  -6.875
  312    H3*    C  30           H3*        C  30  10.161 -17.371  -6.888
  313    H2*    C  30           H2*        C  30  10.673 -17.393  -4.538
  314   2HO*    C  30          2HO*        C  30  12.687 -16.182  -4.972
  315    H1*    C  30           H1*        C  30   9.678 -14.972  -4.027
  316   1H4     C  30          1H4         C  30   4.743 -18.755  -3.517
  317   2H4     C  30          2H4         C  30   4.174 -18.305  -5.144
  318    H5     C  30           H5         C  30   5.567 -17.079  -6.671
  319    H6     C  30           H6         C  30   7.641 -15.911  -6.872
  320   1H5*    C  31          1H5*        C  31  13.515 -17.663  -4.450
  321   2H5*    C  31          2H5*        C  31  14.507 -19.028  -4.975
  322    H4*    C  31           H4*        C  31  14.050 -19.238  -2.597
  323    H3*    C  31           H3*        C  31  12.520 -21.225  -4.322
  324    H2*    C  31           H2*        C  31  11.858 -22.273  -2.285
  325   2HO*    C  31          2HO*        C  31  13.983 -21.853  -1.280
  326    H1*    C  31           H1*        C  31  11.167 -19.958  -1.056
  327   1H4     C  31          1H4         C  31   5.958 -22.036  -3.772
  328   2H4     C  31          2H4         C  31   6.295 -21.130  -5.269
  329    H5     C  31           H5         C  31   8.367 -19.968  -5.625
  330    H6     C  31           H6         C  31  10.450 -19.376  -4.625
  331    H3T    C  31           H3T        C  31  14.775 -21.431  -4.378
  Start of MODEL   20
    1   1H5*    G   1          1H5*        G   1  -6.392 -21.030   9.662
    2   2H5*    G   1          2H5*        G   1  -5.947 -22.099   8.334
    3    H4*    G   1           H4*        G   1  -4.592 -22.092  11.071
    4    H3*    G   1           H3*        G   1  -3.931 -20.647   8.499
    5    H2*    G   1           H2*        G   1  -1.585 -21.000   9.020
    6   2HO*    G   1          2HO*        G   1  -1.883 -20.711  11.312
    7    H1*    G   1           H1*        G   1  -1.847 -23.609   9.511
    8    H8     G   1           H8         G   1  -4.554 -22.919   7.025
    9    H1     G   1           H1         G   1   1.322 -23.069   4.434
   10   1H2     G   1          1H2         G   1   2.832 -23.027   6.068
   11   2H2     G   1          2H2         G   1   2.332 -22.993   7.752
   12    H5T    G   1           H5T        G   1  -6.348 -23.873   9.791
   13   1H5*    G   2          1H5*        G   2  -1.322 -19.110  11.361
   14   2H5*    G   2          2H5*        G   2  -1.213 -17.347  11.258
   15    H4*    G   2           H4*        G   2   0.997 -18.398  11.131
   16    H3*    G   2           H3*        G   2   0.121 -16.999   8.576
   17    H2*    G   2           H2*        G   2   2.348 -17.506   7.769
   18   2HO*    G   2          2HO*        G   2   3.286 -17.138   9.887
   19    H1*    G   2           H1*        G   2   2.310 -20.086   8.497
   20    H8     G   2           H8         G   2  -1.275 -19.512   7.674
   21    H1     G   2           H1         G   2   2.497 -19.519   2.471
   22   1H2     G   2          1H2         G   2   4.613 -19.347   3.112
   23   2H2     G   2          2H2         G   2   5.049 -19.330   4.825
   24   1H5*    A   3          1H5*        A   3   4.105 -15.731   9.416
   25   2H5*    A   3          2H5*        A   3   4.193 -13.969   9.292
   26    H4*    A   3           H4*        A   3   5.919 -15.037   7.925
   27    H3*    A   3           H3*        A   3   3.765 -13.559   6.393
   28    H2*    A   3           H2*        A   3   5.094 -14.030   4.419
   29   2HO*    A   3          2HO*        A   3   7.113 -13.743   5.613
   30    H1*    A   3           H1*        A   3   5.455 -16.621   4.946
   31    H8     A   3           H8         A   3   2.076 -16.074   6.425
   32   1H6     A   3          1H6         A   3  -0.129 -16.402   0.642
   33   2H6     A   3          2H6         A   3  -0.497 -16.491   2.354
   34    H2     A   3           H2         A   3   4.260 -15.779   0.387
   35   1H5*    U   4          1H5*        U   4   7.507 -12.371   4.873
   36   2H5*    U   4          2H5*        U   4   7.607 -10.631   4.597
   37    H4*    U   4           H4*        U   4   8.104 -11.939   2.545
   38    H3*    U   4           H3*        U   4   5.616 -10.204   2.483
   39    H2*    U   4           H2*        U   4   5.470 -10.864   0.130
   40   2HO*    U   4          2HO*        U   4   7.788 -10.822  -0.129
   41    H1*    U   4           H1*        U   4   5.854 -13.481   0.571
   42    H3     U   4           H3         U   4   1.416 -12.594  -0.359
   43    H5     U   4           H5         U   4   1.794 -12.376   3.832
   44    H6     U   4           H6         U   4   4.166 -12.503   3.596
   45   1H5*    A   5          1H5*        A   5   7.927  -9.458  -1.021
   46   2H5*    A   5          2H5*        A   5   7.976  -7.736  -1.414
   47    H4*    A   5           H4*        A   5   7.186  -9.079  -3.318
   48    H3*    A   5           H3*        A   5   5.127  -7.185  -2.123
   49    H2*    A   5           H2*        A   5   3.681  -7.892  -3.915
   50   2HO*    A   5          2HO*        A   5   5.394  -7.995  -5.475
   51    H1*    A   5           H1*        A   5   4.095 -10.510  -3.603
   52    H8     A   5           H8         A   5   4.404  -9.252  -0.096
   53   1H6     A   5          1H6         A   5  -1.780  -9.201  -0.010
   54   2H6     A   5          2H6         A   5  -0.317  -9.087   0.978
   55    H2     A   5           H2         A   5  -0.487  -9.544  -4.215
   56   1H5*    U   6          1H5*        U   6   5.134  -6.574  -6.389
   57   2H5*    U   6          2H5*        U   6   4.931  -4.846  -6.732
   58    H4*    U   6           H4*        U   6   3.162  -6.304  -7.746
   59    H3*    U   6           H3*        U   6   2.269  -4.202  -5.744
   60    H2*    U   6           H2*        U   6   0.024  -4.877  -6.347
   61   2HO*    U   6          2HO*        U   6   0.628  -5.155  -8.591
   62    H1*    U   6           H1*        U   6   0.481  -7.530  -6.216
   63    H3     U   6           H3         U   6  -2.027  -6.194  -2.658
   64    H5     U   6           H5         U   6   1.951  -5.777  -1.393
   65    H6     U   6           H6         U   6   2.670  -6.214  -3.646
   66   1H5*    A   7          1H5*        A   7  -0.340  -3.842  -9.099
   67   2H5*    A   7          2H5*        A   7  -0.561  -2.123  -9.471
   68    H4*    A   7           H4*        A   7  -2.704  -3.279  -9.133
   69    H3*    A   7           H3*        A   7  -2.034  -1.160  -7.050
   70    H2*    A   7           H2*        A   7  -4.122  -1.596  -6.074
   71   2HO*    A   7          2HO*        A   7  -5.268  -1.713  -8.060
   72    H1*    A   7           H1*        A   7  -4.074  -4.297  -6.287
   73    H8     A   7           H8         A   7  -0.589  -3.211  -5.418
   74   1H6     A   7          1H6         A   7  -2.810  -2.888   0.415
   75   2H6     A   7          2H6         A   7  -1.316  -2.883  -0.550
   76    H2     A   7           H2         A   7  -6.182  -3.509  -2.275
   77   1H5*    U   8          1H5*        U   8  -5.426   2.361  -7.023
   78   2H5*    U   8          2H5*        U   8  -4.295   1.578  -5.935
   79    H4*    U   8           H4*        U   8  -7.269   0.944  -6.198
   80    H3*    U   8           H3*        U   8  -5.510   2.549  -4.383
   81    H2*    U   8           H2*        U   8  -6.729   1.864  -2.431
   82   2HO*    U   8          2HO*        U   8  -8.794   1.951  -3.517
   83    H1*    U   8           H1*        U   8  -6.775  -0.729  -3.005
   84    H3     U   8           H3         U   8  -3.392   0.251   0.016
   85    H5     U   8           H5         U   8  -1.613  -0.020  -3.778
   86    H6     U   8           H6         U   8  -3.793  -0.009  -4.780
   87   1H5*    G   9          1H5*        G   9  -9.375   3.962  -2.842
   88   2H5*    G   9          2H5*        G   9  -9.252   5.736  -2.834
   89    H4*    G   9           H4*        G   9  -9.718   4.870  -0.579
   90    H3*    G   9           H3*        G   9  -6.911   5.927  -0.914
   91    H2*    G   9           H2*        G   9  -6.776   5.783   1.518
   92   2HO*    G   9          2HO*        G   9  -9.085   6.164   1.941
   93    H1*    G   9           H1*        G   9  -7.515   3.238   1.455
   94    H8     G   9           H8         G   9  -5.837   3.563  -1.881
   95    H1     G   9           H1         G   9  -1.692   3.770   3.016
   96   1H2     G   9          1H2         G   9  -2.799   4.070   4.912
   97   2H2     G   9          2H2         G   9  -4.553   4.148   4.933
   98   1H5*    A  10          1H5*        A  10  -8.373   9.882   2.040
   99   2H5*    A  10          2H5*        A  10  -7.169   8.764   1.416
  100    H4*    A  10           H4*        A  10  -8.213   8.792   4.285
  101    H3*    A  10           H3*        A  10  -5.808   9.995   2.928
  102    H2*    A  10           H2*        A  10  -4.432   9.414   4.839
  103   2HO*    A  10          2HO*        A  10  -6.213   9.882   6.334
  104    H1*    A  10           H1*        A  10  -5.244   6.900   5.024
  105    H8     A  10           H8         A  10  -5.675   7.398   1.368
  106   1H6     A  10          1H6         A  10   0.458   6.653   0.860
  107   2H6     A  10          2H6         A  10  -1.070   6.780  -0.004
  108    H2     A  10           H2         A  10  -0.488   7.219   5.159
  109   1H5*    U  11          1H5*        U  11  -5.184  11.215   6.895
  110   2H5*    U  11          2H5*        U  11  -4.914  12.967   6.908
  111    H4*    U  11           H4*        U  11  -3.035  11.752   7.945
  112    H3*    U  11           H3*        U  11  -2.425  13.013   5.270
  113    H2*    U  11           H2*        U  11  -0.100  12.594   5.765
  114   2HO*    U  11          2HO*        U  11  -0.283  12.854   8.134
  115    H1*    U  11           H1*        U  11  -0.575  10.076   6.431
  116    H3     U  11           H3         U  11   1.258  10.131   2.249
  117    H5     U  11           H5         U  11  -2.886  10.555   1.648
  118    H6     U  11           H6         U  11  -3.153  10.791   4.036
  119   1H5*    A  12          1H5*        A  12   0.108  16.566   8.079
  120   2H5*    A  12          2H5*        A  12  -0.084  15.642   6.583
  121    H4*    A  12           H4*        A  12   2.279  15.421   8.506
  122    H3*    A  12           H3*        A  12   1.664  17.068   6.093
  123    H2*    A  12           H2*        A  12   3.547  16.426   4.916
  124   2HO*    A  12          2HO*        A  12   4.825  16.916   6.929
  125    H1*    A  12           H1*        A  12   3.961  13.951   5.740
  126    H8     A  12           H8         A  12   0.356  14.308   4.940
  127   1H6     A  12          1H6         A  12   2.041  13.463  -0.973
  128   2H6     A  12          2H6         A  12   0.685  13.554   0.139
  129    H2     A  12           H2         A  12   5.718  14.054   1.444
  130   1H5*    U  13          1H5*        U  13   5.777  18.378   6.316
  131   2H5*    U  13          2H5*        U  13   5.609  20.144   6.275
  132    H4*    U  13           H4*        U  13   6.912  19.447   4.356
  133    H3*    U  13           H3*        U  13   4.100  20.346   3.686
  134    H2*    U  13           H2*        U  13   4.758  20.135   1.382
  135   2HO*    U  13          2HO*        U  13   6.838  20.992   1.614
  136    H1*    U  13           H1*        U  13   6.021  17.790   1.613
  137    H3     U  13           H3         U  13   2.250  16.607  -0.546
  138    H5     U  13           H5         U  13   0.970  17.288   3.379
  139    H6     U  13           H6         U  13   3.184  18.069   3.918
  140   1H5*    A  14          1H5*        A  14   7.351  22.424   1.317
  141   2H5*    A  14          2H5*        A  14   6.877  24.120   1.221
  142    H4*    A  14           H4*        A  14   7.522  23.166  -0.961
  143    H3*    A  14           H3*        A  14   5.243  24.726  -0.399
  144    H2*    A  14           H2*        A  14   3.727  23.209  -0.646
  145   2HO*    A  14          2HO*        A  14   4.224  23.678  -3.375
  146    H1*    A  14           H1*        A  14   5.255  21.765  -2.851
  147    H8     A  14           H8         A  14   3.552  21.426   0.470
  148   1H6     A  14          1H6         A  14   0.240  17.976  -0.952
  149   2H6     A  14          2H6         A  14   0.048  17.137  -2.485
  150    H2     A  14           H2         A  14   3.106  18.628  -5.256
  151   1H5*    A  15          1H5*        A  15   5.192  24.904  -5.939
  152   2H5*    A  15          2H5*        A  15   4.009  24.995  -4.627
  153    H4*    A  15           H4*        A  15   4.267  22.750  -6.614
  154    H3*    A  15           H3*        A  15   3.166  25.100  -7.316
  155    H2*    A  15           H2*        A  15   1.852  25.170  -5.301
  156   2HO*    A  15          2HO*        A  15   0.535  24.999  -7.551
  157    H1*    A  15           H1*        A  15   0.936  22.348  -5.942
  158    H8     A  15           H8         A  15   1.742  24.885  -3.292
  159   1H6     A  15          1H6         A  15  -1.985  21.498   0.369
  160   2H6     A  15          2H6         A  15  -1.049  22.997   0.272
  161    H2     A  15           H2         A  15  -1.513  19.414  -3.469
  162   1H5*    U  16          1H5*        U  16   0.988  21.026  -8.989
  163   2H5*    U  16          2H5*        U  16   0.289  21.448 -10.561
  164    H4*    U  16           H4*        U  16  -1.134  19.832  -9.301
  165    H3*    U  16           H3*        U  16  -2.196  22.543  -9.977
  166    H2*    U  16           H2*        U  16  -3.934  22.407  -8.507
  167   2HO*    U  16          2HO*        U  16  -4.342  20.285  -9.817
  168    H1*    U  16           H1*        U  16  -3.010  20.098  -7.020
  169    H3     U  16           H3         U  16  -3.924  22.435  -3.233
  170    H5     U  16           H5         U  16  -2.422  25.377  -5.818
  171    H6     U  16           H6         U  16  -2.037  23.655  -7.483
  172   1H5*    U  17          1H5*        U  17  -1.688  17.568 -12.209
  173   2H5*    U  17          2H5*        U  17  -2.139  18.116 -10.592
  174    H4*    U  17           H4*        U  17   0.742  17.534 -11.384
  175    H3*    U  17           H3*        U  17  -1.401  15.632 -10.742
  176    H2*    U  17           H2*        U  17  -0.514  14.794  -8.686
  177   2HO*    U  17          2HO*        U  17   1.664  14.645  -9.719
  178    H1*    U  17           H1*        U  17   0.625  16.969  -7.654
  179    H3     U  17           H3         U  17  -2.810  18.502  -5.190
  180    H5     U  17           H5         U  17  -4.703  16.461  -8.325
  181    H6     U  17           H6         U  17  -2.593  16.186  -9.354
  182   1H5*    U  18          1H5*        U  18   1.490  11.387  -9.667
  183   2H5*    U  18          2H5*        U  18   1.099  12.849  -8.768
  184    H4*    U  18           H4*        U  18   3.912  12.130  -9.698
  185    H3*    U  18           H3*        U  18   2.464  11.199  -7.300
  186    H2*    U  18           H2*        U  18   3.734  12.244  -5.663
  187   2HO*    U  18          2HO*        U  18   5.758  11.571  -6.480
  188    H1*    U  18           H1*        U  18   4.448  14.545  -6.854
  189    H3     U  18           H3         U  18   1.205  17.027  -5.042
  190    H5     U  18           H5         U  18  -0.655  13.312  -5.541
  191    H6     U  18           H6         U  18   1.286  12.558  -6.672
  192   1H5*    G  19          1H5*        G  19   7.052  10.316  -7.278
  193   2H5*    G  19          2H5*        G  19   7.162   8.723  -6.493
  194    H4*    G  19           H4*        G  19   8.823  10.221  -5.553
  195    H3*    G  19           H3*        G  19   6.488   9.415  -3.854
  196    H2*    G  19           H2*        G  19   7.149  10.711  -2.010
  197   2HO*    G  19          2HO*        G  19   9.671  10.548  -3.156
  198    H1*    G  19           H1*        G  19   7.860  12.836  -3.348
  199    H8     G  19           H8         G  19   4.846  10.515  -3.472
  200    H1     G  19           H1         G  19   3.533  16.758  -2.952
  201   1H2     G  19          1H2         G  19   5.392  17.955  -3.310
  202   2H2     G  19          2H2         G  19   6.903  17.149  -3.659
  203   1H5*    A  20          1H5*        A  20   9.962   6.570  -1.199
  204   2H5*    A  20          2H5*        A  20   8.404   7.375  -1.377
  205    H4*    A  20           H4*        A  20  10.566   8.062   0.656
  206    H3*    A  20           H3*        A  20   7.892   6.667   0.711
  207    H2*    A  20           H2*        A  20   7.389   7.687   2.842
  208   2HO*    A  20          2HO*        A  20   9.707   7.514   3.483
  209    H1*    A  20           H1*        A  20   7.998  10.187   2.119
  210    H8     A  20           H8         A  20   7.042   8.860  -1.200
  211   1H6     A  20          1H6         A  20   2.085   9.062  -0.633
  212   2H6     A  20          2H6         A  20   1.099   9.151   0.744
  213    H2     A  20           H2         A  20   3.668   9.807   4.180
  214   1H5*    U  21          1H5*        U  21   9.152   6.388   4.640
  215   2H5*    U  21          2H5*        U  21   9.004   4.738   5.250
  216    H4*    U  21           H4*        U  21   7.765   6.400   6.623
  217    H3*    U  21           H3*        U  21   6.129   4.210   5.269
  218    H2*    U  21           H2*        U  21   4.250   5.074   6.341
  219   2HO*    U  21          2HO*        U  21   5.185   5.441   8.357
  220    H1*    U  21           H1*        U  21   4.733   7.685   5.951
  221    H3     U  21           H3         U  21   1.286   6.392   3.243
  222    H5     U  21           H5         U  21   4.776   5.730   1.013
  223    H6     U  21           H6         U  21   6.058   6.193   2.967
  224   1H5*    C  22          1H5*        C  22   3.848   1.936   9.280
  225   2H5*    C  22          2H5*        C  22   3.595   2.171   7.555
  226    H4*    C  22           H4*        C  22   2.603   4.018   9.770
  227    H3*    C  22           H3*        C  22   1.492   1.825   8.066
  228    H2*    C  22           H2*        C  22  -0.595   2.993   7.696
  229   2HO*    C  22          2HO*        C  22  -0.543   3.845   9.922
  230    H1*    C  22           H1*        C  22   0.479   5.342   7.158
  231   1H4     C  22          1H4         C  22   0.352   2.698   1.486
  232   2H4     C  22          2H4         C  22   2.062   2.312   1.628
  233    H5     C  22           H5         C  22   3.321   2.611   3.694
  234    H6     C  22           H6         C  22   3.193   3.385   5.973
  235   1H5*    A  23          1H5*        A  23  -2.027   3.069  10.088
  236   2H5*    A  23          2H5*        A  23  -2.536   1.692  11.094
  237    H4*    A  23           H4*        A  23  -4.296   2.413   9.632
  238    H3*    A  23           H3*        A  23  -3.051  -0.163   9.572
  239    H2*    A  23           H2*        A  23  -2.840  -0.585   7.625
  240   2HO*    A  23          2HO*        A  23  -5.650  -0.505   7.510
  241    H1*    A  23           H1*        A  23  -4.744   1.466   6.558
  242    H8     A  23           H8         A  23  -1.099   0.944   7.198
  243   1H6     A  23          1H6         A  23  -0.661  -0.021   0.994
  244   2H6     A  23          2H6         A  23   0.291   0.095   2.487
  245    H2     A  23           H2         A  23  -4.871   0.584   2.052
  246   1H5*    G  24          1H5*        G  24  -8.292  -1.472   8.619
  247   2H5*    G  24          2H5*        G  24  -6.713  -2.048   8.184
  248    H4*    G  24           H4*        G  24  -8.717  -0.794   6.251
  249    H3*    G  24           H3*        G  24  -8.109  -3.674   6.936
  250    H2*    G  24           H2*        G  24  -8.643  -4.168   4.657
  251   2HO*    G  24          2HO*        G  24 -10.311  -2.643   4.352
  252    H1*    G  24           H1*        G  24  -7.003  -2.328   3.630
  253    H8     G  24           H8         G  24  -4.649  -2.542   5.984
  254    H1     G  24           H1         G  24  -5.510  -8.589   4.062
  255   1H2     G  24          1H2         G  24  -8.602  -7.462   2.982
  256   2H2     G  24          2H2         G  24  -7.547  -8.781   3.093
  257   1H5*    U  25          1H5*        U  25 -11.617  -6.093   4.513
  258   2H5*    U  25          2H5*        U  25 -10.074  -5.346   4.218
  259    H4*    U  25           H4*        U  25 -12.651  -4.829   2.697
  260    H3*    U  25           H3*        U  25 -10.036  -6.226   2.194
  261    H2*    U  25           H2*        U  25 -10.083  -5.519  -0.119
  262   2HO*    U  25          2HO*        U  25 -12.412  -5.938  -0.217
  263    H1*    U  25           H1*        U  25 -10.946  -3.014   0.354
  264    H3     U  25           H3         U  25  -7.007  -0.880   0.826
  265    H5     U  25           H5         U  25  -6.047  -4.898   1.505
  266    H6     U  25           H6         U  25  -8.379  -5.447   1.412
  267   1H5*    A  26          1H5*        A  26 -12.412  -7.358  -1.237
  268   2H5*    A  26          2H5*        A  26 -12.199  -9.106  -1.446
  269    H4*    A  26           H4*        A  26 -11.660  -7.824  -3.502
  270    H3*    A  26           H3*        A  26  -9.398  -9.362  -2.193
  271    H2*    A  26           H2*        A  26  -8.086  -8.727  -4.132
  272   2HO*    A  26          2HO*        A  26  -9.897  -8.960  -5.592
  273    H1*    A  26           H1*        A  26  -8.755  -6.147  -4.082
  274    H8     A  26           H8         A  26  -8.836  -6.989  -0.456
  275   1H6     A  26          1H6         A  26  -2.635  -6.776  -0.574
  276   2H6     A  26          2H6         A  26  -4.063  -6.912   0.442
  277    H2     A  26           H2         A  26  -4.080  -6.638  -4.750
  278   1H5*    U  27          1H5*        U  27  -9.390 -10.356  -6.251
  279   2H5*    U  27          2H5*        U  27  -9.143 -12.087  -6.509
  280    H4*    U  27           H4*        U  27  -7.458 -10.740  -7.698
  281    H3*    U  27           H3*        U  27  -6.315 -12.438  -5.430
  282    H2*    U  27           H2*        U  27  -4.182 -11.717  -6.276
  283   2HO*    U  27          2HO*        U  27  -4.852 -11.767  -8.490
  284    H1*    U  27           H1*        U  27  -4.821  -9.110  -6.364
  285    H3     U  27           H3         U  27  -2.286 -10.074  -2.645
  286    H5     U  27           H5         U  27  -6.259 -10.504  -1.414
  287    H6     U  27           H6         U  27  -6.945 -10.284  -3.700
  288   1H5*    A  28          1H5*        A  28  -4.174 -13.329  -9.011
  289   2H5*    A  28          2H5*        A  28  -3.892 -15.077  -9.126
  290    H4*    A  28           H4*        A  28  -1.805 -13.831  -9.369
  291    H3*    A  28           H3*        A  28  -1.997 -15.461  -6.813
  292    H2*    A  28           H2*        A  28   0.317 -14.785  -6.478
  293   2HO*    A  28          2HO*        A  28   0.819 -14.965  -8.756
  294    H1*    A  28           H1*        A  28  -0.088 -12.201  -6.999
  295    H8     A  28           H8         A  28  -3.328 -13.216  -5.392
  296   1H6     A  28          1H6         A  28  -1.767 -12.729  -0.671
  297   2H6     A  28          2H6         A  28  -0.238 -12.590   0.005
  298    H2     A  28           H2         A  28   2.704 -12.654  -3.185
  299   1H5*    U  29          1H5*        U  29   1.668 -16.359  -8.723
  300   2H5*    U  29          2H5*        U  29   2.086 -18.076  -8.620
  301    H4*    U  29           H4*        U  29   3.853 -16.638  -7.669
  302    H3*    U  29           H3*        U  29   2.430 -18.406  -5.633
  303    H2*    U  29           H2*        U  29   4.118 -17.584  -4.093
  304   2HO*    U  29          2HO*        U  29   5.767 -17.527  -5.779
  305    H1*    U  29           H1*        U  29   3.769 -15.005  -4.706
  306    H3     U  29           H3         U  29   1.650 -15.986  -0.773
  307    H5     U  29           H5         U  29  -1.225 -16.645  -3.744
  308    H6     U  29           H6         U  29   0.503 -16.388  -5.389
  309   1H5*    C  30          1H5*        C  30   6.562 -18.873  -5.141
  310   2H5*    C  30          2H5*        C  30   7.017 -20.571  -4.938
  311    H4*    C  30           H4*        C  30   7.856 -19.167  -3.091
  312    H3*    C  30           H3*        C  30   5.732 -21.209  -2.279
  313    H2*    C  30           H2*        C  30   6.260 -20.507  -0.024
  314   2HO*    C  30          2HO*        C  30   8.548 -20.171  -0.651
  315    H1*    C  30           H1*        C  30   6.040 -17.881  -0.536
  316   1H4     C  30          1H4         C  30   0.191 -19.784   0.834
  317   2H4     C  30          2H4         C  30  -0.214 -19.848  -0.891
  318    H5     C  30           H5         C  30   1.479 -19.618  -2.624
  319    H6     C  30           H6         C  30   3.793 -19.188  -3.020
  320   1H5*    C  31          1H5*        C  31   8.904 -21.488   0.398
  321   2H5*    C  31          2H5*        C  31   9.444 -23.168   0.534
  322    H4*    C  31           H4*        C  31   8.989 -22.270   2.764
  323    H3*    C  31           H3*        C  31   6.937 -24.286   1.761
  324    H2*    C  31           H2*        C  31   6.057 -24.244   4.004
  325   2HO*    C  31          2HO*        C  31   8.217 -24.028   4.969
  326    H1*    C  31           H1*        C  31   6.052 -21.528   4.156
  327   1H4     C  31          1H4         C  31   0.398 -23.096   1.933
  328   2H4     C  31          2H4         C  31   0.959 -22.907   0.265
  329    H5     C  31           H5         C  31   3.302 -22.544  -0.290
  330    H6     C  31           H6         C  31   5.481 -22.197   0.613
  331    H3T    C  31           H3T        C  31   9.055 -25.077   2.009