*HEADER    RNA BINDING PROTEIN                     01-OCT-05   2B6G              
*TITLE     RNA RECOGNITION BY THE VTS1 SAM DOMAIN                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-                                                        
*COMPND   3 R(*GP*GP*AP*GP*GP*CP*UP*CP*UP*GP*GP*CP*AP*GP*CP*UP*UP*UP*C)          
*COMPND   4 -3';                                                                 
*COMPND   5 CHAIN: B;                                                            
*COMPND   6 FRAGMENT: SMAUG RECOGNITION ELEMENT;                                 
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: VTS1P;                                                     
*COMPND  10 CHAIN: A;                                                            
*COMPND  11 FRAGMENT: SAM DOMAIN;                                                
*COMPND  12 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: RNA WAS PRODUCED BY T7 POLYMERASE BASED IN            
*SOURCE   4 VITRO TRANSCRIPTION;                                                 
*SOURCE   5 MOL_ID: 2;                                                           
*SOURCE   6 ORGANISM_SCIENTIFIC: SACCHAROMYCES CEREVISIAE;                       
*SOURCE   7 ORGANISM_COMMON: YEAST;                                              
*SOURCE   8 GENE: VTS1P;                                                         
*SOURCE   9 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE  10 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE  11 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE  12 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  13 EXPRESSION_SYSTEM_PLASMID: PGEX                                      
*KEYWDS    ALPHA-HELIX, PENTALOOP, HAIRPIN                                       
*EXPDTA    NMR                                                                   
*AUTHOR    L.W.DONALDSON, P.E.JOHNSON                                            
*REVDAT   1   24-JAN-06 2B6G    0                                                


assign ( resid    5 and name    HN )
       ( resid    5 and name    HA )
        5.00  3.20  0.00 peak    0 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 20001 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name    HA )
        5.00  3.20  0.00 peak 20002 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 20003 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name   HB2 )
        5.00  3.20  0.00 peak 20005 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name   HB1 )
        4.87  3.07  0.00 peak 20008 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name   HB2 )
        5.00  3.20  0.00 peak 20010 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name   HB1 )
        5.00  3.20  0.00 peak 20011 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 20012 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 20013 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name   HB2 )
        5.00  3.20  0.00 peak 20014 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name   HB2 )
        5.00  3.20  0.00 peak 20015 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name   HB1 )
        5.00  3.20  0.00 peak 20016 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name   HB1 )
        5.00  3.20  0.00 peak 20027 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   14 and name    HN )
        5.00  3.20  0.00 peak 20049 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   13 and name    HA )
        5.00  3.20  0.00 peak 20050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   13 and name   HB2 )
        5.00  3.20  0.00 peak 20051 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   13 and name   HB1 )
        5.00  3.20  0.00 peak 20052 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   13 and name   HB2 )
        4.36  2.56  0.00 peak 20054 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   13 and name   HB1 )
        5.00  3.20  0.00 peak 20056 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   13 and name   HB1 )
        5.00  3.20  0.00 peak 20058 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   13 and name   HB2 )
        5.00  3.20  0.00 peak 20059 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HA )
       ( resid   13 and name   HB2 )
        5.00  3.20  0.00 peak 20060 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   35 and name    HN )
        5.00  3.20  0.00 peak 20064 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   12 and name   HB1 )
        5.00  3.20  0.00 peak 20065 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 20066 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20068 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HB )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20069 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 20070 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name    HA )
        5.00  3.20  0.00 peak 20071 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   19 and name   HB2 )
        4.23  2.43  0.00 peak 20072 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB2 )
       ( resid   18 and name    HN )
        5.00  3.20  0.00 peak 20073 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   17 and name   HB2 )
        5.00  3.20  0.00 peak 20074 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB1 )
       ( resid   18 and name    HN )
        5.00  3.20  0.00 peak 20075 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   17 and name   HB1 )
        5.00  3.20  0.00 peak 20076 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   17 and name   HB1 )
        5.00  3.20  0.00 peak 20080 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   17 and name   HB2 )
        5.00  3.20  0.00 peak 20081 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name    HA )
        5.00  3.20  0.00 peak 20084 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   22 and name    HN )
        5.00  3.20  0.00 peak 20086 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name    HA )
        5.00  3.20  0.00 peak 20087 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name   HB2 )
        5.00  3.20  0.00 peak 20090 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name   HB1 )
        5.00  3.20  0.00 peak 20091 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name   HB2 )
        5.00  3.20  0.00 peak 20092 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name   HB2 )
        5.00  3.20  0.00 peak 20093 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name   HB1 )
        5.00  3.20  0.00 peak 20094 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HN )
       ( resid   80 and name    HA )
        5.00  3.20  0.00 peak 20100 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HA )
       ( resid   23 and name   HB2 )
        5.00  3.20  0.00 peak 20101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HA )
       ( resid   23 and name   HB1 )
        5.00  3.20  0.00 peak 20102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   23 and name   HB2 )
        5.00  3.20  0.00 peak 20104 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   23 and name   HB1 )
        5.00  3.20  0.00 peak 20105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name   HB1 )
        5.00  3.20  0.00 peak 20106 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB1 )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 20107 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HB1 )
        5.00  3.20  0.00 peak 20108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 20109 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   25 and name   HB1 )
        4.87  3.07  0.00 peak 20110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   27 and name    HN )
        5.00  3.20  0.00 peak 20117 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HB1 )
        4.71  2.91  0.00 peak 20118 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HB2 )
        4.30  2.50  0.00 peak 20119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB1 )
        5.00  3.20  0.00 peak 20120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB2 )
        5.00  3.20  0.00 peak 20121 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   29 and name    HA )
        5.00  3.20  0.00 peak 20126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HA )
       ( resid   30 and name    HN )
        4.78  2.98  0.00 peak 20127 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   31 and name    HN )
        5.00  3.20  0.00 peak 20134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name    HA )
        5.00  3.20  0.00 peak 20135 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   30 and name   HB1 )
        4.17  2.37  0.00 peak 20137 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name    HA )
        5.00  3.20  0.00 peak 20140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HA )
       ( resid   32 and name    HN )
        5.00  3.20  0.00 peak 20141 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   31 and name    HA )
        4.65  2.85  0.00 peak 20142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HA )
       ( resid   33 and name    HN )
        5.00  3.20  0.00 peak 20143 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 20144 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   71 and name   HB2 )
        5.00  3.20  0.00 peak 20145 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   71 and name   HB1 )
        5.00  3.20  0.00 peak 20146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   32 and name   HA1 )
        4.23  2.43  0.00 peak 20150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name   HA1 )
       ( resid   33 and name    HN )
        5.00  3.20  0.00 peak 20151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name    HB )
        4.74  2.94  0.00 peak 20152 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   35 and name    HN )
        4.23  2.43  0.00 peak 20155 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 20157 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HB1 )
        4.01  2.21  0.00 peak 20158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   12 and name   HB2 )
        5.00  3.20  0.00 peak 20159 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   35 and name    HA )
        5.00  3.20  0.00 peak 20161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 20162 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   39 and name    HN )
        5.00  3.20  0.00 peak 20164 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 20165 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   35 and name   HB2 )
        4.49  2.69  0.00 peak 20166 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   35 and name   HB1 )
        4.49  2.69  0.00 peak 20167 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name   HB1 )
        4.62  2.82  0.00 peak 20168 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name   HB2 )
        5.00  3.20  0.00 peak 20169 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name    HA )
        4.17  2.37  0.00 peak 20173 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   35 and name   HB1 )
        5.00  3.20  0.00 peak 20174 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 20175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   35 and name   HB2 )
        4.65  2.85  0.00 peak 20178 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   35 and name   HB1 )
        4.78  2.98  0.00 peak 20179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 20181 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   36 and name    HA )
        4.58  2.78  0.00 peak 20183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   36 and name    HB )
        4.52  2.72  0.00 peak 20185 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HB )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   36 and name    HB )
        4.04  2.24  0.00 peak 20188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   36 and name    HB )
        4.39  2.59  0.00 peak 20190 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 20202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name    HA )
        4.04  2.24  0.00 peak 20203 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name   HB2 )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 20204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name   HB2 )
        5.00  3.20  0.00 peak 20205 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name    HA )
        4.84  3.04  0.00 peak 20206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   41 and name    HN )
        5.00  3.20  0.00 peak 20207 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name    HA )
        5.00  3.20  0.00 peak 20208 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   39 and name    HN )
        5.00  3.20  0.00 peak 20209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name   HB1 )
        5.00  3.20  0.00 peak 20210 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name   HB2 )
        3.91  2.11  0.00 peak 20211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name   HB1 )
        5.00  3.20  0.00 peak 20213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name   HB2 )
        5.00  3.20  0.00 peak 20214 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name   HB2 )
        5.00  3.20  0.00 peak 20215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB1 )
       ( resid   39 and name    HN )
        5.00  3.20  0.00 peak 20216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name   HB2 )
        5.00  3.20  0.00 peak 20217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name   HB2 )
        5.00  3.20  0.00 peak 20218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name   HB1 )
        5.00  3.20  0.00 peak 20219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name   HB1 )
        5.00  3.20  0.00 peak 20220 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   41 and name    HN )
        5.00  3.20  0.00 peak 20227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name    HA )
        5.00  3.20  0.00 peak 20229 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   40 and name    HN )
        5.00  3.20  0.00 peak 20230 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   39 and name    HB )
        4.62  2.82  0.00 peak 20233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB1 )
       ( resid   39 and name    HA )
        5.00  3.20  0.00 peak 20234 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name    HB )
        5.00  3.20  0.00 peak 20238 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   40 and name    HA )
        5.00  3.20  0.00 peak 20239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   39 and name    HB )
        5.00  3.20  0.00 peak 20240 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   25 and name    HN )
        4.36  2.56  0.00 peak 20253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   41 and name    HN )
        5.00  3.20  0.00 peak 20254 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name    HA )
        5.00  3.20  0.00 peak 20256 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name    HA )
        5.00  3.20  0.00 peak 20257 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   40 and name   HB2 )
        4.81  3.01  0.00 peak 20259 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name   HB1 )
        4.97  3.17  0.00 peak 20261 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name   HB2 )
        4.81  3.01  0.00 peak 20262 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   40 and name   HB2 )
        4.68  2.88  0.00 peak 20264 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB2 )
       ( resid   11 and name    HN )
        5.00  3.20  0.00 peak 20265 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HB1 )
       ( resid   42 and name    HN )
        5.00  3.20  0.00 peak 20266 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name   HB2 )
        4.65  2.85  0.00 peak 20267 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB2 )
       ( resid   43 and name    HN )
        5.00  3.20  0.00 peak 20273 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB1 )
       ( resid   43 and name    HN )
        4.90  3.10  0.00 peak 20274 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name   HB2 )
        5.00  3.20  0.00 peak 20275 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name   HB1 )
        5.00  3.20  0.00 peak 20276 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   46 and name    HN )
        5.00  3.20  0.00 peak 20277 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name    HA )
        5.00  3.20  0.00 peak 20278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   48 and name    HN )
        5.00  3.20  0.00 peak 20279 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   45 and name    HB )
        4.39  2.59  0.00 peak 20280 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   48 and name   HB2 )
        5.00  3.20  0.00 peak 20281 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name   HB2 )
        5.00  3.20  0.00 peak 20283 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB2 )
       ( resid   47 and name    HN )
        5.00  3.20  0.00 peak 20284 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name   HB1 )
        5.00  3.20  0.00 peak 20285 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   47 and name    HN )
        5.00  3.20  0.00 peak 20286 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name   HB1 )
        5.00  3.20  0.00 peak 20287 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   46 and name   HB1 )
        5.00  3.20  0.00 peak 20288 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name   HB2 )
        5.00  3.20  0.00 peak 20289 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HB2 )
        4.81  3.01  0.00 peak 20290 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HB1 )
        4.87  3.07  0.00 peak 20291 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name   HB2 )
       ( resid   73 and name    HN )
        5.00  3.20  0.00 peak 20292 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HA )
       ( resid   72 and name   HB2 )
        5.00  3.20  0.00 peak 20293 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   47 and name   HB1 )
        4.71  2.91  0.00 peak 20294 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name    HA )
        4.42  2.62  0.00 peak 20296 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 20297 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA2 )
       ( resid   51 and name    HN )
        5.00  3.20  0.00 peak 20298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   50 and name   HA2 )
        4.55  2.75  0.00 peak 20299 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA1 )
       ( resid   51 and name    HN )
        5.00  3.20  0.00 peak 20300 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   50 and name   HA1 )
        5.00  3.20  0.00 peak 20301 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name    HA )
        5.00  3.20  0.00 peak 20305 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 20306 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   54 and name    HN )
        5.00  3.20  0.00 peak 20327 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB1 )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 20338 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB2 )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 20339 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name   HB2 )
        4.84  3.04  0.00 peak 20340 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name   HB1 )
        4.97  3.17  0.00 peak 20341 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   55 and name   HA1 )
        5.00  3.20  0.00 peak 20342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA1 )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20343 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   55 and name   HA2 )
        5.00  3.20  0.00 peak 20344 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20345 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20346 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 20347 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20348 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20349 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   58 and name   HB1 )
        4.81  3.01  0.00 peak 20365 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   58 and name   HB2 )
        4.68  2.88  0.00 peak 20366 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB2 )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 20367 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB1 )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 20368 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   62 and name    HN )
        5.00  3.20  0.00 peak 20372 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name    HA )
        5.00  3.20  0.00 peak 20373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name   HB1 )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20374 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name   HB2 )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20375 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HB2 )
        5.00  3.20  0.00 peak 20376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HB1 )
        5.00  3.20  0.00 peak 20377 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   59 and name   HB1 )
        5.00  3.20  0.00 peak 20378 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   59 and name   HB2 )
        5.00  3.20  0.00 peak 20379 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 20380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name    HA )
        5.00  3.20  0.00 peak 20381 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   60 and name   HB2 )
        5.00  3.20  0.00 peak 20382 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 20397 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 20398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 20399 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 20401 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20413 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20414 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB2 )
       ( resid   65 and name    HN )
        5.00  3.20  0.00 peak 20415 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20417 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20421 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   65 and name   HA2 )
        4.84  3.04  0.00 peak 20422 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 20423 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   65 and name   HA1 )
        4.62  2.82  0.00 peak 20424 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA1 )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 20425 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA1 )
       ( resid   68 and name    HB )
        5.00  3.20  0.00 peak 20426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   68 and name    HB )
        5.00  3.20  0.00 peak 20429 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   67 and name    HN )
        5.00  3.20  0.00 peak 20430 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 20431 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name    HA )
        4.68  2.88  0.00 peak 20432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   69 and name   HB1 )
        5.00  3.20  0.00 peak 20433 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   69 and name   HB2 )
        5.00  3.20  0.00 peak 20434 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 20435 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   70 and name    HN )
        5.00  3.20  0.00 peak 20439 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name    HA )
        5.00  3.20  0.00 peak 20440 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   70 and name   HB2 )
        5.00  3.20  0.00 peak 20442 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20443 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20446 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name    HB )
        4.84  3.04  0.00 peak 20459 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 20460 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA1 )
       ( resid   68 and name    HB )
        5.00  3.20  0.00 peak 20461 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name    HB )
        5.00  3.20  0.00 peak 20462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HA )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 20480 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   28 and name    HA )
        4.84  3.04  0.00 peak 20481 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HA )
       ( resid   31 and name    HN )
        5.00  3.20  0.00 peak 20482 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name    HA )
        4.58  2.78  0.00 peak 20483 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HB1 )
       ( resid   70 and name    HN )
        5.00  3.20  0.00 peak 20484 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HB2 )
       ( resid   70 and name    HN )
        5.00  3.20  0.00 peak 20485 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name   HB2 )
        4.55  2.75  0.00 peak 20486 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name   HB1 )
        4.65  2.85  0.00 peak 20487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HA )
       ( resid   69 and name   HB1 )
        4.84  3.04  0.00 peak 20488 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   69 and name   HB1 )
        4.97  3.17  0.00 peak 20489 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 20490 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name    HA )
        4.65  2.85  0.00 peak 20491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name   HB2 )
        5.00  3.20  0.00 peak 20493 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HB1 )
        4.81  3.01  0.00 peak 20494 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   71 and name   HB1 )
        5.00  3.20  0.00 peak 20495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   71 and name   HB1 )
        5.00  3.20  0.00 peak 20496 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HB2 )
        4.65  2.85  0.00 peak 20497 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   44 and name   HB1 )
        4.46  2.66  0.00 peak 20498 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 20503 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name    HA )
        5.00  3.20  0.00 peak 20504 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB1 )
        5.00  3.20  0.00 peak 20505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB2 )
        5.00  3.20  0.00 peak 20506 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name   HB1 )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 20507 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name   HB1 )
        5.00  3.20  0.00 peak 20508 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name   HB2 )
        5.00  3.20  0.00 peak 20509 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB1 )
        5.00  3.20  0.00 peak 20510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB2 )
        5.00  3.20  0.00 peak 20511 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name    HA )
        5.00  3.20  0.00 peak 20512 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 20513 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name   HB2 )
        4.71  2.91  0.00 peak 20515 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name   HB1 )
        4.55  2.75  0.00 peak 20516 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name   HB1 )
        5.00  3.20  0.00 peak 20517 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name   HB2 )
        5.00  3.20  0.00 peak 20518 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name   HB1 )
        4.87  3.07  0.00 peak 20521 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name   HB2 )
        5.00  3.20  0.00 peak 20522 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   77 and name    HN )
        4.26  2.46  0.00 peak 20529 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name    HA )
        5.00  3.20  0.00 peak 20530 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   77 and name   HB2 )
        5.00  3.20  0.00 peak 20531 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   76 and name    HB )
        5.00  3.20  0.00 peak 20532 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HB )
       ( resid   77 and name    HN )
        5.00  3.20  0.00 peak 20535 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name    HB )
        4.90  3.10  0.00 peak 20536 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   76 and name    HB )
        5.00  3.20  0.00 peak 20538 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   77 and name   HB2 )
        4.97  3.17  0.00 peak 20546 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB2 )
       ( resid   78 and name    HN )
        5.00  3.20  0.00 peak 20547 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB1 )
       ( resid   78 and name    HN )
        5.00  3.20  0.00 peak 20548 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HA )
       ( resid   77 and name   HB1 )
        4.65  2.85  0.00 peak 20549 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HA )
       ( resid   77 and name   HB2 )
        5.00  3.20  0.00 peak 20550 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HA )
       ( resid   79 and name    HN )
        5.00  3.20  0.00 peak 20554 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   78 and name    HA )
        4.94  3.14  0.00 peak 20555 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HN )
       ( resid   81 and name   HB2 )
        4.97  3.17  0.00 peak 20564 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HN )
       ( resid   81 and name   HB1 )
        4.90  3.10  0.00 peak 20565 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20570 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20571 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name   HB2 )
        5.00  3.20  0.00 peak 20573 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   48 and name    HA )
        4.26  2.46  0.00 peak 20583 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name    HA )
        4.30  2.50  0.00 peak 20584 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HA )
       ( resid   48 and name   HB1 )
        3.50  1.70  0.00 peak 20585 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HA )
       ( resid   62 and name   HB2 )
        3.56  1.76  0.00 peak 20586 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 20588 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 20589 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 20590 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 20592 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HA )
       ( resid   67 and name    HN )
        5.00  3.20  0.00 peak 20598 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name    HA )
        5.00  3.20  0.00 peak 20599 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB1 )
       ( resid   65 and name    HN )
        5.00  3.20  0.00 peak 20601 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20608 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA1 )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20609 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   70 and name    HN )
        5.00  3.20  0.00 peak 20610 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   67 and name    HN )
        5.00  3.20  0.00 peak 20611 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name    HB )
        4.33  2.53  0.00 peak 20612 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name    HB )
        4.68  2.88  0.00 peak 20613 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20619 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20620 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name    HB )
        4.68  2.88  0.00 peak 20624 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   71 and name   HB1 )
        5.00  3.20  0.00 peak 20626 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   71 and name   HB2 )
        4.58  2.78  0.00 peak 20627 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HB1 )
        4.84  3.04  0.00 peak 20629 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HB2 )
        4.46  2.66  0.00 peak 20630 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HB1 )
        5.00  3.20  0.00 peak 20631 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HB2 )
        5.00  3.20  0.00 peak 20632 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 20633 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name    HA )
        5.00  3.20  0.00 peak 20634 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB1 )
        5.00  3.20  0.00 peak 20635 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB2 )
        5.00  3.20  0.00 peak 20636 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HA )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 20645 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HA )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 20646 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name    HA )
        4.58  2.78  0.00 peak 20674 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB1 )
       ( resid   19 and name    HA )
        5.00  3.20  0.00 peak 20700 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   24 and name    HN )
        5.00  3.20  0.00 peak 20702 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 20703 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HB2 )
        5.00  3.20  0.00 peak 20704 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HA )
       ( resid   22 and name    HN )
        5.00  3.20  0.00 peak 20706 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name   HB2 )
       ( resid   29 and name    HN )
        5.00  3.20  0.00 peak 20713 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name   HB2 )
        5.00  3.20  0.00 peak 20715 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name   HB1 )
       ( resid   32 and name    HN )
        5.00  3.20  0.00 peak 20716 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name    HA )
        5.00  3.20  0.00 peak 20735 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name    HB )
        5.00  3.20  0.00 peak 20737 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HB2 )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 20744 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    4 and name    HN )
        5.00  3.20  0.00 peak 20753 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20762 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20763 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 20764 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20765 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HA )
       ( resid   18 and name    HN )
        5.00  3.20  0.00 peak 20768 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   17 and name    HA )
        4.65  2.85  0.00 peak 20769 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name   HB1 )
       ( resid    5 and name    HN )
        5.00  3.20  0.00 peak 20770 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name   HB1 )
        5.00  3.20  0.00 peak 20771 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name    HN )
       ( resid   57 and name   HB2 )
        5.00  3.20  0.00 peak 20775 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20779 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HA )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 20780 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   58 and name    HA )
        4.49  2.69  0.00 peak 20781 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name   HB1 )
        4.90  3.10  0.00 peak 20783 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 20787 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 20790 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 20791 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 20792 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20802 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   67 and name    HA )
        5.00  3.20  0.00 peak 20803 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   69 and name    HA )
        4.52  2.72  0.00 peak 20808 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HB1 )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 20809 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HB2 )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 20810 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HB2 )
        4.87  3.07  0.00 peak 20818 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB2 )
       ( resid   25 and name    HN )
        5.00  3.20  0.00 peak 20820 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name   HB2 )
        5.00  3.20  0.00 peak 20821 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name    HA )
        4.55  2.75  0.00 peak 20823 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   18 and name    HN )
        5.00  3.20  0.00 peak 20833 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name    HA )
        5.00  3.20  0.00 peak 20834 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   17 and name    HN )
        5.00  3.20  0.00 peak 20835 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name    HB )
        5.00  3.20  0.00 peak 20836 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name   HB1 )
        5.00  3.20  0.00 peak 20840 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB1 )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 20841 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   60 and name   HB1 )
        5.00  3.20  0.00 peak 20842 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 20861 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20862 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 20863 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20864 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name    HB )
        4.71  2.91  0.00 peak 20875 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name   HB2 )
        5.00  3.20  0.00 peak 20883 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    5 and name   HB2 )
        5.00  3.20  0.00 peak 20884 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name   HB1 )
        5.00  3.20  0.00 peak 20886 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HB1 )
        4.58  2.78  0.00 peak 20887 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   24 and name   HB1 )
        4.84  3.04  0.00 peak 20888 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 20892 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   68 and name    HB )
        5.00  3.20  0.00 peak 20894 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HD1 )
       ( resid    3 and name    HN )
        5.00  3.20  0.00 peak 20935 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20942 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   54 and name   HB1 )
        3.98  2.18  0.00 peak 20943 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    3 and name   HB2 )
        4.23  2.43  0.00 peak 20944 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name   HB2 )
        3.59  1.79  0.00 peak 20946 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name   HB2 )
        3.59  1.79  0.00 peak 20947 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name    HA )
        4.94  3.14  0.00 peak 20952 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 20953 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    7 and name   HB2 )
        4.74  2.94  0.00 peak 20954 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    7 and name   HB1 )
        5.00  3.20  0.00 peak 20955 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   18 and name   HB1 )
        5.00  3.20  0.00 peak 20956 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    4 and name   HB2 )
        4.52  2.72  0.00 peak 20958 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    4 and name   HB2 )
        4.68  2.88  0.00 peak 20959 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    5 and name   HB2 )
        4.14  2.34  0.00 peak 20960 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    5 and name   HB1 )
        4.84  3.04  0.00 peak 20961 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   47 and name    HN )
        5.00  3.20  0.00 peak 20965 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid    7 and name    HN )
        5.00  3.20  0.00 peak 20966 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   44 and name   HB2 )
        3.62  1.82  0.00 peak 20972 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HN )
       ( resid    6 and name    HB )
        5.00  3.20  0.00 peak 20973 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid    6 and name    HB )
        5.00  3.20  0.00 peak 20974 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HA )
       ( resid    9 and name    HN )
        5.00  3.20  0.00 peak 20979 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name    HA )
        5.00  3.20  0.00 peak 20980 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name   HB1 )
        5.00  3.20  0.00 peak 20983 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 20985 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name    HN )
        5.00  3.20  0.00 peak 20986 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HB1 )
       ( resid   10 and name    HN )
        5.00  3.20  0.00 peak 20995 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HA )
       ( resid   13 and name   HB2 )
        4.65  2.85  0.00 peak 20999 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HA )
       ( resid   31 and name   HB1 )
        4.39  2.59  0.00 peak 21006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HA )
       ( resid   69 and name   HB1 )
        4.30  2.50  0.00 peak 21007 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HA )
       ( resid   69 and name   HB2 )
        4.30  2.50  0.00 peak 21008 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   17 and name   HB1 )
        4.81  3.01  0.00 peak 21012 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HA )
       ( resid   37 and name   HB1 )
        4.33  2.53  0.00 peak 21018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name   HB2 )
        5.00  3.20  0.00 peak 21028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   18 and name   HB2 )
        4.49  2.69  0.00 peak 21029 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   52 and name   HB1 )
        4.33  2.53  0.00 peak 21030 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   21 and name   HB1 )
        5.00  3.20  0.00 peak 21031 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   18 and name   HB1 )
        3.69  1.89  0.00 peak 21032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name   HB2 )
        5.00  3.20  0.00 peak 21033 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB2 )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 21034 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB1 )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 21035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name   HB1 )
        5.00  3.20  0.00 peak 21036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   18 and name   HB2 )
        5.00  3.20  0.00 peak 21038 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HN )
       ( resid   20 and name    HA )
        4.97  3.17  0.00 peak 21045 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HB2 )
        5.00  3.20  0.00 peak 21052 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 21053 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   28 and name   HB2 )
        4.78  2.98  0.00 peak 21078 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   28 and name   HB1 )
        4.84  3.04  0.00 peak 21079 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name   HB1 )
       ( resid   29 and name    HN )
        5.00  3.20  0.00 peak 21080 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HA )
       ( resid   28 and name   HB2 )
        4.68  2.88  0.00 peak 21081 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HA )
       ( resid   28 and name   HB1 )
        4.65  2.85  0.00 peak 21082 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   29 and name    HA )
        4.68  2.88  0.00 peak 21083 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HA )
       ( resid   30 and name    HN )
        5.00  3.20  0.00 peak 21084 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   31 and name   HB1 )
        4.30  2.50  0.00 peak 21088 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 21089 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   34 and name    HA )
        4.04  2.24  0.00 peak 21096 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HD1 )
       ( resid   34 and name    HA )
        4.36  2.56  0.00 peak 21098 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name   HB1 )
       ( resid   41 and name    HN )
        5.00  3.20  0.00 peak 21119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name   HB2 )
       ( resid   41 and name    HN )
        5.00  3.20  0.00 peak 21120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   46 and name    HN )
        5.00  3.20  0.00 peak 21121 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   43 and name    HA )
        4.52  2.72  0.00 peak 21122 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name   HB2 )
        4.55  2.75  0.00 peak 21126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name   HB1 )
        4.58  2.78  0.00 peak 21127 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 21128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name   HB2 )
        4.84  3.04  0.00 peak 21137 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name    HA )
        4.46  2.66  0.00 peak 21140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name    HA )
        4.46  2.66  0.00 peak 21141 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   21 and name    HN )
        5.00  3.20  0.00 peak 21142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name   HB2 )
        4.81  3.01  0.00 peak 21143 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name   HB1 )
        5.00  3.20  0.00 peak 21144 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name   HB2 )
        3.59  1.79  0.00 peak 21148 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 21149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 21150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 21151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 21152 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name   HB2 )
        5.00  3.20  0.00 peak 21154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 21159 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 21160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 21161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 21162 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 21168 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   73 and name    HN )
        5.00  3.20  0.00 peak 21169 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name   HB1 )
        4.78  2.98  0.00 peak 21170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 21187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name    HA )
        4.81  3.01  0.00 peak 21188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB1 )
        5.00  3.20  0.00 peak 21189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   74 and name   HB2 )
        5.00  3.20  0.00 peak 21190 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   77 and name    HA )
        4.90  3.10  0.00 peak 21196 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HA )
       ( resid   78 and name    HN )
        3.91  2.11  0.00 peak 21197 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HA )
       ( resid   77 and name   HB1 )
        4.07  2.27  0.00 peak 21198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HA )
       ( resid   77 and name   HB2 )
        4.58  2.78  0.00 peak 21199 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   77 and name   HB1 )
        4.78  2.98  0.00 peak 21200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   78 and name   HB2 )
        4.36  2.56  0.00 peak 21201 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HA )
       ( resid   78 and name   HB2 )
        4.14  2.34  0.00 peak 21202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HA )
       ( resid   81 and name   HB2 )
        4.42  2.62  0.00 peak 21213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HA )
       ( resid   81 and name   HB1 )
        4.90  3.10  0.00 peak 21214 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA1 )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 21254 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 21255 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name    HA )
        5.00  3.20  0.00 peak 21257 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 21258 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   63 and name    HN )
        5.00  3.20  0.00 peak 21259 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 21260 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name   HB1 )
        5.00  3.20  0.00 peak 21262 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name   HB2 )
        5.00  3.20  0.00 peak 21263 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name    HB )
        5.00  3.20  0.00 peak 21287 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   58 and name   HB2 )
        5.00  3.20  0.00 peak 21301 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   58 and name   HB2 )
        5.00  3.20  0.00 peak 21428 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   35 and name   HD1 )
        5.00  3.20  0.00 peak 20004 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name    HG )
        5.00  3.20  0.00 peak 20006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   11 and name   HB1 )
        5.00  3.20  0.00 peak 20020 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   11 and name   HB2 )
        5.00  3.20  0.00 peak 20023 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB2 )
       ( resid   13 and name  HD22 )
        5.00  3.20  0.00 peak 20055 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB1 )
       ( resid   13 and name  HD22 )
        5.00  3.20  0.00 peak 20057 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB1 )
       ( resid   16 and name   HB2 )
        5.00  3.20  0.00 peak 20061 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB1 )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 20062 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HE* )
        5.00  3.20  0.00 peak 20063 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB1 )
       ( resid   17 and name   HD1 )
        5.00  3.20  0.00 peak 20077 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB1 )
       ( resid   17 and name   HD1 )
        5.00  3.20  0.00 peak 20078 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB2 )
       ( resid   17 and name   HD1 )
        5.00  3.20  0.00 peak 20079 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 20111 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HB1 )
        5.00  3.20  0.00 peak 20112 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HB1 )
        5.00  3.20  0.00 peak 20113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HD1 )
        5.00  3.20  0.00 peak 20114 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 20115 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 20116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB2 )
       ( resid   26 and name   HE* )
        5.00  3.20  0.00 peak 20122 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   30 and name    HG )
        5.00  3.20  0.00 peak 20136 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   71 and name   HG1 )
        5.00  3.20  0.00 peak 20147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HA )
       ( resid   71 and name   HG2 )
        5.00  3.20  0.00 peak 20148 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HD1 )
       ( resid    9 and name    HN )
        5.00  3.20  0.00 peak 20160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB2 )
       ( resid   35 and name   HE3 )
        5.00  3.20  0.00 peak 20176 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB1 )
       ( resid   35 and name   HE3 )
        5.00  3.20  0.00 peak 20177 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   36 and name  HG1* )
        5.00  3.20  0.00 peak 20186 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HB )
       ( resid   71 and name   HE2 )
        5.00  3.20  0.00 peak 20189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HB )
       ( resid   36 and name  HG1* )
        5.00  3.20  0.00 peak 20192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 20228 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20232 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   40 and name   HD* )
        5.00  3.20  0.00 peak 20255 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name   HB1 )
       ( resid   40 and name   HD* )
        5.00  3.20  0.00 peak 20260 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name   HB2 )
       ( resid   40 and name   HD* )
        5.00  3.20  0.00 peak 20263 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB1 )
       ( resid   10 and name   HB2 )
        5.00  3.20  0.00 peak 20268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name   HB2 )
       ( resid   72 and name   HG2 )
        5.00  3.20  0.00 peak 20295 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HG1 )
       ( resid   58 and name   HD2 )
        5.00  3.20  0.00 peak 20303 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name   HD2 )
       ( resid   57 and name    HE )
        5.00  3.20  0.00 peak 20359 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   57 and name   HD2 )
        5.00  3.20  0.00 peak 20361 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HB2 )
       ( resid   22 and name   HD1 )
        5.00  3.20  0.00 peak 20362 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB2 )
       ( resid   57 and name   HD2 )
        5.00  3.20  0.00 peak 20363 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   58 and name   HG2 )
        5.00  3.20  0.00 peak 20369 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HG2 )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 20370 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HA )
       ( resid   58 and name   HG2 )
        5.00  3.20  0.00 peak 20371 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB2 )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 20416 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20436 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20437 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   70 and name   HD* )
        5.00  3.20  0.00 peak 20441 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20463 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20466 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   70 and name   HD* )
        5.00  3.20  0.00 peak 20492 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HG1 )
        5.00  3.20  0.00 peak 20499 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HG1 )
       ( resid   73 and name    HE )
        5.00  3.20  0.00 peak 20500 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HG2 )
        5.00  3.20  0.00 peak 20501 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HG2 )
       ( resid   73 and name    HE )
        5.00  3.20  0.00 peak 20502 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   76 and name  HG1* )
        5.00  3.20  0.00 peak 20533 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HB )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 20537 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HB )
       ( resid   76 and name  HG1* )
        5.00  3.20  0.00 peak 20539 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG1 )
       ( resid   77 and name   HB2 )
        5.00  3.20  0.00 peak 20551 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG2 )
       ( resid   77 and name   HB2 )
        5.00  3.20  0.00 peak 20552 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG2 )
       ( resid   77 and name   HB1 )
        5.00  3.20  0.00 peak 20553 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HA )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 20556 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name   HB1 )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 20566 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name   HB2 )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 20567 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name   HB2 )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 20568 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name   HB1 )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 20569 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HA )
       ( resid   48 and name   HG2 )
        5.00  3.20  0.00 peak 20587 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HZ2 )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 20591 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HA )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 20600 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB1 )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 20602 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB1 )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20603 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20607 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20614 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20621 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20623 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 20625 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB1 )
       ( resid   35 and name   HB2 )
        5.00  3.20  0.00 peak 20628 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   46 and name   HB2 )
        5.00  3.20  0.00 peak 20670 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name    HG )
        5.00  3.20  0.00 peak 20691 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name    HG )
        5.00  3.20  0.00 peak 20692 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   24 and name   HB1 )
        5.00  3.20  0.00 peak 20701 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name   HG1 )
       ( resid   24 and name   HB2 )
        5.00  3.20  0.00 peak 20705 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   19 and name   HG1 )
        5.00  3.20  0.00 peak 20707 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   19 and name   HG2 )
        5.00  3.20  0.00 peak 20708 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   24 and name   HB2 )
        5.00  3.20  0.00 peak 20709 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD2 )
       ( resid   31 and name   HB2 )
        5.00  3.20  0.00 peak 20717 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   31 and name   HB2 )
        5.00  3.20  0.00 peak 20718 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 20721 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name   HD2 )
       ( resid   62 and name   HE1 )
        5.00  3.20  0.00 peak 20742 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HG )
       ( resid   11 and name    HN )
        5.00  3.20  0.00 peak 20745 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   10 and name    HG )
        5.00  3.20  0.00 peak 20746 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HA )
       ( resid   10 and name    HG )
        5.00  3.20  0.00 peak 20747 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB1 )
       ( resid   10 and name    HG )
        5.00  3.20  0.00 peak 20748 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 20755 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 20756 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 20757 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 20758 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 20759 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 20760 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 20761 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name   HB2 )
       ( resid   57 and name   HD2 )
        5.00  3.20  0.00 peak 20774 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name   HG1 )
       ( resid   58 and name    HN )
        5.00  3.20  0.00 peak 20776 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name   HG2 )
       ( resid   58 and name    HN )
        5.00  3.20  0.00 peak 20777 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   57 and name   HD2 )
        5.00  3.20  0.00 peak 20778 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20793 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20798 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20799 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20800 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20804 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HA )
       ( resid   22 and name   HD2 )
        5.00  3.20  0.00 peak 20811 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name   HG2 )
       ( resid   24 and name   HB2 )
        5.00  3.20  0.00 peak 20816 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name   HG2 )
       ( resid   24 and name   HB1 )
        5.00  3.20  0.00 peak 20817 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB2 )
       ( resid   24 and name   HD2 )
        5.00  3.20  0.00 peak 20819 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   24 and name   HB1 )
        5.00  3.20  0.00 peak 20822 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HE1 )
        5.00  3.20  0.00 peak 20824 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name    HG )
        5.00  3.20  0.00 peak 20825 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HD2 )
       ( resid   73 and name    HE )
        5.00  3.20  0.00 peak 20831 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HB2 )
       ( resid   70 and name   HD* )
        5.00  3.20  0.00 peak 20832 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 20837 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 20838 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB1 )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 20843 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 20844 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 20850 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD1 )
       ( resid   16 and name    HN )
        5.00  3.20  0.00 peak 20851 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   15 and name   HD1 )
        5.00  3.20  0.00 peak 20852 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name    HA )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 20855 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD2 )
       ( resid   16 and name    HN )
        5.00  3.20  0.00 peak 20856 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   19 and name   HG1 )
        5.00  3.20  0.00 peak 20857 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 20868 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name   HG2 )
       ( resid   13 and name    HN )
        5.00  3.20  0.00 peak 20869 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   12 and name   HG2 )
        5.00  3.20  0.00 peak 20870 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name   HB1 )
       ( resid   12 and name   HG2 )
        5.00  3.20  0.00 peak 20871 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name   HB1 )
       ( resid   12 and name   HG1 )
        5.00  3.20  0.00 peak 20872 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 20873 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name   HG1 )
       ( resid   13 and name    HN )
        5.00  3.20  0.00 peak 20874 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   31 and name    HA )
        5.00  3.20  0.00 peak 20876 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 20877 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HB2 )
       ( resid   45 and name    HB )
        5.00  3.20  0.00 peak 20893 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20895 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20896 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20897 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG1* )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20898 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   34 and name   HD1 )
        5.00  3.20  0.00 peak 20920 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HG1 )
       ( resid   31 and name   HB2 )
        5.00  3.20  0.00 peak 20934 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HB2 )
       ( resid   70 and name   HE* )
        5.00  3.20  0.00 peak 20936 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HD1 )
       ( resid    2 and name   HD1 )
        5.00  3.20  0.00 peak 20937 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HD1 )
       ( resid    2 and name   HB2 )
        5.00  3.20  0.00 peak 20938 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HG2 )
       ( resid    3 and name    HN )
        5.00  3.20  0.00 peak 20941 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    3 and name   HG1 )
        5.00  3.20  0.00 peak 20945 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HG1 )
        5.00  3.20  0.00 peak 20948 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HG2 )
       ( resid   10 and name    HN )
        5.00  3.20  0.00 peak 20949 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HA )
       ( resid    9 and name   HG2 )
        5.00  3.20  0.00 peak 20950 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HA )
       ( resid    9 and name   HG2 )
        5.00  3.20  0.00 peak 20951 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD1 )
       ( resid   15 and name    HA )
        5.00  3.20  0.00 peak 20957 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid   11 and name    HG )
        5.00  3.20  0.00 peak 20969 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   44 and name   HG2 )
        5.00  3.20  0.00 peak 20971 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HA )
       ( resid    8 and name   HD1 )
        5.00  3.20  0.00 peak 20981 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG2 )
       ( resid    8 and name    HA )
        5.00  3.20  0.00 peak 20982 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HD2 )
       ( resid    8 and name   HG2 )
        5.00  3.20  0.00 peak 20989 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG2 )
       ( resid   77 and name   HB1 )
        5.00  3.20  0.00 peak 20990 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG2 )
       ( resid   77 and name   HB2 )
        5.00  3.20  0.00 peak 20991 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB1 )
       ( resid    8 and name   HD2 )
        5.00  3.20  0.00 peak 20992 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB1 )
       ( resid    8 and name   HD1 )
        5.00  3.20  0.00 peak 20993 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HA )
       ( resid    9 and name   HG2 )
        5.00  3.20  0.00 peak 20996 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HG1 )
       ( resid    9 and name   HE2 )
        5.00  3.20  0.00 peak 20997 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 20998 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HA )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 21000 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HB1 )
       ( resid   45 and name    HB )
        5.00  3.20  0.00 peak 21001 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB2 )
       ( resid   16 and name   HB2 )
        5.00  3.20  0.00 peak 21010 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB2 )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 21011 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HG2 )
       ( resid   34 and name   HB2 )
        5.00  3.20  0.00 peak 21014 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 21015 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name   HB1 )
       ( resid   12 and name   HG2 )
        5.00  3.20  0.00 peak 21016 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD2 )
       ( resid   15 and name   HG2 )
        5.00  3.20  0.00 peak 21020 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   15 and name   HD1 )
        5.00  3.20  0.00 peak 21021 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   15 and name   HD1 )
        5.00  3.20  0.00 peak 21022 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HG1 )
       ( resid   15 and name   HD1 )
        5.00  3.20  0.00 peak 21023 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HG2 )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 21024 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD1 )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 21025 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   19 and name   HG1 )
        5.00  3.20  0.00 peak 21026 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB2 )
       ( resid   24 and name    HA )
        5.00  3.20  0.00 peak 21037 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 21042 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 21043 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HG1* )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 21044 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB1 )
       ( resid   24 and name   HD2 )
        5.00  3.20  0.00 peak 21049 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 21050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 21051 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21054 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 21055 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 21056 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 21057 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   25 and name   HE1 )
        5.00  3.20  0.00 peak 21058 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21059 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   25 and name   HE1 )
        5.00  3.20  0.00 peak 21060 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21061 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 21062 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   25 and name   HD2 )
        5.00  3.20  0.00 peak 21063 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB1 )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 21064 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HD2 )
        5.00  3.20  0.00 peak 21065 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HA )
       ( resid   25 and name   HD1 )
        5.00  3.20  0.00 peak 21066 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HD1 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21067 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   25 and name   HD2 )
        5.00  3.20  0.00 peak 21068 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   25 and name   HE1 )
        5.00  3.20  0.00 peak 21069 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   25 and name   HE1 )
        5.00  3.20  0.00 peak 21070 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21071 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21073 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HD1 )
       ( resid   25 and name   HE2 )
        5.00  3.20  0.00 peak 21074 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HH2 )
       ( resid   71 and name    HA )
        5.00  3.20  0.00 peak 21090 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HG2 )
       ( resid   34 and name    HA )
        5.00  3.20  0.00 peak 21097 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   57 and name   HD1 )
        5.00  3.20  0.00 peak 21123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HA )
       ( resid   72 and name   HG2 )
        5.00  3.20  0.00 peak 21124 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid   76 and name  HG1* )
        5.00  3.20  0.00 peak 21125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   47 and name   HG1 )
        5.00  3.20  0.00 peak 21129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   47 and name   HG1 )
        5.00  3.20  0.00 peak 21130 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   47 and name   HG2 )
        5.00  3.20  0.00 peak 21131 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name   HG1 )
       ( resid   52 and name    HA )
        5.00  3.20  0.00 peak 21132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   47 and name   HG2 )
        5.00  3.20  0.00 peak 21134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   47 and name   HG1 )
        5.00  3.20  0.00 peak 21135 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   48 and name   HG1 )
        5.00  3.20  0.00 peak 21136 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB1 )
       ( resid   49 and name   HG2 )
        5.00  3.20  0.00 peak 21138 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 21163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HG2 )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 21171 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HG1 )
        5.00  3.20  0.00 peak 21172 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HZ3 )
       ( resid   71 and name   HG1 )
        5.00  3.20  0.00 peak 21173 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HH2 )
       ( resid   71 and name   HG2 )
        5.00  3.20  0.00 peak 21174 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HG1 )
       ( resid   71 and name   HE2 )
        5.00  3.20  0.00 peak 21175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HG2 )
       ( resid   71 and name   HE2 )
        5.00  3.20  0.00 peak 21176 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HB2 )
       ( resid   71 and name   HG2 )
        5.00  3.20  0.00 peak 21177 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HB2 )
       ( resid   71 and name   HG1 )
        5.00  3.20  0.00 peak 21178 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 21182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HD1 )
       ( resid   71 and name   HE1 )
        5.00  3.20  0.00 peak 21183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG2 )
       ( resid   79 and name    HN )
        5.00  3.20  0.00 peak 21203 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   78 and name   HG1 )
        5.00  3.20  0.00 peak 21204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG1 )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 21205 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG1 )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 21206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HA )
       ( resid   78 and name   HG2 )
        5.00  3.20  0.00 peak 21207 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG2 )
       ( resid   78 and name   HD1 )
        5.00  3.20  0.00 peak 21208 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HD2 )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 21209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HD2 )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 21210 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HB1 )
       ( resid   78 and name   HD1 )
        5.00  3.20  0.00 peak 21211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG2 )
       ( resid   78 and name   HD1 )
        5.00  3.20  0.00 peak 21212 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HE1 )
        5.00  3.20  0.00 peak 21261 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HA )
       ( resid   22 and name   HG1 )
        5.00  3.20  0.00 peak 21265 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HA )
       ( resid   22 and name   HG1 )
        5.00  3.20  0.00 peak 21266 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HA )
       ( resid   73 and name   HD1 )
        5.00  3.20  0.00 peak 21284 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 21335 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   25 and name   HD1 )
        5.00  3.20  0.00 peak 21336 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HD1 )
        5.00  3.20  0.00 peak 21346 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HD2 )
        5.00  3.20  0.00 peak 21347 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 21349 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   59 and name   HD2 )
        5.00  3.20  0.00 peak 21351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name    HG )
        5.00  3.20  0.00 peak 21383 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HG )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 21384 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HB )
       ( resid   38 and name    HG )
        5.00  3.20  0.00 peak 21386 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name    HG )
        5.00  3.20  0.00 peak 21387 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name   HB1 )
       ( resid   38 and name    HG )
        5.00  3.20  0.00 peak 21390 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HD1 )
       ( resid   58 and name    HE )
        5.00  3.20  0.00 peak 21405 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB2 )
       ( resid   58 and name   HD1 )
        5.00  3.20  0.00 peak 21409 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB2 )
       ( resid   58 and name   HD1 )
        5.00  3.20  0.00 peak 21426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB1 )
       ( resid   58 and name   HD1 )
        5.00  3.20  0.00 peak 21427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HZ3 )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 21431 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HH2 )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 21432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB1 )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 21457 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name  HD2# )
        4.46  2.66  0.00 peak 20007 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20009 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20017 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20021 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20022 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20025 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20026 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20029 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HB )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20030 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20031 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HG )
       ( resid   11 and name  HD1# )
        4.36  2.56  0.00 peak 20032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   11 and name  HD1# )
        4.10  2.30  0.00 peak 20033 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   11 and name  HD2# )
        4.58  2.78  0.00 peak 20034 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 20036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20037 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 20038 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   17 and name   HE3 )
        5.00  3.20  0.00 peak 20039 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   35 and name   HD1 )
        5.00  3.20  0.00 peak 20040 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20041 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name  HD2# )
        4.36  2.56  0.00 peak 20042 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB2 )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20043 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   67 and name  HG1# )
        4.58  2.78  0.00 peak 20044 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 20045 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   11 and name  HD2# )
        4.49  2.69  0.00 peak 20046 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HG )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20047 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   11 and name  HD2# )
        4.26  2.46  0.00 peak 20048 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   36 and name  HG2# )
        5.00  3.20  0.00 peak 20067 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   17 and name   HB1 )
        5.00  3.20  0.00 peak 20082 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   17 and name   HB2 )
        5.00  3.20  0.00 peak 20083 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20085 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20088 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name  HD2# )
        4.78  2.98  0.00 peak 20089 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB1 )
       ( resid    5 and name  HD2# )
        5.00  3.20  0.00 peak 20095 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB1 )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20096 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB1 )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20097 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB2 )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20098 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB2 )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20099 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HA )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20103 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB2 )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB1 )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20124 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB1 )
       ( resid   29 and name   HB# )
        5.00  3.20  0.00 peak 20125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   29 and name   HB# )
        5.00  3.20  0.00 peak 20128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   29 and name   HB# )
        4.68  2.88  0.00 peak 20129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   30 and name    HN )
        5.00  3.20  0.00 peak 20130 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HA )
       ( resid   29 and name   HB# )
        4.42  2.62  0.00 peak 20131 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB1 )
       ( resid   29 and name   HB# )
        5.00  3.20  0.00 peak 20132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB2 )
       ( resid   29 and name   HB# )
        5.00  3.20  0.00 peak 20133 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   30 and name  HD2# )
        5.00  3.20  0.00 peak 20138 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 20139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   31 and name    HA )
        5.00  3.20  0.00 peak 20149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HB )
       ( resid   33 and name  HG2# )
        4.90  3.10  0.00 peak 20153 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HB )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 20154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name  HD1# )
        5.00  3.20  0.00 peak 20170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 20171 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name    HA )
        5.00  3.20  0.00 peak 20172 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name   HB1 )
        5.00  3.20  0.00 peak 20180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   36 and name  HG2# )
        5.00  3.20  0.00 peak 20184 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HB )
       ( resid   36 and name  HG2# )
        4.23  2.43  0.00 peak 20191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20193 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20194 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   71 and name   HE2 )
        5.00  3.20  0.00 peak 20195 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   36 and name  HG2# )
        5.00  3.20  0.00 peak 20196 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   36 and name  HG2# )
        5.00  3.20  0.00 peak 20197 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HD1# )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 20198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   36 and name  HD1# )
        5.00  3.20  0.00 peak 20199 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HD1# )
       ( resid   71 and name   HE2 )
        5.00  3.20  0.00 peak 20200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   36 and name  HD1# )
        5.00  3.20  0.00 peak 20201 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 20212 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 20221 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   64 and name   HE* )
        4.97  3.17  0.00 peak 20222 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20223 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20224 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 20225 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 20226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20235 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20236 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   39 and name  HD1# )
        5.00  3.20  0.00 peak 20237 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20241 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   39 and name  HD1# )
        5.00  3.20  0.00 peak 20242 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   68 and name    HA )
        5.00  3.20  0.00 peak 20244 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HD1# )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 20246 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20247 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 20248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20249 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   68 and name    HA )
        5.00  3.20  0.00 peak 20250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20251 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20252 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20258 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name  HG2# )
       ( resid   46 and name    HN )
        5.00  3.20  0.00 peak 20269 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name  HG2# )
        5.00  3.20  0.00 peak 20270 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name  HG2# )
       ( resid   48 and name    HN )
        5.00  3.20  0.00 peak 20271 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name  HD1# )
        5.00  3.20  0.00 peak 20272 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   45 and name  HG2# )
        5.00  3.20  0.00 peak 20282 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA1 )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 20302 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA2 )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 20304 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20307 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20308 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20309 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HE* )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20310 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20311 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20312 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB1 )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20313 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB2 )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 20314 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HB )
       ( resid   51 and name  HG1# )
        4.58  2.78  0.00 peak 20315 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG1# )
       ( resid   51 and name  HG2# )
        4.26  2.46  0.00 peak 20316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20317 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20318 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HD* )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20319 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 20320 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20321 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HB )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20322 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 20323 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name  HD2# )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20324 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20325 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG1# )
       ( resid   51 and name  HG2# )
        4.81  3.01  0.00 peak 20326 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   53 and name   HB# )
        5.00  3.20  0.00 peak 20328 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 20330 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   54 and name    HN )
        5.00  3.20  0.00 peak 20331 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20332 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name   HB# )
        4.84  3.04  0.00 peak 20333 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 20334 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   53 and name   HB# )
        5.00  3.20  0.00 peak 20336 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 20350 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name   HB# )
       ( resid   58 and name    HN )
        5.00  3.20  0.00 peak 20353 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name   HB# )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 20354 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 20356 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   56 and name   HB# )
        4.65  2.85  0.00 peak 20357 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   56 and name   HB# )
        4.65  2.85  0.00 peak 20358 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name  HD1# )
       ( resid   57 and name   HD2 )
        5.00  3.20  0.00 peak 20364 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20383 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD2# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20384 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20385 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20386 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name  HD1# )
        5.00  3.20  0.00 peak 20387 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 20388 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD1# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20389 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name  HD1# )
        5.00  3.20  0.00 peak 20390 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD1# )
       ( resid   64 and name   HE* )
        4.81  3.01  0.00 peak 20391 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD1# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20392 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   60 and name  HD1# )
        5.00  3.20  0.00 peak 20393 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD1# )
       ( resid   60 and name  HD1# )
        5.00  3.20  0.00 peak 20394 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   61 and name  HD1# )
        5.00  3.20  0.00 peak 20395 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name  HD1# )
        5.00  3.20  0.00 peak 20396 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   63 and name   HB# )
        4.65  2.85  0.00 peak 20402 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 20403 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 20404 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name   HB# )
        4.84  3.04  0.00 peak 20405 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 20406 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HZ2 )
       ( resid   63 and name   HB# )
        4.20  2.40  0.00 peak 20407 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   63 and name   HB# )
        4.78  2.98  0.00 peak 20409 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 20410 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD1# )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 20411 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name  HD1# )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20418 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20419 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB2 )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20420 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA1 )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20428 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   66 and name  HG2# )
        4.78  2.98  0.00 peak 20438 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20444 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name  HG2# )
        4.01  2.21  0.00 peak 20445 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HB )
       ( resid   67 and name  HG1# )
        4.81  3.01  0.00 peak 20447 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HB )
       ( resid   67 and name  HG2# )
        4.97  3.17  0.00 peak 20448 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20449 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20450 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HE1 )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20451 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name  HG1# )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 20452 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20453 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HD* )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20454 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20455 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HB )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20456 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20457 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   68 and name  HG2# )
        4.71  2.91  0.00 peak 20464 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20465 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HG2# )
        5.00  3.20  0.00 peak 20467 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG2# )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 20468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name  HG2# )
        4.97  3.17  0.00 peak 20469 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG2# )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20470 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20471 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20472 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HD1# )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 20473 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HA )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20474 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB2 )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20475 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20477 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20478 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG1* )
       ( resid   68 and name  HD1# )
        4.81  3.01  0.00 peak 20479 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20514 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB1 )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20523 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB2 )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20524 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name  HD1# )
        5.00  3.20  0.00 peak 20525 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name  HD1# )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 20526 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HD* )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 20527 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HZ3 )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 20528 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 20534 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HB )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 20540 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG2# )
       ( resid   77 and name    HN )
        5.00  3.20  0.00 peak 20541 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG2# )
       ( resid   80 and name    HN )
        5.00  3.20  0.00 peak 20542 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HG2# )
       ( resid   67 and name    HN )
        5.00  3.20  0.00 peak 20543 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG2# )
        5.00  3.20  0.00 peak 20544 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   76 and name  HG2# )
        5.00  3.20  0.00 peak 20545 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HE1 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20557 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HN )
       ( resid   80 and name   HB# )
        4.81  3.01  0.00 peak 20558 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name   HB# )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 20559 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name   HB# )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 20560 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HZ2 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20562 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   80 and name   HB# )
        4.74  2.94  0.00 peak 20563 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20574 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20575 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD2# )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 20576 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HG )
       ( resid   10 and name  HD1# )
        4.97  3.17  0.00 peak 20577 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   61 and name  HD1# )
        4.65  2.85  0.00 peak 20578 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HA )
       ( resid   61 and name  HD1# )
        5.00  3.20  0.00 peak 20579 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name  HD1# )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20580 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD1# )
       ( resid   17 and name    HN )
        5.00  3.20  0.00 peak 20581 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   10 and name  HD1# )
        5.00  3.20  0.00 peak 20582 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   63 and name   HB# )
        4.65  2.85  0.00 peak 20593 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 20594 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 20595 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 20596 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD2# )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 20597 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name   HB1 )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20604 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name  HD1# )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20605 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   64 and name   HB1 )
        5.00  3.20  0.00 peak 20606 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   66 and name  HD1# )
        3.62  1.82  0.00 peak 20615 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 20616 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 20617 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name   HB2 )
        5.00  3.20  0.00 peak 20622 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20637 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HD* )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20638 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HE* )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20639 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20640 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20641 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB1 )
       ( resid   75 and name  HD2# )
        4.84  3.04  0.00 peak 20642 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB2 )
       ( resid   75 and name  HD2# )
        4.42  2.62  0.00 peak 20643 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name  HD1# )
       ( resid   75 and name  HD2# )
        4.10  2.30  0.00 peak 20644 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name    HN )
        5.00  3.20  0.00 peak 20647 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name  HD1# )
        4.74  2.94  0.00 peak 20648 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name   HB1 )
        5.00  3.20  0.00 peak 20649 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   14 and name  HD1# )
        5.00  3.20  0.00 peak 20650 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG1* )
       ( resid   14 and name  HD1# )
        4.81  3.01  0.00 peak 20651 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   14 and name  HD1# )
        5.00  3.20  0.00 peak 20652 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   18 and name    HN )
        5.00  3.20  0.00 peak 20653 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name  HG2# )
        5.00  3.20  0.00 peak 20654 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   18 and name   HB2 )
        5.00  3.20  0.00 peak 20655 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD1# )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20656 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD1# )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20657 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    1 and name   HB2 )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20658 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    1 and name  HD22 )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20659 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HZ3 )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20660 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HZ2 )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20661 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20662 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HA )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20663 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name  HD2# )
        5.00  3.20  0.00 peak 20665 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HA )
       ( resid   30 and name  HD2# )
        5.00  3.20  0.00 peak 20666 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB1 )
       ( resid   18 and name  HD2# )
        4.20  2.40  0.00 peak 20668 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name  HD1# )
        5.00  3.20  0.00 peak 20669 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name  HD1# )
        5.00  3.20  0.00 peak 20671 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name  HD1# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20672 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name  HD1# )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20673 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 20675 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20676 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG1* )
       ( resid   14 and name  HD1# )
        5.00  3.20  0.00 peak 20677 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   14 and name  HD1# )
        4.68  2.88  0.00 peak 20678 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name    HA )
        5.00  3.20  0.00 peak 20679 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 20680 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 20681 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 20682 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HA )
       ( resid   10 and name  HD1# )
        5.00  3.20  0.00 peak 20683 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD1# )
       ( resid   17 and name    HA )
        5.00  3.20  0.00 peak 20684 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 20685 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name  HD1# )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 20686 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD1# )
       ( resid   63 and name    HA )
        4.62  2.82  0.00 peak 20687 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name  HD1# )
        5.00  3.20  0.00 peak 20688 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name  HD2# )
        5.00  3.20  0.00 peak 20689 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HA )
       ( resid   46 and name  HD2# )
        4.14  2.34  0.00 peak 20690 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HG )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 20694 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   38 and name    HA )
        5.00  3.20  0.00 peak 20695 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 20696 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name  HG2# )
        5.00  3.20  0.00 peak 20697 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 20698 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD2# )
       ( resid   17 and name    HN )
        5.00  3.20  0.00 peak 20710 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   10 and name  HD2# )
        5.00  3.20  0.00 peak 20711 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name  HD2# )
        5.00  3.20  0.00 peak 20712 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name   HB1 )
       ( resid   29 and name   HB# )
        5.00  3.20  0.00 peak 20714 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   31 and name   HB1 )
        5.00  3.20  0.00 peak 20719 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB1 )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20720 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   68 and name    HA )
        5.00  3.20  0.00 peak 20722 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   39 and name  HD1# )
        5.00  3.20  0.00 peak 20723 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 20724 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   39 and name  HD1# )
        5.00  3.20  0.00 peak 20725 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20726 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   40 and name    HN )
        5.00  3.20  0.00 peak 20727 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20728 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20729 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   68 and name    HA )
        5.00  3.20  0.00 peak 20730 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20731 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20732 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20733 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20734 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB2 )
       ( resid   45 and name  HG2# )
        5.00  3.20  0.00 peak 20736 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name  HD2# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 20738 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 20739 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name   HG2 )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 20740 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name  HG2# )
       ( resid   49 and name   HG1 )
        5.00  3.20  0.00 peak 20741 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG1# )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 20743 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HA )
       ( resid   10 and name  HD2# )
        5.00  3.20  0.00 peak 20749 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA2 )
       ( resid   52 and name  HD2# )
        5.00  3.20  0.00 peak 20750 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB2 )
       ( resid   10 and name  HD2# )
        5.00  3.20  0.00 peak 20751 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB1 )
       ( resid   10 and name  HD2# )
        5.00  3.20  0.00 peak 20752 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20754 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20766 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20767 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD2# )
       ( resid   17 and name    HA )
        5.00  3.20  0.00 peak 20772 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD1# )
       ( resid   17 and name    HA )
        5.00  3.20  0.00 peak 20773 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HD2 )
       ( resid   75 and name  HD1# )
        5.00  3.20  0.00 peak 20782 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD2# )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 20784 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD1# )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 20785 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name  HD1# )
       ( resid   62 and name    HN )
        5.00  3.20  0.00 peak 20788 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD2# )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 20794 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20795 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 20796 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 20797 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HD1# )
       ( resid   67 and name    HN )
        5.00  3.20  0.00 peak 20801 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   67 and name    HB )
        5.00  3.20  0.00 peak 20805 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG2# )
       ( resid   69 and name   HB2 )
        5.00  3.20  0.00 peak 20806 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG2# )
       ( resid   69 and name    HA )
        5.00  3.20  0.00 peak 20807 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name   HB2 )
       ( resid   23 and name  HD1# )
        5.00  3.20  0.00 peak 20812 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name   HB2 )
       ( resid   23 and name  HD2# )
        5.00  3.20  0.00 peak 20813 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HB )
       ( resid   45 and name  HG2# )
        5.00  3.20  0.00 peak 20826 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HA )
       ( resid   45 and name  HG2# )
        4.78  2.98  0.00 peak 20827 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   30 and name   HB2 )
        5.00  3.20  0.00 peak 20828 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HA )
       ( resid   41 and name  HD2# )
        5.00  3.20  0.00 peak 20829 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD2# )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 20830 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   34 and name    HA )
        5.00  3.20  0.00 peak 20839 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HD1# )
        5.00  3.20  0.00 peak 20845 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   31 and name    HA )
        5.00  3.20  0.00 peak 20846 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 20847 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   14 and name  HG2# )
        5.00  3.20  0.00 peak 20848 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 20849 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   15 and name   HD1 )
        5.00  3.20  0.00 peak 20853 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 20854 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HD1 )
       ( resid   66 and name  HG2# )
        5.00  3.20  0.00 peak 20858 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HG2# )
       ( resid   67 and name    HA )
        5.00  3.20  0.00 peak 20859 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   66 and name  HG2# )
        5.00  3.20  0.00 peak 20860 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20865 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 20866 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 20867 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name  HD21 )
       ( resid   16 and name   HE# )
        5.00  3.20  0.00 peak 20878 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name   HE# )
        5.00  3.20  0.00 peak 20879 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name  HD22 )
       ( resid   16 and name   HE# )
        5.00  3.20  0.00 peak 20880 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HA )
       ( resid   16 and name   HE# )
        5.00  3.20  0.00 peak 20881 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HG2# )
        5.00  3.20  0.00 peak 20882 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB2 )
       ( resid    5 and name  HD2# )
        5.00  3.20  0.00 peak 20885 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD2# )
       ( resid   17 and name   HB2 )
        5.00  3.20  0.00 peak 20889 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   26 and name   HD* )
        5.00  3.20  0.00 peak 20890 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name  HD2# )
        5.00  3.20  0.00 peak 20891 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG2# )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 20899 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG1* )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20900 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20901 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    5 and name  HD2# )
        4.62  2.82  0.00 peak 20902 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name  HD2# )
        5.00  3.20  0.00 peak 20903 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name  HG2# )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20904 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name  HG2# )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20905 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name  HG2# )
       ( resid   70 and name   HB2 )
        5.00  3.20  0.00 peak 20906 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HN )
       ( resid    6 and name  HG2# )
        5.00  3.20  0.00 peak 20907 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name  HG2# )
       ( resid   70 and name   HD* )
        5.00  3.20  0.00 peak 20908 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG2 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20909 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 20910 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 20911 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HB2 )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 20912 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20913 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20914 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG1 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20915 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name  HD1# )
        5.00  3.20  0.00 peak 20917 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD1# )
       ( resid   66 and name    HB )
        5.00  3.20  0.00 peak 20918 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   34 and name   HD1 )
        5.00  3.20  0.00 peak 20919 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 20921 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   64 and name   HB2 )
        5.00  3.20  0.00 peak 20922 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20923 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB2 )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20924 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20925 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB1 )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20926 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB1 )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 20927 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 20928 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD1# )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 20929 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20930 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 20931 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 20932 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HB2 )
       ( resid   66 and name  HG2# )
        5.00  3.20  0.00 peak 20939 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HD1 )
       ( resid   66 and name  HG2# )
        5.00  3.20  0.00 peak 20940 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid   67 and name  HG2# )
        4.74  2.94  0.00 peak 20962 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    5 and name  HD2# )
        4.87  3.07  0.00 peak 20963 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB2 )
       ( resid    5 and name  HD1# )
        5.00  3.20  0.00 peak 20964 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20967 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid   11 and name  HD2# )
        5.00  3.20  0.00 peak 20968 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid    6 and name  HG2# )
        3.94  2.14  0.00 peak 20970 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HB )
       ( resid    6 and name  HG2# )
        4.55  2.75  0.00 peak 20975 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HB )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20976 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HB )
       ( resid    6 and name  HG2# )
        4.90  3.10  0.00 peak 20977 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name  HG2# )
       ( resid   76 and name  HG1* )
        4.39  2.59  0.00 peak 20978 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name    HA )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 20984 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG1 )
       ( resid   76 and name  HG2# )
        5.00  3.20  0.00 peak 20987 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HG1 )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 20988 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    2 and name   HD1 )
       ( resid   66 and name  HG2# )
        5.00  3.20  0.00 peak 20994 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB1 )
       ( resid   10 and name  HD2# )
        5.00  3.20  0.00 peak 21002 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name   HB1 )
       ( resid   10 and name  HD1# )
        5.00  3.20  0.00 peak 21003 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD2# )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 21004 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HB2 )
       ( resid   52 and name  HD2# )
        5.00  3.20  0.00 peak 21005 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG1* )
       ( resid   14 and name  HD1# )
        5.00  3.20  0.00 peak 21009 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name  HG2# )
        5.00  3.20  0.00 peak 21013 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HB )
       ( resid   14 and name  HG2# )
        4.52  2.72  0.00 peak 21017 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   37 and name   HB2 )
        5.00  3.20  0.00 peak 21019 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name  HD2# )
        5.00  3.20  0.00 peak 21039 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   27 and name    HN )
        5.00  3.20  0.00 peak 21040 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   27 and name    HA )
        4.68  2.88  0.00 peak 21041 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD1# )
       ( resid   60 and name    HA )
        5.00  3.20  0.00 peak 21046 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   76 and name    HB )
        5.00  3.20  0.00 peak 21047 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   26 and name   HB2 )
        4.74  2.94  0.00 peak 21075 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   26 and name   HB2 )
        4.74  2.94  0.00 peak 21076 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB2 )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 21077 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HA )
       ( resid   29 and name   HB# )
        4.42  2.62  0.00 peak 21085 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   30 and name   HB2 )
        4.52  2.72  0.00 peak 21086 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name   HB2 )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 21087 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HB )
       ( resid   33 and name  HG2# )
        4.62  2.82  0.00 peak 21091 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   34 and name   HD2 )
        5.00  3.20  0.00 peak 21092 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   37 and name   HG1 )
        5.00  3.20  0.00 peak 21093 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   37 and name   HG1 )
        5.00  3.20  0.00 peak 21094 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name  HG2# )
       ( resid   37 and name   HB2 )
        5.00  3.20  0.00 peak 21095 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   34 and name    HA )
        5.00  3.20  0.00 peak 21099 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   14 and name  HD1# )
        5.00  3.20  0.00 peak 21100 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   36 and name  HG1* )
        5.00  3.20  0.00 peak 21101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   36 and name  HD1# )
        4.39  2.59  0.00 peak 21102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB2 )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 21103 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB2 )
       ( resid   38 and name  HD1# )
        5.00  3.20  0.00 peak 21104 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 21105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 21106 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21107 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   40 and name    HN )
        5.00  3.20  0.00 peak 21108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21109 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB2 )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21111 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB1 )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21112 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 21114 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HB )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21115 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 21116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HG2# )
       ( resid   67 and name  HG1# )
        5.00  3.20  0.00 peak 21117 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   39 and name  HG2# )
        5.00  3.20  0.00 peak 21118 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HB )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 21139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HB2 )
       ( resid   52 and name  HD2# )
        5.00  3.20  0.00 peak 21145 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HB2 )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 21146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HG )
       ( resid   10 and name  HD2# )
        3.24  1.44  0.00 peak 21147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   56 and name   HB# )
        4.74  2.94  0.00 peak 21153 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 21155 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 21156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   56 and name    HA )
        5.00  3.20  0.00 peak 21157 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG1* )
       ( resid   76 and name  HD1# )
        4.81  3.01  0.00 peak 21158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HA )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 21164 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   63 and name    HA )
        5.00  3.20  0.00 peak 21165 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name  HG1# )
       ( resid   68 and name    HA )
        5.00  3.20  0.00 peak 21166 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   68 and name  HG2# )
        4.58  2.78  0.00 peak 21167 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HG1 )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 21179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   71 and name   HG2 )
        5.00  3.20  0.00 peak 21180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   71 and name   HG1 )
        5.00  3.20  0.00 peak 21181 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name  HD1# )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 21184 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HD1# )
       ( resid   71 and name   HE2 )
        4.81  3.01  0.00 peak 21185 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   71 and name   HE2 )
        5.00  3.20  0.00 peak 21186 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB2 )
       ( resid   75 and name  HD1# )
        4.33  2.53  0.00 peak 21191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB2 )
       ( resid   75 and name  HD1# )
        4.33  2.53  0.00 peak 21192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name  HD1# )
       ( resid   75 and name  HD2# )
        3.85  2.05  0.00 peak 21193 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HG2# )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 21194 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG2# )
       ( resid   80 and name   HB# )
        4.39  2.59  0.00 peak 21195 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD1# )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 21215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB2 )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 21216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   56 and name   HB# )
        4.71  2.91  0.00 peak 21217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name  HD2# )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 21218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   63 and name   HB# )
        4.74  2.94  0.00 peak 21219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD1# )
       ( resid   63 and name   HB# )
        5.00  3.20  0.00 peak 21220 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   56 and name   HB# )
        4.39  2.59  0.00 peak 21221 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD2# )
       ( resid   56 and name   HB# )
        4.49  2.69  0.00 peak 21222 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name   HB# )
       ( resid   60 and name  HD2# )
        5.00  3.20  0.00 peak 21223 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG1# )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 21224 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HB1 )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 21226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 21227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 21228 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 21229 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 21230 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name  HD1# )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 21231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   52 and name  HD1# )
        4.74  2.94  0.00 peak 21232 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA2 )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 21233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HB2 )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 21234 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name  HD2# )
        5.00  3.20  0.00 peak 21235 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   54 and name  HD2# )
        5.00  3.20  0.00 peak 21237 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD1# )
       ( resid   58 and name    HE )
        3.82  2.02  0.00 peak 21239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 21240 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   27 and name    HA )
        5.00  3.20  0.00 peak 21241 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB2 )
       ( resid   18 and name  HD1# )
        5.00  3.20  0.00 peak 21242 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HB )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 21243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB1 )
       ( resid   54 and name  HD1# )
        3.78  1.98  0.00 peak 21244 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB2 )
       ( resid   54 and name  HD1# )
        3.62  1.82  0.00 peak 21245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name   HB2 )
       ( resid   61 and name  HD1# )
        4.87  3.07  0.00 peak 21246 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB1 )
       ( resid   67 and name  HG2# )
        4.55  2.75  0.00 peak 21247 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD1# )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 21248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   63 and name   HB# )
        4.52  2.72  0.00 peak 21250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   63 and name   HB# )
        4.52  2.72  0.00 peak 21251 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 21252 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 21253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   38 and name  HD2# )
        4.04  2.24  0.00 peak 21268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   41 and name  HD1# )
        3.88  2.08  0.00 peak 21269 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   41 and name   HB2 )
        5.00  3.20  0.00 peak 21270 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   23 and name  HD2# )
        5.00  3.20  0.00 peak 21271 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name   HB2 )
       ( resid   23 and name  HD2# )
        5.00  3.20  0.00 peak 21276 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name   HB1 )
       ( resid   23 and name  HD2# )
        5.00  3.20  0.00 peak 21278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   53 and name   HB# )
        5.00  3.20  0.00 peak 21296 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG1# )
       ( resid   60 and name  HD1# )
        4.04  2.24  0.00 peak 21307 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD2# )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 21311 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD2# )
       ( resid   58 and name    HE )
        5.00  3.20  0.00 peak 21312 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD2# )
       ( resid   58 and name   HD1 )
        5.00  3.20  0.00 peak 21314 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB1 )
       ( resid   54 and name  HD2# )
        5.00  3.20  0.00 peak 21315 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB2 )
       ( resid   54 and name  HD2# )
        5.00  3.20  0.00 peak 21316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name   HE* )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 21319 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 21328 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 21329 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 21330 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 21331 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 21332 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD2# )
       ( resid   41 and name  HD1# )
        5.00  3.20  0.00 peak 21333 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG2# )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 21334 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD1# )
       ( resid   59 and name   HB2 )
        5.00  3.20  0.00 peak 21342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name  HD1# )
       ( resid   59 and name   HB1 )
        5.00  3.20  0.00 peak 21344 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD1# )
       ( resid   63 and name   HB# )
        4.30  2.50  0.00 peak 21363 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB1 )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 21364 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name  HD2# )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 21365 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB2 )
       ( resid   54 and name  HD2# )
        5.00  3.20  0.00 peak 21366 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name   HB2 )
       ( resid   60 and name  HD1# )
        5.00  3.20  0.00 peak 21371 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   60 and name  HD1# )
        4.90  3.10  0.00 peak 21373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB1 )
       ( resid   46 and name  HD1# )
        5.00  3.20  0.00 peak 21376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HB2 )
       ( resid   41 and name  HD1# )
        5.00  3.20  0.00 peak 21378 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HB2 )
       ( resid   41 and name  HD2# )
        4.39  2.59  0.00 peak 21380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HG )
       ( resid   38 and name  HD1# )
        5.00  3.20  0.00 peak 21388 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HG )
       ( resid   38 and name  HD2# )
        4.36  2.56  0.00 peak 21389 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD1# )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 21398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HA )
       ( resid   21 and name  HD2# )
        5.00  3.20  0.00 peak 21399 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD2# )
       ( resid   58 and name   HD1 )
        5.00  3.20  0.00 peak 21412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name  HD2# )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 21440 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD2# )
       ( resid   60 and name  HD2# )
        4.58  2.78  0.00 peak 21446 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD1# )
       ( resid   58 and name   HD2 )
        5.00  3.20  0.00 peak 21454 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   26 and name   HE* )
        4.87  3.07  0.00 peak 21458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   64 and name   HE* )
        5.00  3.20  0.00 peak 21459 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 21460 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   24 and name    HA )
        5.00  3.20  0.00 peak 21461 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   24 and name   HB1 )
        5.00  3.20  0.00 peak 21462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   26 and name   HB2 )
        5.00  3.20  0.00 peak 21463 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB2 )
       ( resid   18 and name  HD1# )
        4.68  2.88  0.00 peak 21465 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   18 and name  HD1# )
        5.00  3.20  0.00 peak 21466 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB2 )
       ( resid   18 and name  HD2# )
        5.00  3.20  0.00 peak 21468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name  HD1# )
       ( resid   31 and name    HN )
        5.00  3.20  0.00 peak 21469 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name   HB2 )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 21470 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name   HB1 )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 21471 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HZ3 )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 21475 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name  HD1# )
       ( resid   64 and name    HZ )
        5.00  3.20  0.00 peak 21476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 21480 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   17 and name   HD1 )
        5.00  3.20  0.00 peak 21481 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   64 and name    HN )
        4.26  2.46  0.00 peak    0 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name   HB2 )
        4.26  2.46  0.00 peak 10002 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   64 and name    HN )
        5.00  3.20  0.00 peak 10003 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name    HA )
        4.17  2.37  0.00 peak 10004 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HN )
       ( resid    4 and name    HN )
        4.33  2.53  0.00 peak 10006 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HN )
       ( resid    3 and name   HB1 )
        3.91  2.11  0.00 peak 10007 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    5 and name    HN )
        4.58  2.78  0.00 peak 10010 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 10011 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name    HA )
        4.87  3.07  0.00 peak 10012 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    5 and name    HN )
        4.58  2.78  0.00 peak 10013 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name    HA )
        4.52  2.72  0.00 peak 10014 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name   HB2 )
        5.00  3.20  0.00 peak 10016 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name   HB1 )
        4.58  2.78  0.00 peak 10017 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HB2 )
       ( resid   16 and name    HN )
        3.85  2.05  0.00 peak 10018 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name   HB1 )
        5.00  3.20  0.00 peak 10020 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 10022 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HN )
       ( resid    6 and name    HB )
        5.00  3.20  0.00 peak 10023 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HN )
       ( resid    6 and name    HA )
        5.00  3.20  0.00 peak 10024 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HA )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 10025 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name   HB2 )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 10026 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name    HA )
        4.42  2.62  0.00 peak 10028 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HA )
       ( resid    7 and name    HN )
        4.90  3.10  0.00 peak 10029 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HA )
       ( resid    7 and name    HN )
        4.58  2.78  0.00 peak 10030 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HA )
       ( resid    7 and name    HN )
        5.00  3.20  0.00 peak 10031 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name   HB2 )
        3.43  1.63  0.00 peak 10032 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid    7 and name   HB1 )
        3.62  1.82  0.00 peak 10033 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   72 and name    HN )
        4.55  2.75  0.00 peak 10036 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   70 and name    HN )
        4.71  2.91  0.00 peak 10037 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   12 and name    HN )
        4.36  2.56  0.00 peak 10038 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name    HA )
        4.62  2.82  0.00 peak 10039 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name    HA )
        4.36  2.56  0.00 peak 10040 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HB1 )
       ( resid   70 and name    HN )
        4.58  2.78  0.00 peak 10041 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name   HB2 )
       ( resid   70 and name    HN )
        5.00  3.20  0.00 peak 10042 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   70 and name   HB2 )
        4.71  2.91  0.00 peak 10043 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name   HB2 )
        3.69  1.89  0.00 peak 10044 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name   HB1 )
        4.78  2.98  0.00 peak 10045 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   12 and name    HN )
        4.55  2.75  0.00 peak 10047 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10048 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HA )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10049 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HA )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10050 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB2 )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10053 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name   HB1 )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10054 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   63 and name    HN )
        3.98  2.18  0.00 peak 10055 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   62 and name    HN )
        4.26  2.46  0.00 peak 10056 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name    HA )
        3.88  2.08  0.00 peak 10057 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HB2 )
        3.27  1.47  0.00 peak 10058 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   16 and name    HN )
        5.00  3.20  0.00 peak 10061 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   14 and name    HN )
        3.85  2.05  0.00 peak 10062 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name    HB )
        4.23  2.43  0.00 peak 10065 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   18 and name    HN )
        4.81  3.01  0.00 peak 10069 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   17 and name    HN )
        4.04  2.24  0.00 peak 10070 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   17 and name    HN )
        4.30  2.50  0.00 peak 10071 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   17 and name    HA )
        4.78  2.98  0.00 peak 10072 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   17 and name   HB2 )
        4.52  2.72  0.00 peak 10073 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   17 and name   HB1 )
        3.94  2.14  0.00 peak 10074 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HB2 )
       ( resid   17 and name    HN )
        4.68  2.88  0.00 peak 10076 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HB1 )
       ( resid   17 and name    HN )
        4.62  2.82  0.00 peak 10077 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   18 and name    HN )
        4.52  2.72  0.00 peak 10079 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 10080 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HA )
       ( resid   18 and name    HN )
        4.68  2.88  0.00 peak 10081 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB2 )
       ( resid   18 and name    HN )
        4.71  2.91  0.00 peak 10083 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HB2 )
       ( resid   18 and name    HN )
        4.71  2.91  0.00 peak 10084 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name   HB2 )
        4.20  2.40  0.00 peak 10085 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name   HB1 )
        3.98  2.18  0.00 peak 10086 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   19 and name    HN )
        4.81  3.01  0.00 peak 10088 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   20 and name    HN )
        5.00  3.20  0.00 peak 10089 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   19 and name    HA )
        4.26  2.46  0.00 peak 10090 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   19 and name   HB2 )
        3.69  1.89  0.00 peak 10092 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   19 and name   HB1 )
        3.72  1.92  0.00 peak 10093 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   20 and name    HN )
        4.36  2.56  0.00 peak 10096 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HN )
       ( resid   21 and name    HN )
        5.00  3.20  0.00 peak 10097 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   20 and name    HN )
        5.00  3.20  0.00 peak 10098 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HN )
       ( resid   20 and name    HA )
        4.23  2.43  0.00 peak 10099 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name   HB1 )
       ( resid   20 and name    HN )
        4.74  2.94  0.00 peak 10100 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   22 and name    HN )
        4.58  2.78  0.00 peak 10102 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HN )
       ( resid   21 and name    HN )
        5.00  3.20  0.00 peak 10103 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HA )
       ( resid   21 and name    HN )
        5.00  3.20  0.00 peak 10104 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name    HA )
        4.74  2.94  0.00 peak 10105 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name   HB1 )
        4.46  2.66  0.00 peak 10106 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name   HB2 )
        5.00  3.20  0.00 peak 10107 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   22 and name    HN )
        4.71  2.91  0.00 peak 10109 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HN )
       ( resid   22 and name    HA )
        3.88  2.08  0.00 peak 10110 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   20 and name    HA )
       ( resid   22 and name    HN )
        5.00  3.20  0.00 peak 10111 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name   HB1 )
       ( resid   22 and name    HN )
        4.94  3.14  0.00 peak 10112 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB1 )
       ( resid   22 and name    HN )
        5.00  3.20  0.00 peak 10113 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   24 and name    HN )
        4.62  2.82  0.00 peak 10114 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   23 and name    HN )
        5.00  3.20  0.00 peak 10115 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HA )
       ( resid   23 and name    HN )
        4.36  2.56  0.00 peak 10116 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   23 and name   HB1 )
        3.98  2.18  0.00 peak 10117 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name    HN )
       ( resid   24 and name    HN )
        3.91  2.11  0.00 peak 10118 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name    HA )
        5.00  3.20  0.00 peak 10119 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name    HA )
        4.84  3.04  0.00 peak 10120 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name   HB1 )
        5.00  3.20  0.00 peak 10121 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   24 and name   HB2 )
        4.87  3.07  0.00 peak 10122 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   23 and name   HB1 )
       ( resid   24 and name    HN )
        5.00  3.20  0.00 peak 10123 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   25 and name    HN )
        5.00  3.20  0.00 peak 10124 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   26 and name    HN )
        4.58  2.78  0.00 peak 10125 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name    HA )
        4.68  2.88  0.00 peak 10126 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HB2 )
        4.62  2.82  0.00 peak 10127 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HB1 )
        4.55  2.75  0.00 peak 10129 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   26 and name    HN )
        4.26  2.46  0.00 peak 10132 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   27 and name    HA )
        3.46  1.66  0.00 peak 10134 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB1 )
        4.52  2.72  0.00 peak 10135 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   26 and name    HN )
       ( resid   26 and name   HB2 )
        3.82  2.02  0.00 peak 10136 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HB2 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 10137 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   29 and name    HN )
        4.33  2.53  0.00 peak 10140 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   28 and name    HN )
        4.78  2.98  0.00 peak 10141 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   30 and name    HN )
        5.00  3.20  0.00 peak 10142 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   28 and name    HA )
        4.46  2.66  0.00 peak 10143 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HA )
       ( resid   28 and name    HN )
        4.36  2.56  0.00 peak 10144 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   28 and name   HB2 )
        4.20  2.40  0.00 peak 10145 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   29 and name    HN )
        3.98  2.18  0.00 peak 10147 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   30 and name    HN )
        4.14  2.34  0.00 peak 10148 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name    HN )
        3.94  2.14  0.00 peak 10149 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HA )
       ( resid   29 and name    HN )
        5.00  3.20  0.00 peak 10150 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   29 and name    HA )
        3.88  2.08  0.00 peak 10151 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HA )
       ( resid   29 and name    HN )
        4.68  2.88  0.00 peak 10152 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name    HA )
        5.00  3.20  0.00 peak 10153 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name   HB2 )
       ( resid   29 and name    HN )
        4.30  2.50  0.00 peak 10154 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name   HB2 )
        3.94  2.14  0.00 peak 10156 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   30 and name    HN )
        3.66  1.86  0.00 peak 10159 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name    HA )
        4.49  2.69  0.00 peak 10160 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HA )
       ( resid   30 and name    HN )
        5.00  3.20  0.00 peak 10161 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HA )
       ( resid   30 and name    HN )
        5.00  3.20  0.00 peak 10162 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name   HB1 )
        3.59  1.79  0.00 peak 10164 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   32 and name    HN )
        5.00  3.20  0.00 peak 10168 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   31 and name    HN )
        4.04  2.24  0.00 peak 10169 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   31 and name    HA )
        3.50  1.70  0.00 peak 10170 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name   HB2 )
       ( resid   31 and name    HN )
        4.62  2.82  0.00 peak 10171 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HN )
       ( resid   32 and name    HN )
        5.00  3.20  0.00 peak 10173 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   33 and name    HN )
        4.87  3.07  0.00 peak 10174 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   31 and name    HA )
       ( resid   32 and name    HN )
        3.72  1.92  0.00 peak 10175 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   32 and name   HA1 )
        3.59  1.79  0.00 peak 10176 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name    HN )
       ( resid   33 and name    HN )
        4.65  2.85  0.00 peak 10177 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name    HA )
        4.04  2.24  0.00 peak 10178 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   32 and name   HA1 )
       ( resid   33 and name    HN )
        3.37  1.57  0.00 peak 10179 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   60 and name    HN )
        4.87  3.07  0.00 peak 10181 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HA )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 10182 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name    HA )
        4.46  2.66  0.00 peak 10183 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   60 and name   HB1 )
        4.04  2.24  0.00 peak 10184 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   37 and name    HN )
        4.68  2.88  0.00 peak 10185 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   36 and name    HN )
        4.97  3.17  0.00 peak 10186 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   35 and name    HN )
        3.75  1.95  0.00 peak 10187 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   35 and name    HA )
        4.78  2.98  0.00 peak 10188 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   35 and name   HB2 )
        4.14  2.34  0.00 peak 10189 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   35 and name   HB1 )
        4.36  2.56  0.00 peak 10190 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   35 and name    HN )
        4.71  2.91  0.00 peak 10191 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name    HN )
        3.72  1.92  0.00 peak 10194 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   37 and name    HN )
        4.84  3.04  0.00 peak 10195 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name    HA )
        5.00  3.20  0.00 peak 10196 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 10197 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name    HA )
        5.00  3.20  0.00 peak 10198 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HA )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 10199 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name   HB1 )
        3.98  2.18  0.00 peak 10202 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   38 and name   HB2 )
        4.71  2.91  0.00 peak 10203 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HB )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 10206 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 10207 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   39 and name    HN )
        5.00  3.20  0.00 peak 10208 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   40 and name    HN )
        5.00  3.20  0.00 peak 10209 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HA )
       ( resid   39 and name    HN )
        5.00  3.20  0.00 peak 10210 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name    HA )
        5.00  3.20  0.00 peak 10211 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name    HB )
        5.00  3.20  0.00 peak 10212 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB1 )
       ( resid   39 and name    HN )
        4.78  2.98  0.00 peak 10213 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name   HB2 )
       ( resid   39 and name    HN )
        4.65  2.85  0.00 peak 10214 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   41 and name    HN )
        3.88  2.08  0.00 peak 10217 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   40 and name    HN )
        4.62  2.82  0.00 peak 10219 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name    HA )
        4.52  2.72  0.00 peak 10220 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   41 and name    HA )
        5.00  3.20  0.00 peak 10221 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name   HB1 )
        4.14  2.34  0.00 peak 10222 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HA )
       ( resid   40 and name    HN )
        3.78  1.98  0.00 peak 10223 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   41 and name    HN )
        3.98  2.18  0.00 peak 10225 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name    HA )
        4.04  2.24  0.00 peak 10226 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name   HB1 )
       ( resid   41 and name    HN )
        5.00  3.20  0.00 peak 10227 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name   HB2 )
        3.75  1.95  0.00 peak 10228 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   44 and name    HN )
        5.00  3.20  0.00 peak 10230 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   46 and name    HN )
        5.00  3.20  0.00 peak 10231 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HA )
       ( resid   42 and name    HN )
        3.30  1.50  0.00 peak 10232 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name   HB1 )
        5.00  3.20  0.00 peak 10233 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   42 and name   HB2 )
        4.33  2.53  0.00 peak 10234 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name   HB2 )
       ( resid   42 and name    HN )
        4.20  2.40  0.00 peak 10235 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   43 and name    HA )
        4.65  2.85  0.00 peak 10238 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB1 )
       ( resid   43 and name    HN )
        4.46  2.66  0.00 peak 10239 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB2 )
       ( resid   43 and name    HN )
        3.91  2.11  0.00 peak 10240 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   43 and name   HB1 )
        3.56  1.76  0.00 peak 10241 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   43 and name   HB2 )
        3.82  2.02  0.00 peak 10242 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name    HA )
        4.04  2.24  0.00 peak 10244 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB1 )
       ( resid   44 and name    HN )
        5.00  3.20  0.00 peak 10245 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name   HB2 )
       ( resid   44 and name    HN )
        5.00  3.20  0.00 peak 10246 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name   HB2 )
       ( resid   44 and name    HN )
        3.69  1.89  0.00 peak 10247 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name   HB2 )
        3.78  1.98  0.00 peak 10249 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name   HB1 )
        3.75  1.95  0.00 peak 10250 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   47 and name    HN )
        5.00  3.20  0.00 peak 10251 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   45 and name    HN )
        5.00  3.20  0.00 peak 10252 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name    HA )
        4.46  2.66  0.00 peak 10253 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name    HB )
        5.00  3.20  0.00 peak 10254 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name   HB2 )
       ( resid   45 and name    HN )
        4.78  2.98  0.00 peak 10255 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   46 and name    HN )
        4.33  2.53  0.00 peak 10257 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   47 and name    HN )
        4.78  2.98  0.00 peak 10258 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   46 and name    HN )
        5.00  3.20  0.00 peak 10259 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   46 and name    HN )
        4.55  2.75  0.00 peak 10260 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name    HA )
        4.46  2.66  0.00 peak 10261 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name   HB1 )
        4.17  2.37  0.00 peak 10262 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name   HB2 )
        3.85  2.05  0.00 peak 10264 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   46 and name   HB2 )
        3.85  2.05  0.00 peak 10265 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   47 and name    HN )
        4.58  2.78  0.00 peak 10266 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HA )
       ( resid   47 and name    HN )
        4.87  3.07  0.00 peak 10267 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   47 and name    HA )
        4.01  2.21  0.00 peak 10268 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name   HB2 )
       ( resid   47 and name    HN )
        4.49  2.69  0.00 peak 10272 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   50 and name    HN )
        4.30  2.50  0.00 peak 10274 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name    HA )
        4.46  2.66  0.00 peak 10275 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HA )
       ( resid   49 and name    HN )
        5.00  3.20  0.00 peak 10276 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   49 and name    HN )
        4.46  2.66  0.00 peak 10277 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name   HB2 )
       ( resid   49 and name    HN )
        3.82  2.02  0.00 peak 10278 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name   HB1 )
        4.01  2.21  0.00 peak 10279 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   51 and name    HN )
        3.98  2.18  0.00 peak 10281 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   50 and name    HN )
        4.01  2.21  0.00 peak 10282 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HA )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 10283 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HA )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 10284 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HA )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 10285 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   50 and name   HA2 )
        3.85  2.05  0.00 peak 10286 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HB2 )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 10287 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   52 and name    HN )
        5.00  3.20  0.00 peak 10291 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   53 and name    HN )
        4.46  2.66  0.00 peak 10292 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   52 and name    HN )
        3.88  2.08  0.00 peak 10293 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HA )
       ( resid   52 and name    HN )
        3.88  2.08  0.00 peak 10294 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name   HB2 )
        3.91  2.11  0.00 peak 10295 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name   HB1 )
        3.62  1.82  0.00 peak 10296 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   54 and name    HN )
        5.00  3.20  0.00 peak 10301 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name    HA )
        4.71  2.91  0.00 peak 10302 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HA )
       ( resid   53 and name    HN )
        4.74  2.94  0.00 peak 10303 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name   HB2 )
       ( resid   53 and name    HN )
        4.52  2.72  0.00 peak 10304 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 10309 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   54 and name    HN )
        5.00  3.20  0.00 peak 10310 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name   HB1 )
        4.33  2.53  0.00 peak 10312 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name   HB2 )
        3.78  1.98  0.00 peak 10313 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 10315 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10316 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   55 and name   HA1 )
        5.00  3.20  0.00 peak 10317 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   55 and name   HA2 )
        5.00  3.20  0.00 peak 10319 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name   HB1 )
       ( resid   55 and name    HN )
        4.90  3.10  0.00 peak 10320 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10322 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   58 and name    HN )
        5.00  3.20  0.00 peak 10323 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   57 and name    HN )
        4.17  2.37  0.00 peak 10324 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA1 )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10325 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10326 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name    HA )
        4.74  2.94  0.00 peak 10327 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name    HN )
       ( resid   58 and name    HN )
        4.68  2.88  0.00 peak 10330 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   57 and name    HN )
        4.71  2.91  0.00 peak 10331 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        4.97  3.17  0.00 peak 10332 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name    HN )
       ( resid   58 and name    HN )
        4.68  2.88  0.00 peak 10337 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   59 and name    HN )
        4.87  3.07  0.00 peak 10338 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   58 and name    HA )
        4.65  2.85  0.00 peak 10339 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   58 and name    HN )
        4.62  2.82  0.00 peak 10340 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   58 and name    HN )
        5.00  3.20  0.00 peak 10341 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name   HB2 )
       ( resid   58 and name    HN )
        4.39  2.59  0.00 peak 10342 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   58 and name   HB2 )
        3.53  1.73  0.00 peak 10343 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   59 and name    HN )
        4.65  2.85  0.00 peak 10344 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   60 and name    HN )
        4.58  2.78  0.00 peak 10345 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name    HA )
        4.30  2.50  0.00 peak 10346 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 10347 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB1 )
       ( resid   59 and name    HN )
        4.65  2.85  0.00 peak 10348 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HB2 )
       ( resid   59 and name    HN )
        4.33  2.53  0.00 peak 10349 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HB1 )
        3.75  1.95  0.00 peak 10350 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HB1 )
        3.75  1.95  0.00 peak 10351 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   59 and name   HB2 )
        3.98  2.18  0.00 peak 10352 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HN )
       ( resid   61 and name    HN )
        4.78  2.98  0.00 peak 10353 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   62 and name    HN )
        4.58  2.78  0.00 peak 10354 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name    HA )
        4.23  2.43  0.00 peak 10355 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 10356 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name   HB1 )
        3.53  1.73  0.00 peak 10357 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name   HB2 )
        3.98  2.18  0.00 peak 10358 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   13 and name    HA )
        4.46  2.66  0.00 peak 10360 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HA )
       ( resid   62 and name    HN )
        4.39  2.59  0.00 peak 10361 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   13 and name   HB2 )
        4.62  2.82  0.00 peak 10362 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HN )
       ( resid   13 and name   HB1 )
        4.42  2.62  0.00 peak 10363 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   64 and name    HN )
        4.68  2.88  0.00 peak 10364 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   63 and name    HN )
        4.10  2.30  0.00 peak 10365 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name    HA )
        4.58  2.78  0.00 peak 10366 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HA )
       ( resid   63 and name    HN )
        5.00  3.20  0.00 peak 10367 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   60 and name    HA )
       ( resid   63 and name    HN )
        5.00  3.20  0.00 peak 10368 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name   HB2 )
       ( resid   63 and name    HN )
        3.69  1.89  0.00 peak 10369 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   65 and name    HN )
        4.78  2.98  0.00 peak 10371 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   66 and name    HN )
        4.71  2.91  0.00 peak 10372 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   65 and name   HA1 )
        3.50  1.70  0.00 peak 10373 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   65 and name   HA2 )
        3.85  2.05  0.00 peak 10374 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HA )
       ( resid   65 and name    HN )
        4.74  2.94  0.00 peak 10375 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   68 and name    HB )
        5.00  3.20  0.00 peak 10376 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   66 and name    HN )
        4.65  2.85  0.00 peak 10380 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   67 and name    HN )
        4.58  2.78  0.00 peak 10381 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name    HA )
        3.88  2.08  0.00 peak 10382 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   66 and name    HN )
        5.00  3.20  0.00 peak 10383 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name    HB )
        4.26  2.46  0.00 peak 10384 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   68 and name    HN )
        4.90  3.10  0.00 peak 10388 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   67 and name    HN )
        4.58  2.78  0.00 peak 10389 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA1 )
       ( resid   67 and name    HN )
        4.84  3.04  0.00 peak 10390 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name    HA )
        4.97  3.17  0.00 peak 10391 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name    HB )
        4.62  2.82  0.00 peak 10392 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HB )
       ( resid   67 and name    HN )
        4.74  2.94  0.00 peak 10393 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   68 and name    HN )
        4.87  3.07  0.00 peak 10397 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 10398 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   69 and name    HA )
        5.00  3.20  0.00 peak 10399 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 10400 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name   HA2 )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 10401 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name    HA )
        4.62  2.82  0.00 peak 10402 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HB )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 10403 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name    HB )
        4.17  2.37  0.00 peak 10404 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 10411 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   70 and name    HN )
        4.81  3.01  0.00 peak 10412 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 10413 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name    HA )
        4.71  2.91  0.00 peak 10414 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HA )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 10415 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HA )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 10416 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name   HB1 )
        3.88  2.08  0.00 peak 10417 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   69 and name   HB2 )
        4.10  2.30  0.00 peak 10418 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HB )
       ( resid   69 and name    HN )
        4.81  3.01  0.00 peak 10419 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   71 and name    HN )
        4.81  3.01  0.00 peak 10421 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HN )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 10422 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name    HA )
        4.62  2.82  0.00 peak 10423 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HA )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 10424 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HB1 )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 10425 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name   HB2 )
       ( resid   71 and name    HN )
        5.00  3.20  0.00 peak 10426 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HB2 )
        4.30  2.50  0.00 peak 10427 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HB1 )
        4.42  2.62  0.00 peak 10428 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   70 and name    HN )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 10431 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   73 and name    HN )
        4.71  2.91  0.00 peak 10432 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   69 and name    HA )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 10433 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name    HA )
        4.26  2.46  0.00 peak 10434 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HA )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 10435 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HB1 )
       ( resid   72 and name    HN )
        3.98  2.18  0.00 peak 10437 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HB1 )
        5.00  3.20  0.00 peak 10438 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   73 and name    HN )
        4.62  2.82  0.00 peak 10441 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   17 and name    HN )
        5.00  3.20  0.00 peak 10442 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   74 and name    HN )
        4.20  2.40  0.00 peak 10443 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name    HA )
        4.55  2.75  0.00 peak 10444 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HA )
       ( resid   73 and name    HN )
        5.00  3.20  0.00 peak 10445 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HA )
       ( resid   16 and name    HN )
        5.00  3.20  0.00 peak 10446 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name    HN )
       ( resid   16 and name   HB2 )
        5.00  3.20  0.00 peak 10447 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HB2 )
       ( resid   16 and name    HN )
        4.14  2.34  0.00 peak 10448 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   75 and name    HN )
        4.42  2.62  0.00 peak 10450 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   74 and name    HN )
        5.00  3.20  0.00 peak 10451 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   74 and name    HN )
        4.14  2.34  0.00 peak 10452 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   74 and name   HB2 )
        4.62  2.82  0.00 peak 10453 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HN )
       ( resid   75 and name    HN )
        4.52  2.72  0.00 peak 10454 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 10455 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name    HA )
       ( resid   75 and name    HN )
        4.49  2.69  0.00 peak 10456 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name    HA )
        4.58  2.78  0.00 peak 10457 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name   HB1 )
        4.30  2.50  0.00 peak 10458 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name   HB2 )
        4.01  2.21  0.00 peak 10459 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   77 and name    HN )
        5.00  3.20  0.00 peak 10462 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   76 and name    HN )
        4.42  2.62  0.00 peak 10463 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   76 and name    HN )
        4.58  2.78  0.00 peak 10464 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name    HA )
        4.68  2.88  0.00 peak 10465 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name    HB )
        4.20  2.40  0.00 peak 10466 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB1 )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 10468 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name   HB2 )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 10469 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   78 and name    HN )
        5.00  3.20  0.00 peak 10472 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   77 and name    HA )
        3.94  2.14  0.00 peak 10473 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HA )
       ( resid   77 and name    HN )
        3.62  1.82  0.00 peak 10474 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   77 and name   HB1 )
        3.85  2.05  0.00 peak 10475 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   77 and name   HB2 )
        4.36  2.56  0.00 peak 10476 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   78 and name    HN )
        5.00  3.20  0.00 peak 10479 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   79 and name    HN )
        4.81  3.01  0.00 peak 10480 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB1 )
       ( resid   78 and name    HN )
        4.87  3.07  0.00 peak 10481 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB2 )
       ( resid   78 and name    HN )
        5.00  3.20  0.00 peak 10482 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   78 and name   HB1 )
        3.56  1.76  0.00 peak 10483 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   79 and name    HN )
        4.71  2.91  0.00 peak 10485 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   80 and name    HN )
        4.49  2.69  0.00 peak 10486 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   79 and name    HA )
        4.49  2.69  0.00 peak 10487 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   79 and name   HB1 )
        3.69  1.89  0.00 peak 10488 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB1 )
       ( resid   79 and name    HN )
        5.00  3.20  0.00 peak 10489 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB2 )
       ( resid   79 and name    HN )
        5.00  3.20  0.00 peak 10490 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HB2 )
       ( resid   79 and name    HN )
        4.36  2.56  0.00 peak 10491 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   80 and name    HN )
        4.68  2.88  0.00 peak 10494 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   51 and name    HN )
        3.82  2.02  0.00 peak 10495 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HA )
       ( resid   80 and name    HN )
        4.71  2.91  0.00 peak 10496 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 10501 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HN )
       ( resid   81 and name    HN )
        4.23  2.43  0.00 peak 10502 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HA )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 10505 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HN )
       ( resid   81 and name   HB2 )
        4.20  2.40  0.00 peak 10506 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HN )
       ( resid   81 and name   HB1 )
        3.98  2.18  0.00 peak 10507 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name    HN )
       ( resid   24 and name    HN )
        5.00  3.20  0.00 peak 10517 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   27 and name    HN )
       ( resid   28 and name    HN )
        4.68  2.88  0.00 peak 10519 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HA )
       ( resid   27 and name    HN )
        5.00  3.20  0.00 peak 10520 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   30 and name    HN )
        5.00  3.20  0.00 peak 10521 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HN )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 10522 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   38 and name    HN )
        5.00  3.20  0.00 peak 10523 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name    HN )
       ( resid   37 and name    HN )
        4.39  2.59  0.00 peak 10524 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name    HA )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 10525 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name    HA )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 10526 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB2 )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 10527 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HB1 )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 10528 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   34 and name   HB2 )
       ( resid   36 and name    HN )
        5.00  3.20  0.00 peak 10529 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   42 and name    HN )
       ( resid   43 and name    HN )
        5.00  3.20  0.00 peak 10531 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   48 and name    HN )
        5.00  3.20  0.00 peak 10532 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   48 and name    HN )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 10533 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   52 and name    HN )
        5.00  3.20  0.00 peak 10535 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   20 and name    HN )
        5.00  3.20  0.00 peak 10536 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 10537 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name    HN )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 10541 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB1 )
       ( resid   25 and name    HN )
        5.00  3.20  0.00 peak 10542 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 10544 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HN )
       ( resid    4 and name    HN )
        4.20  2.40  0.00 peak 10545 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    4 and name    HN )
       ( resid    6 and name    HN )
        5.00  3.20  0.00 peak 10546 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid   10 and name    HN )
        5.00  3.20  0.00 peak 10548 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name   HB1 )
       ( resid    9 and name    HN )
        5.00  3.20  0.00 peak 10549 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid   10 and name    HA )
        5.00  3.20  0.00 peak 10550 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HA )
       ( resid    9 and name    HN )
        5.00  3.20  0.00 peak 10551 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10552 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid   10 and name    HN )
        3.85  2.05  0.00 peak 10553 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   11 and name    HA )
        5.00  3.20  0.00 peak 10554 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10555 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name    HN )
       ( resid   11 and name    HN )
        3.88  2.08  0.00 peak 10556 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name   HB2 )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 10557 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   74 and name   HB1 )
       ( resid   75 and name    HN )
        5.00  3.20  0.00 peak 10558 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 10559 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB2 )
       ( resid   80 and name    HN )
        5.00  3.20  0.00 peak 10560 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name   HB1 )
       ( resid   80 and name    HN )
        5.00  3.20  0.00 peak 10561 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   80 and name    HN )
        5.00  3.20  0.00 peak 10562 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name    HN )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 10564 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name   HA2 )
       ( resid   51 and name    HN )
        4.81  3.01  0.00 peak 10565 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name    HN )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 10566 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   77 and name    HN )
        5.00  3.20  0.00 peak 10568 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   50 and name   HA2 )
        5.00  3.20  0.00 peak 10570 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   50 and name   HA1 )
        5.00  3.20  0.00 peak 10571 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name    HN )
       ( resid   49 and name    HN )
        5.00  3.20  0.00 peak 10572 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   58 and name    HN )
        5.00  3.20  0.00 peak 10573 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   53 and name    HN )
        4.17  2.37  0.00 peak 10574 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HA )
       ( resid   54 and name    HN )
        3.69  1.89  0.00 peak 10578 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10583 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA1 )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10584 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10585 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   57 and name    HN )
       ( resid   59 and name    HN )
        5.00  3.20  0.00 peak 10586 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HA )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 10588 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   55 and name   HA2 )
       ( resid   57 and name    HN )
        4.52  2.72  0.00 peak 10589 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HA )
       ( resid   57 and name    HN )
        4.81  3.01  0.00 peak 10590 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name    HN )
       ( resid   60 and name    HN )
        5.00  3.20  0.00 peak 10591 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   59 and name    HN )
       ( resid   61 and name    HN )
        5.00  3.20  0.00 peak 10592 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HB2 )
       ( resid   25 and name    HN )
        5.00  3.20  0.00 peak 10623 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid    9 and name    HA )
        3.85  2.05  0.00 peak 10636 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 10649 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HA )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 10650 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name    HB )
        5.00  3.20  0.00 peak 10651 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   64 and name    HN )
       ( resid   64 and name   HD* )
        5.00  3.20  0.00 peak 10001 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name    HN )
       ( resid    3 and name   HG1 )
        5.00  3.20  0.00 peak 10008 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HD2 )
       ( resid   16 and name    HN )
        5.00  3.20  0.00 peak 10015 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   15 and name   HG2 )
       ( resid   16 and name    HN )
        5.00  3.20  0.00 peak 10019 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   12 and name    HN )
       ( resid   12 and name   HG2 )
        5.00  3.20  0.00 peak 10051 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HG )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10052 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HD2 )
        5.00  3.20  0.00 peak 10059 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   62 and name    HN )
       ( resid   62 and name   HG1 )
        5.00  3.20  0.00 peak 10060 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   15 and name   HD1 )
        5.00  3.20  0.00 peak 10063 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   15 and name   HD2 )
        5.00  3.20  0.00 peak 10064 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 10066 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HG1* )
        5.00  3.20  0.00 peak 10067 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   16 and name   HG1 )
       ( resid   17 and name    HN )
        5.00  3.20  0.00 peak 10075 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name    HG )
        5.00  3.20  0.00 peak 10087 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   19 and name   HG1 )
        5.00  3.20  0.00 peak 10094 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name    HN )
       ( resid   19 and name   HG2 )
        5.00  3.20  0.00 peak 10095 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   19 and name   HG1 )
       ( resid   20 and name    HN )
        5.00  3.20  0.00 peak 10101 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HD1 )
        5.00  3.20  0.00 peak 10128 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HG2 )
        5.00  3.20  0.00 peak 10130 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name    HN )
       ( resid   25 and name   HG1 )
        5.00  3.20  0.00 peak 10131 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HD2 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 10133 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG2 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 10138 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   25 and name   HG1 )
       ( resid   26 and name    HN )
        5.00  3.20  0.00 peak 10139 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name    HG )
        5.00  3.20  0.00 peak 10163 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG1* )
       ( resid   35 and name    HN )
        5.00  3.20  0.00 peak 10192 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name   HG1 )
        5.00  3.20  0.00 peak 10200 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   37 and name    HN )
       ( resid   37 and name   HG1 )
        5.00  3.20  0.00 peak 10201 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   40 and name   HD* )
        5.00  3.20  0.00 peak 10218 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   44 and name    HN )
       ( resid   44 and name   HG2 )
        5.00  3.20  0.00 peak 10248 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   47 and name    HN )
       ( resid   47 and name   HG1 )
        4.84  3.04  0.00 peak 10271 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name    HN )
       ( resid   49 and name   HG1 )
        5.00  3.20  0.00 peak 10280 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   49 and name   HG2 )
       ( resid   50 and name    HN )
        5.00  3.20  0.00 peak 10288 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HG1 )
        5.00  3.20  0.00 peak 10333 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HG1 )
        5.00  3.20  0.00 peak 10334 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HG2 )
        5.00  3.20  0.00 peak 10335 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 10385 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HG1* )
        5.00  3.20  0.00 peak 10386 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HG1* )
        5.00  3.20  0.00 peak 10405 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HD1 )
        5.00  3.20  0.00 peak 10429 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name    HN )
       ( resid   71 and name   HG2 )
        5.00  3.20  0.00 peak 10430 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   72 and name    HN )
       ( resid   72 and name   HG2 )
        5.00  3.20  0.00 peak 10436 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   71 and name   HG2 )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 10439 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HN )
       ( resid   73 and name   HG1 )
        5.00  3.20  0.00 peak 10449 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name  HG1* )
        5.00  3.20  0.00 peak 10467 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name    HN )
       ( resid   78 and name   HG1 )
        5.00  3.20  0.00 peak 10484 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG2 )
       ( resid   79 and name    HN )
        5.00  3.20  0.00 peak 10492 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HN )
       ( resid   81 and name   HE* )
        5.00  3.20  0.00 peak 10503 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   81 and name    HN )
       ( resid   81 and name   HD* )
        5.00  3.20  0.00 peak 10504 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HG2 )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 10508 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HZ2 )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 10510 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HD1 )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 10511 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   17 and name   HD1 )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 10514 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HZ2 )
       ( resid   35 and name   HE1 )
        5.00  3.20  0.00 peak 10515 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   35 and name   HE1 )
       ( resid   80 and name    HA )
        5.00  3.20  0.00 peak 10516 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HG1* )
       ( resid   35 and name    HN )
        5.00  3.20  0.00 peak 10518 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    3 and name   HG1 )
       ( resid    4 and name    HN )
        5.00  3.20  0.00 peak 10543 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   24 and name   HD2 )
       ( resid   25 and name    HN )
        5.00  3.20  0.00 peak 10593 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HG2 )
       ( resid   58 and name    HE )
        5.00  3.20  0.00 peak 10594 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HD2 )
       ( resid   22 and name    HE )
        5.00  3.20  0.00 peak 10595 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   22 and name   HG2 )
       ( resid   22 and name    HE )
        5.00  3.20  0.00 peak 10596 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HD2 )
       ( resid   73 and name    HE )
        5.00  3.20  0.00 peak 10597 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name   HG1 )
       ( resid   73 and name    HE )
        5.00  3.20  0.00 peak 10598 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name    HA )
       ( resid   13 and name  HD21 )
        5.00  3.20  0.00 peak 10599 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB2 )
       ( resid   13 and name  HD21 )
        5.00  3.20  0.00 peak 10600 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name   HB1 )
       ( resid   13 and name  HD21 )
        5.00  3.20  0.00 peak 10601 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name  HD21 )
       ( resid   16 and name   HB2 )
        5.00  3.20  0.00 peak 10602 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   13 and name  HD21 )
       ( resid   16 and name   HB1 )
        5.00  3.20  0.00 peak 10603 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name   HB1 )
       ( resid   13 and name  HD21 )
        5.00  3.20  0.00 peak 10604 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   78 and name   HD2 )
       ( resid   78 and name    HE )
        5.00  3.20  0.00 peak 10609 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HD1 )
       ( resid   58 and name    HE )
        5.00  3.20  0.00 peak 10612 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   58 and name   HG2 )
       ( resid   58 and name    HE )
        5.00  3.20  0.00 peak 10615 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name   HB1 )
       ( resid   23 and name    HN )
        5.00  3.20  0.00 peak 10629 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    8 and name   HD2 )
       ( resid    9 and name    HN )
        5.00  3.20  0.00 peak 10637 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    9 and name    HN )
       ( resid    9 and name   HG1 )
        5.00  3.20  0.00 peak 10640 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name  HG1* )
        5.00  3.20  0.00 peak 10652 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   64 and name    HN )
        4.17  2.37  0.00 peak 10005 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name    HN )
       ( resid    5 and name  HD2# )
        5.00  3.20  0.00 peak 10021 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name    HN )
       ( resid    6 and name  HG2# )
        5.00  3.20  0.00 peak 10027 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    6 and name  HG2# )
       ( resid    7 and name    HN )
        5.00  3.20  0.00 peak 10035 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name    HN )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 10046 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name    HN )
       ( resid   14 and name  HG2# )
        5.00  3.20  0.00 peak 10068 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   10 and name  HD1# )
       ( resid   17 and name    HN )
        5.00  3.20  0.00 peak 10078 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name    HN )
       ( resid   18 and name  HD1# )
        4.94  3.14  0.00 peak 10082 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   18 and name  HD1# )
       ( resid   19 and name    HN )
        5.00  3.20  0.00 peak 10091 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   21 and name    HN )
       ( resid   21 and name  HD1# )
        5.00  3.20  0.00 peak 10108 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   28 and name    HN )
       ( resid   29 and name   HB# )
        5.00  3.20  0.00 peak 10146 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name    HN )
       ( resid   29 and name   HB# )
        3.62  1.82  0.00 peak 10155 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name  HD1# )
        5.00  3.20  0.00 peak 10157 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   38 and name    HN )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 10158 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   29 and name   HB# )
       ( resid   30 and name    HN )
        4.65  2.85  0.00 peak 10165 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name  HD2# )
        5.00  3.20  0.00 peak 10166 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   30 and name    HN )
       ( resid   30 and name  HD1# )
        5.00  3.20  0.00 peak 10167 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   33 and name  HG2# )
        5.00  3.20  0.00 peak 10180 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   14 and name  HD1# )
       ( resid   35 and name    HN )
        5.00  3.20  0.00 peak 10193 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HG2# )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 10204 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   36 and name  HD1# )
       ( resid   37 and name    HN )
        5.00  3.20  0.00 peak 10205 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name  HG2# )
        4.71  2.91  0.00 peak 10215 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   39 and name    HN )
       ( resid   39 and name  HD1# )
        5.00  3.20  0.00 peak 10216 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   40 and name    HN )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 10224 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name    HN )
       ( resid   41 and name  HD1# )
        5.00  3.20  0.00 peak 10229 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name  HD1# )
       ( resid   42 and name    HN )
        4.71  2.91  0.00 peak 10236 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   41 and name  HD2# )
       ( resid   42 and name    HN )
        4.62  2.82  0.00 peak 10237 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   43 and name    HN )
       ( resid   61 and name  HD2# )
        5.00  3.20  0.00 peak 10243 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name    HN )
       ( resid   45 and name  HG2# )
        5.00  3.20  0.00 peak 10256 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name  HG2# )
       ( resid   46 and name    HN )
        5.00  3.20  0.00 peak 10263 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   46 and name  HD1# )
       ( resid   47 and name    HN )
        5.00  3.20  0.00 peak 10273 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 10289 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   50 and name    HN )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 10290 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name  HD2# )
        5.00  3.20  0.00 peak 10297 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name    HN )
       ( resid   52 and name  HD1# )
        5.00  3.20  0.00 peak 10298 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG1# )
       ( resid   52 and name    HN )
        5.00  3.20  0.00 peak 10299 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   52 and name    HN )
        5.00  3.20  0.00 peak 10300 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   53 and name   HB# )
        3.56  1.76  0.00 peak 10305 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name    HN )
       ( resid   56 and name   HB# )
        5.00  3.20  0.00 peak 10306 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   52 and name  HD1# )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 10307 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   53 and name    HN )
        5.00  3.20  0.00 peak 10308 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name    HN )
       ( resid   54 and name  HD1# )
        5.00  3.20  0.00 peak 10314 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 10321 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   53 and name   HB# )
       ( resid   56 and name    HN )
        4.33  2.53  0.00 peak 10328 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name    HN )
       ( resid   56 and name   HB# )
        4.10  2.30  0.00 peak 10329 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   56 and name   HB# )
       ( resid   57 and name    HN )
        5.00  3.20  0.00 peak 10336 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   61 and name    HN )
       ( resid   61 and name  HD1# )
        5.00  3.20  0.00 peak 10359 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name    HN )
       ( resid   63 and name   HB# )
        3.75  1.95  0.00 peak 10370 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   63 and name   HB# )
       ( resid   65 and name    HN )
        5.00  3.20  0.00 peak 10377 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   66 and name  HD1# )
        5.00  3.20  0.00 peak 10378 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   65 and name    HN )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 10379 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name    HN )
       ( resid   66 and name  HD1# )
        4.23  2.43  0.00 peak 10387 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name  HG1# )
        4.30  2.50  0.00 peak 10394 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name    HN )
       ( resid   67 and name  HG2# )
        5.00  3.20  0.00 peak 10395 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HD1# )
       ( resid   67 and name    HN )
        5.00  3.20  0.00 peak 10396 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name  HG1# )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 10406 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HG2# )
        5.00  3.20  0.00 peak 10407 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   66 and name  HG2# )
       ( resid   68 and name    HN )
        5.00  3.20  0.00 peak 10408 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HD1# )
        4.97  3.17  0.00 peak 10409 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name    HN )
       ( resid   68 and name  HD1# )
        5.00  3.20  0.00 peak 10410 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   67 and name  HG2# )
       ( resid   69 and name    HN )
        5.00  3.20  0.00 peak 10420 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   68 and name  HG2# )
       ( resid   72 and name    HN )
        5.00  3.20  0.00 peak 10440 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name  HD1# )
        5.00  3.20  0.00 peak 10460 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name    HN )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 10461 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 10470 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   75 and name  HD1# )
       ( resid   76 and name    HN )
        5.00  3.20  0.00 peak 10471 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HD1# )
       ( resid   77 and name    HN )
        5.00  3.20  0.00 peak 10477 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG2# )
       ( resid   77 and name    HN )
        5.00  3.20  0.00 peak 10478 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   79 and name    HN )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 10493 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name    HN )
       ( resid   80 and name   HB# )
        4.30  2.50  0.00 peak 10497 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG2# )
       ( resid   80 and name    HN )
        5.00  3.20  0.00 peak 10498 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name  HG1# )
        5.00  3.20  0.00 peak 10499 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name    HN )
       ( resid   51 and name  HG2# )
        5.00  3.20  0.00 peak 10500 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   80 and name   HB# )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 10509 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    5 and name  HD2# )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 10512 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   17 and name   HE1 )
        5.00  3.20  0.00 peak 10513 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   45 and name  HG2# )
       ( resid   48 and name    HN )
        5.00  3.20  0.00 peak 10534 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD1# )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10538 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   11 and name  HD2# )
       ( resid   12 and name    HN )
        5.00  3.20  0.00 peak 10539 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    7 and name    HN )
       ( resid   11 and name  HD1# )
        5.00  3.20  0.00 peak 10547 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name  HG2# )
       ( resid   81 and name    HN )
        5.00  3.20  0.00 peak 10563 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   33 and name    HN )
       ( resid   38 and name  HD2# )
        5.00  3.20  0.00 peak 10567 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   77 and name    HN )
       ( resid   80 and name   HB# )
        5.00  3.20  0.00 peak 10569 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   73 and name    HE )
       ( resid   75 and name  HD2# )
        5.00  3.20  0.00 peak 10607 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD1# )
       ( resid   58 and name    HE )
        5.00  3.20  0.00 peak 10613 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   54 and name  HD1# )
       ( resid   55 and name    HN )
        5.00  3.20  0.00 peak 10620 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   51 and name  HG2# )
       ( resid   56 and name    HN )
        5.00  3.20  0.00 peak 10646 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name  HD1# )
        5.00  3.20  0.00 peak 10653 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid   76 and name    HN )
       ( resid   76 and name  HG2# )
        5.00  3.20  0.00 peak 10654 volume 0.00 ppm1 0.000 ppm2 0.000

assign ( resid    1 and name O  ) ( resid    5 and name HN )  1.80  0.00  0.30
assign ( resid    1 and name O  ) ( resid    5 and name N  )  2.70  0.00  0.30

assign ( resid    2 and name O  ) ( resid    6 and name HN )  1.80  0.00  0.30
assign ( resid    2 and name O  ) ( resid    6 and name N  )  2.70  0.00  0.30

assign ( resid    7 and name O  ) ( resid   11 and name HN )  1.80  0.00  0.30
assign ( resid    7 and name O  ) ( resid   11 and name N  )  2.70  0.00  0.30

assign ( resid    8 and name O  ) ( resid   12 and name HN )  1.80  0.00  0.30
assign ( resid    8 and name O  ) ( resid   12 and name N  )  2.70  0.00  0.30

assign ( resid   13 and name O  ) ( resid   17 and name HN )  1.80  0.00  0.30
assign ( resid   13 and name O  ) ( resid   17 and name N  )  2.70  0.00  0.30

assign ( resid   14 and name O  ) ( resid   18 and name HN )  1.80  0.00  0.30
assign ( resid   14 and name O  ) ( resid   18 and name N  )  2.70  0.00  0.30

assign ( resid   15 and name O  ) ( resid   19 and name HN )  1.80  0.00  0.30
assign ( resid   15 and name O  ) ( resid   19 and name N  )  2.70  0.00  0.30

assign ( resid   16 and name O  ) ( resid   20 and name HN )  1.80  0.00  0.30
assign ( resid   16 and name O  ) ( resid   20 and name N  )  2.70  0.00  0.30

assign ( resid   18 and name O  ) ( resid   22 and name HN )  1.80  0.00  0.30
assign ( resid   18 and name O  ) ( resid   22 and name N  )  2.70  0.00  0.30

assign ( resid   23 and name O  ) ( resid   26 and name HN )  1.80  0.00  0.30
assign ( resid   23 and name O  ) ( resid   26 and name N  )  2.70  0.00  0.30

assign ( resid   24 and name O  ) ( resid   27 and name HN )  1.80  0.00  0.30
assign ( resid   24 and name O  ) ( resid   27 and name N  )  2.70  0.00  0.30

assign ( resid   26 and name O  ) ( resid   29 and name HN )  1.80  0.00  0.30
assign ( resid   26 and name O  ) ( resid   29 and name N  )  2.70  0.00  0.30

assign ( resid   34 and name O  ) ( resid   38 and name HN )  1.80  0.00  0.30
assign ( resid   34 and name O  ) ( resid   38 and name N  )  2.70  0.00  0.30

assign ( resid   35 and name O  ) ( resid   39 and name HN )  1.80  0.00  0.30
assign ( resid   35 and name O  ) ( resid   39 and name N  )  2.70  0.00  0.30

assign ( resid   37 and name O  ) ( resid   40 and name HN )  1.80  0.00  0.30
assign ( resid   37 and name O  ) ( resid   40 and name N  )  2.70  0.00  0.30

assign ( resid   38 and name O  ) ( resid   41 and name HN )  1.80  0.00  0.30
assign ( resid   38 and name O  ) ( resid   41 and name N  )  2.70  0.00  0.30

assign ( resid   42 and name O  ) ( resid   46 and name HN )  1.80  0.00  0.30
assign ( resid   42 and name O  ) ( resid   46 and name N  )  2.70  0.00  0.30

assign ( resid   43 and name O  ) ( resid   47 and name HN )  1.80  0.00  0.30
assign ( resid   43 and name O  ) ( resid   47 and name N  )  2.70  0.00  0.30

assign ( resid   44 and name O  ) ( resid   48 and name HN )  1.80  0.00  0.30
assign ( resid   44 and name O  ) ( resid   48 and name N  )  2.70  0.00  0.30

assign ( resid   45 and name O  ) ( resid   49 and name HN )  1.80  0.00  0.30
assign ( resid   45 and name O  ) ( resid   49 and name N  )  2.70  0.00  0.30

assign ( resid   46 and name O  ) ( resid   50 and name HN )  1.80  0.00  0.30
assign ( resid   46 and name O  ) ( resid   50 and name N  )  2.70  0.00  0.30

assign ( resid   53 and name O  ) ( resid   57 and name HN )  1.80  0.00  0.30
assign ( resid   53 and name O  ) ( resid   57 and name N  )  2.70  0.00  0.30

assign ( resid   54 and name O  ) ( resid   58 and name HN )  1.80  0.00  0.30
assign ( resid   54 and name O  ) ( resid   58 and name N  )  2.70  0.00  0.30

assign ( resid   55 and name O  ) ( resid   59 and name HN )  1.80  0.00  0.30
assign ( resid   55 and name O  ) ( resid   59 and name N  )  2.70  0.00  0.30

assign ( resid   56 and name O  ) ( resid   60 and name HN )  1.80  0.00  0.30
assign ( resid   56 and name O  ) ( resid   60 and name N  )  2.70  0.00  0.30

assign ( resid   57 and name O  ) ( resid   61 and name HN )  1.80  0.00  0.30
assign ( resid   57 and name O  ) ( resid   61 and name N  )  2.70  0.00  0.30

assign ( resid   58 and name O  ) ( resid   62 and name HN )  1.80  0.00  0.30
assign ( resid   58 and name O  ) ( resid   62 and name N  )  2.70  0.00  0.30

assign ( resid   59 and name O  ) ( resid   63 and name HN )  1.80  0.00  0.30
assign ( resid   59 and name O  ) ( resid   63 and name N  )  2.70  0.00  0.30

assign ( resid   60 and name O  ) ( resid   64 and name HN )  1.80  0.00  0.30
assign ( resid   60 and name O  ) ( resid   64 and name N  )  2.70  0.00  0.30

assign ( resid   61 and name O  ) ( resid   65 and name HN )  1.80  0.00  0.30
assign ( resid   61 and name O  ) ( resid   65 and name N  )  2.70  0.00  0.30

assign ( resid   62 and name O  ) ( resid   66 and name HN )  1.80  0.00  0.30
assign ( resid   62 and name O  ) ( resid   66 and name N  )  2.70  0.00  0.30

assign ( resid   63 and name O  ) ( resid   67 and name HN )  1.80  0.00  0.30
assign ( resid   63 and name O  ) ( resid   67 and name N  )  2.70  0.00  0.30

assign ( resid   64 and name O  ) ( resid   68 and name HN )  1.80  0.00  0.30
assign ( resid   64 and name O  ) ( resid   68 and name N  )  2.70  0.00  0.30

assign ( resid   66 and name O  ) ( resid   70 and name HN )  1.80  0.00  0.30
assign ( resid   66 and name O  ) ( resid   70 and name N  )  2.70  0.00  0.30

assign ( resid   67 and name O  ) ( resid   71 and name HN )  1.80  0.00  0.30
assign ( resid   67 and name O  ) ( resid   71 and name N  )  2.70  0.00  0.30

assign ( resid   68 and name O  ) ( resid   72 and name HN )  1.80  0.00  0.30
assign ( resid   68 and name O  ) ( resid   72 and name N  )  2.70  0.00  0.30

assign ( resid   69 and name O  ) ( resid   73 and name HN )  1.80  0.00  0.30
assign ( resid   69 and name O  ) ( resid   73 and name N  )  2.70  0.00  0.30

assign ( resid   70 and name O  ) ( resid   74 and name HN )  1.80  0.00  0.30
assign ( resid   70 and name O  ) ( resid   74 and name N  )  2.70  0.00  0.30

assign ( resid   77 and name O  ) ( resid   80 and name HN )  1.80  0.00  0.30
assign ( resid   77 and name O  ) ( resid   80 and name N  )  2.70  0.00  0.30

assign ( resid   78 and name O  ) ( resid   81 and name HN )  1.80  0.00  0.30
assign ( resid   78 and name O  ) ( resid   81 and name N  )  2.70  0.00  0.30

  assign ( resid 101 and name H8    ) ( resid 101 and name H2''  ) 5.00 3.20 0.00 peak 70001  
  assign ( resid 101 and name H2''  ) ( resid 102 and name H8    ) 5.00 3.20 0.00 peak 70002  
  assign ( resid 102 and name H8    ) ( resid 101 and name H1'   ) 5.00 3.20 0.00 peak 70003  
  assign ( resid 103 and name H2    ) ( resid 104 and name H1'   ) 5.00 3.20 0.00 peak 70004  
  assign ( resid 103 and name H2    ) ( resid 118 and name H1'   ) 5.00 3.20 0.00 peak 70005  
  assign ( resid 104 and name H8    ) ( resid 103 and name H1'   ) 5.00 3.20 0.00 peak 70006  
  assign ( resid 104 and name H8    ) ( resid 104 and name H1'   ) 5.00 3.20 0.00 peak 70007  
  assign ( resid 105 and name H8    ) ( resid 105 and name H1'   ) 5.00 3.20 0.00 peak 70008  
  assign ( resid 105 and name H8    ) ( resid 104 and name H1'   ) 5.00 3.20 0.00 peak 70009  
  assign ( resid 105 and name H1    ) ( resid 115 and name H5    ) 5.00 3.20 0.00 peak 70010  
  assign ( resid 105 and name H8    ) ( resid 106 and name H5    ) 5.00 3.20 0.00 peak 70011  
  assign ( resid 106 and name H6    ) ( resid 105 and name H1'   ) 5.00 3.20 0.00 peak 70012  
  assign ( resid 106 and name H6    ) ( resid 106 and name H1'   ) 5.00 3.20 0.00 peak 70013  
  assign ( resid 106 and name H6    ) ( resid 107 and name H5    ) 5.00 3.20 0.00 peak 70014  
  assign ( resid 106 and name H5    ) ( resid 105 and name H1'   ) 5.00 3.20 0.00 peak 70015  
  assign ( resid 107 and name H6    ) ( resid 107 and name H1'   ) 5.00 3.20 0.00 peak 70016  
  assign ( resid 107 and name H6    ) ( resid 106 and name H1'   ) 5.00 3.20 0.00 peak 70017  
  assign ( resid 107 and name H6    ) ( resid 108 and name H6    ) 5.00 3.20 0.00 peak 70018  
  assign ( resid 107 and name H3    ) ( resid 113 and name H2    ) 5.00 3.20 0.00 peak 70019  
  assign ( resid 107 and name H5    ) ( resid 108 and name H5    ) 5.00 3.20 0.00 peak 70020  
  assign ( resid 107 and name H6    ) ( resid 108 and name H5    ) 5.00 3.20 0.00 peak 70021  
  assign ( resid 107 and name H5    ) ( resid 106 and name H1'   ) 5.00 3.20 0.00 peak 70022  
  assign ( resid 108 and name H6    ) ( resid 107 and name H5    ) 5.00 3.20 0.00 peak 70023   
  assign ( resid 108 and name H6    ) ( resid 108 and name H1'   ) 5.00 3.20 0.00 peak 70024  
  assign ( resid 109 and name H6    ) ( resid 108 and name H1'   ) 5.00 3.20 0.00 peak 70026   
  assign ( resid 109 and name H1'   ) ( resid 110 and name H8    ) 5.00 3.20 0.00 peak 70028  
  assign ( resid 110 and name H8    ) ( resid 110 and name H1'   ) 5.00 3.20 0.00 peak 70029  
  assign ( resid 110 and name H8    ) ( resid 109 and name H1'   ) 5.00 3.20 0.00 peak 70032  
  assign ( resid 110 and name H4'   ) ( resid 110 and name H2''  ) 5.00 3.20 0.00 peak 70033  
  assign ( resid 110 and name H4'   ) ( resid 110 and name H1'   ) 5.00 3.20 0.00 peak 70034  
  assign ( resid 111 and name H4'   ) ( resid 110 and name H4'   ) 5.00 3.20 0.00 peak 70037  
  assign ( resid 111 and name H1'   ) ( resid 111 and name H2''  ) 5.00 3.20 0.00 peak 70038  
  assign ( resid 111 and name H1'   ) ( resid 111 and name H3'   ) 5.00 3.20 0.00 peak 70039  
  assign ( resid 111 and name H8    ) ( resid 111 and name H2'   ) 5.00 3.20 0.00 peak 70040  
  assign ( resid 111 and name H8    ) ( resid 111 and name H3'   ) 5.00 3.20 0.00 peak 70041  
  assign ( resid 111 and name H1    ) ( resid 113 and name H2    ) 5.00 3.20 0.00 peak 70043  
  assign ( resid 111 and name H1    ) ( resid 107 and name H3    ) 5.00 3.20 0.00 peak 70044  
  assign ( resid 111 and name H1    ) ( resid 108 and name H5    ) 5.00 3.20 0.00 peak 70045  
  assign ( resid 112 and name H6    ) ( resid 112 and name H1'   ) 5.00 3.20 0.00 peak 70046  
  assign ( resid 113 and name H8    ) ( resid 111 and name H1'   ) 5.00 3.20 0.00 peak 70047  
  assign ( resid 113 and name H8    ) ( resid 111 and name H2''  ) 5.00 3.20 0.00 peak 70048  
  assign ( resid 113 and name H1'   ) ( resid 111 and name H1'   ) 5.00 3.20 0.00 peak 70050  
  assign ( resid 114 and name H8    ) ( resid 113 and name H1'   ) 5.00 3.20 0.00 peak 70051  
  assign ( resid 114 and name H1    ) ( resid 105 and name H1    ) 5.00 3.20 0.00 peak 70052  
  assign ( resid 114 and name H1    ) ( resid 106 and name H5    ) 5.00 3.20 0.00 peak 70053  
  assign ( resid 115 and name H6    ) ( resid 114 and name H1'   ) 5.00 3.20 0.00 peak 70054  
  assign ( resid 115 and name H6    ) ( resid 116 and name H5    ) 5.00 3.20 0.00 peak 70055  
  assign ( resid 115 and name H6    ) ( resid 115 and name H1'   ) 5.00 3.20 0.00 peak 70056  
  assign ( resid 116 and name H6    ) ( resid 116 and name H1'   ) 5.00 3.20 0.00 peak 70057  
  assign ( resid 116 and name H6    ) ( resid 115 and name H1'   ) 5.00 3.20 0.00 peak 70058  
  assign ( resid 116 and name H6    ) ( resid 115 and name H5    ) 5.00 3.20 0.00 peak 70059  
  assign ( resid 117 and name H6    ) ( resid 116 and name H1'   ) 5.00 3.20 0.00 peak 70060  
  assign ( resid 119 and name H6    ) ( resid 118 and name H1'   ) 5.00 3.20 0.00 peak 70061  



!!!!G1-C19
assign (resid 101 and name n1) (resid 119 and name n3)   2.87 0.20 0.20
assign (resid 101 and name h1) (resid 119 and name n3)   1.86 0.20 0.20
assign (resid 101 and name o6) (resid 119 and name n4)   2.81 0.20 0.20
assign (resid 101 and name n2) (resid 119 and name o2)   2.81 0.20 0.20
assign (resid 101 and name n2) (resid 119 and name n3)   3.58 0.20 0.20
assign (resid 101 and name o6) (resid 119 and name n3)   3.63 0.20 0.20

!!!!G2-U18   
assign (resid 102 and name O6) (resid 118 and name H3)   1.90 0.10 0.30
assign (resid 102 and name O6) (resid 118 and name N3)   3.00 0.28 0.08
assign (resid 102 and name H1) (resid 118 and name O2)   1.90 0.10 0.30
assign (resid 102 and name N1) (resid 118 and name O2)   3.00 0.28 0.08

!!!!A3-U17
assign (resid 103 and name n1) (resid 117 and name n3)   2.92 0.20 0.20
assign (resid 103 and name n1) (resid 117 and name h3)   1.91 0.20 0.20
assign (resid 103 and name n6) (resid 117 and name o4)   2.89 0.20 0.20
assign (resid 103 and name h2) (resid 117 and name o2)   2.94 0.20 0.20
assign (resid 103 and name n1) (resid 117 and name o4)   3.69 0.20 0.20
assign (resid 103 and name n1) (resid 117 and name o2)   3.67 0.20 0.20

!!!!G4-U16   
assign (resid 104 and name O6)  (resid 116 and name H3)  1.90 0.10 0.30
assign (resid 104 and name O6)  (resid 116 and name N3)  3.00 0.28 0.08
assign (resid 104 and name H1)  (resid 116 and name O2)  1.90 0.10 0.30
assign (resid 104 and name N1)  (resid 116 and name O2)  3.00 0.28 0.08

!!!!G5-C15
assign (resid 105 and name n1) (resid 115 and name n3)   2.87 0.20 0.20
assign (resid 105 and name h1) (resid 115 and name n3)   1.86 0.20 0.20
assign (resid 105 and name o6) (resid 115 and name n4)   2.81 0.20 0.20
assign (resid 105 and name n2) (resid 115 and name o2)   2.81 0.20 0.20
assign (resid 105 and name n2) (resid 115 and name n3)   3.58 0.20 0.20
assign (resid 105 and name o6) (resid 115 and name n3)   3.63 0.20 0.20

!!!!G14-C6
assign (resid 114 and name n1) (resid 106 and name n3)   2.87 0.20 0.20
assign (resid 114 and name h1) (resid 106 and name n3)   1.86 0.20 0.20
assign (resid 114 and name o6) (resid 106 and name n4)   2.81 0.20 0.20
assign (resid 114 and name n2) (resid 106 and name o2)   2.81 0.20 0.20
assign (resid 114 and name n2) (resid 106 and name n3)   3.58 0.20 0.20
assign (resid 114 and name o6) (resid 106 and name n3)   3.63 0.20 0.20

!!!!A13-U7
assign (resid 113 and name n1) (resid 107 and name n3)   2.92 0.20 0.20
assign (resid 113 and name n1) (resid 107 and name h3)   1.91 0.20 0.20
assign (resid 113 and name n6) (resid 107 and name o4)   2.89 0.20 0.20
assign (resid 113 and name h2) (resid 107 and name o2)   2.94 0.20 0.20
assign (resid 113 and name n1) (resid 107 and name o4)   3.69 0.20 0.20
assign (resid 113 and name n1) (resid 107 and name o2)   3.67 0.20 0.20

!!!!G11-C8
assign (resid 111 and name n1) (resid 108 and name n3)   2.87 0.20 0.20
assign (resid 111 and name h1) (resid 108 and name n3)   1.86 0.20 0.20
assign (resid 111 and name o6) (resid 108 and name n4)   2.81 0.20 0.20
assign (resid 111 and name n2) (resid 108 and name o2)   2.81 0.20 0.20
assign (resid 111 and name n2) (resid 108 and name n3)   3.58 0.20 0.20
assign (resid 111 and name o6) (resid 108 and name n3)   3.63 0.20 0.20

assign ( resid  23 and name HD2# ) ( resid 110 and name H21  )   4.50  2.70  0.00 peak 60001
assign ( resid  23 and name HD2# ) ( resid 110 and name H22  )   4.50  2.70  0.00 peak 60002
assign ( resid  25 and name HD*  ) ( resid 110 and name H1   )   4.00  2.70  0.00 peak 60003
assign ( resid  26 and name HE*  ) ( resid 110 and name H1   )   4.50  2.70  0.00 peak 60004
assign ( resid  53 and name HN   ) ( resid 110 and name H1   )   4.50  2.70  0.00 peak 60005
assign ( resid  53 and name HN   ) ( resid 108 and name H3'  )   4.50  2.70  0.00 peak 60006
assign ( resid  53 and name HB#  ) ( resid 110 and name H1   )   3.00  1.20  0.00 peak 60007
assign ( resid  53 and name HB#  ) ( resid 108 and name H2'  )   4.50  2.70  0.00 peak 60008
assign ( resid  53 and name HB#  ) ( resid 108 and name H3'  )   3.00  1.20  0.00 peak 60009
assign ( resid  54 and name HD2# ) ( resid 109 and name H5'' )   3.00  1.20  0.00 peak 60010
assign ( resid  54 and name HN   ) ( resid 108 and name H3'  )   4.50  2.70  0.00 peak 60011
assign ( resid  54 and name HN   ) ( resid 109 and name H5'  )   4.50  2.70  0.00 peak 60012
assign ( resid  55 and name HN   ) ( resid 108 and name H2'  )   4.50  2.70  0.00 peak 60013
assign ( resid  55 and name HN   ) ( resid 108 and name H3'  )   4.50  2.70  0.00 peak 60014
assign ( resid  55 and name HN   ) ( resid 109 and name H3'  )   4.50  2.70  0.00 peak 60015
assign ( resid  55 and name HN   ) ( resid 109 and name H5'  )   3.00  1.20  0.00 peak 60016
assign ( resid  55 and name HA1  ) ( resid 109 and name H3'  )   3.00  1.20  0.00 peak 60017
assign ( resid  55 and name HA2  ) ( resid 109 and name H3'  )   4.00  2.70  0.00 peak 60018
assign ( resid  56 and name HB#  ) ( resid 110 and name H1   )   3.00  1.20  0.00 peak 60019
assign ( resid  56 and name HB#  ) ( resid 110 and name H21  )   3.00  1.20  0.00 peak 60020
assign ( resid  56 and name HB#  ) ( resid 110 and name H22  )   3.00  1.20  0.00 peak 60021
assign ( resid  56 and name HN   ) ( resid 109 and name H3'  )   5.50  3.70  0.00 peak 60022
assign ( resid  58 and name HD*  ) ( resid 109 and name H3'  )   4.50  2.70  0.00 peak 60023
! residue    2 cyana PSI 
assign ( resid    2 and name N  ) ( resid    2 and name CA  )
       ( resid    2 and name C  ) ( resid    3 and name N  ) 1.00 -29.0  44.0 2

! residue    3 cyana PHI 
assign ( resid    2 and name C  ) ( resid    3 and name N  )
       ( resid    3 and name CA ) ( resid    3 and name C  ) 1.00 -66.0  28.0 2

! residue    3 cyana PSI 
assign ( resid    3 and name N  ) ( resid    3 and name CA  )
       ( resid    3 and name C  ) ( resid    4 and name N  ) 1.00 -39.0  52.0 2

! residue    4 cyana PHI 
assign ( resid    3 and name C  ) ( resid    4 and name N  )
       ( resid    4 and name CA ) ( resid    4 and name C  ) 1.00 -69.0  52.0 2

! residue    4 cyana PSI 
assign ( resid    4 and name N  ) ( resid    4 and name CA  )
       ( resid    4 and name C  ) ( resid    5 and name N  ) 1.00 -33.0  48.0 2

! residue    5 cyana PHI 
assign ( resid    4 and name C  ) ( resid    5 and name N  )
       ( resid    5 and name CA ) ( resid    5 and name C  ) 1.00 -77.0  84.0 2

! residue    5 cyana PSI 
assign ( resid    5 and name N  ) ( resid    5 and name CA  )
       ( resid    5 and name C  ) ( resid    6 and name N  ) 1.00 -32.0  72.0 2

! residue    6 cyana PHI 
assign ( resid    5 and name C  ) ( resid    6 and name N  )
       ( resid    6 and name CA ) ( resid    6 and name C  ) 1.00 -90.0  48.0 2

! residue    6 cyana PSI 
assign ( resid    6 and name N  ) ( resid    6 and name CA  )
       ( resid    6 and name C  ) ( resid    7 and name N  ) 1.00  -2.0  20.0 2

! residue    7 cyana PHI 
assign ( resid    6 and name C  ) ( resid    7 and name N  )
       ( resid    7 and name CA ) ( resid    7 and name C  ) 1.00 -77.0  84.0 2

! residue    7 cyana PSI 
assign ( resid    7 and name N  ) ( resid    7 and name CA  )
       ( resid    7 and name C  ) ( resid    8 and name N  ) 1.00 125.0  96.0 2

! residue   10 cyana PHI 
assign ( resid    9 and name C  ) ( resid   10 and name N  )
       ( resid   10 and name CA ) ( resid   10 and name C  ) 1.00 -67.0  20.0 2

! residue   10 cyana PSI 
assign ( resid   10 and name N  ) ( resid   10 and name CA  )
       ( resid   10 and name C  ) ( resid   11 and name N  ) 1.00 -37.0  56.0 2

! residue   11 cyana PHI 
assign ( resid   10 and name C  ) ( resid   11 and name N  )
       ( resid   11 and name CA ) ( resid   11 and name C  ) 1.00 -69.0  44.0 2

! residue   11 cyana PSI 
assign ( resid   11 and name N  ) ( resid   11 and name CA  )
       ( resid   11 and name C  ) ( resid   12 and name N  ) 1.00 -32.0  36.0 2

! residue   12 cyana PHI 
assign ( resid   11 and name C  ) ( resid   12 and name N  )
       ( resid   12 and name CA ) ( resid   12 and name C  ) 1.00 -90.0  84.0 2

! residue   12 cyana PSI 
assign ( resid   12 and name N  ) ( resid   12 and name CA  )
       ( resid   12 and name C  ) ( resid   13 and name N  ) 1.00 -11.0  84.0 2

! residue   13 cyana PHI 
assign ( resid   12 and name C  ) ( resid   13 and name N  )
       ( resid   13 and name CA ) ( resid   13 and name C  ) 1.00 -92.0  80.0 2

! residue   13 cyana PSI 
assign ( resid   13 and name N  ) ( resid   13 and name CA  )
       ( resid   13 and name C  ) ( resid   14 and name N  ) 1.00 122.0 112.0 2

! residue   16 cyana PHI 
assign ( resid   15 and name C  ) ( resid   16 and name N  )
       ( resid   16 and name CA ) ( resid   16 and name C  ) 1.00 -71.0  64.0 2

! residue   16 cyana PSI 
assign ( resid   16 and name N  ) ( resid   16 and name CA  )
       ( resid   16 and name C  ) ( resid   17 and name N  ) 1.00 -37.0  36.0 2

! residue   17 cyana PHI 
assign ( resid   16 and name C  ) ( resid   17 and name N  )
       ( resid   17 and name CA ) ( resid   17 and name C  ) 1.00 -65.0  20.0 2

! residue   17 cyana PSI 
assign ( resid   17 and name N  ) ( resid   17 and name CA  )
       ( resid   17 and name C  ) ( resid   18 and name N  ) 1.00 -42.0  36.0 2

! residue   18 cyana PHI 
assign ( resid   17 and name C  ) ( resid   18 and name N  )
       ( resid   18 and name CA ) ( resid   18 and name C  ) 1.00 -67.0  24.0 2

! residue   18 cyana PSI 
assign ( resid   18 and name N  ) ( resid   18 and name CA  )
       ( resid   18 and name C  ) ( resid   19 and name N  ) 1.00 -40.0  28.0 2

! residue   19 cyana PHI 
assign ( resid   18 and name C  ) ( resid   19 and name N  )
       ( resid   19 and name CA ) ( resid   19 and name C  ) 1.00 -66.0  28.0 2

! residue   19 cyana PSI 
assign ( resid   19 and name N  ) ( resid   19 and name CA  )
       ( resid   19 and name C  ) ( resid   20 and name N  ) 1.00 -36.0  24.0 2

! residue   20 cyana PHI 
assign ( resid   19 and name C  ) ( resid   20 and name N  )
       ( resid   20 and name CA ) ( resid   20 and name C  ) 1.00 -70.0  28.0 2

! residue   20 cyana PSI 
assign ( resid   20 and name N  ) ( resid   20 and name CA  )
       ( resid   20 and name C  ) ( resid   21 and name N  ) 1.00 -21.0  48.0 2

! residue   21 cyana PHI 
assign ( resid   20 and name C  ) ( resid   21 and name N  )
       ( resid   21 and name CA ) ( resid   21 and name C  ) 1.00 -90.0  44.0 2

! residue   21 cyana PSI 
assign ( resid   21 and name N  ) ( resid   21 and name CA  )
       ( resid   21 and name C  ) ( resid   22 and name N  ) 1.00   4.0  52.0 2

! residue   22 cyana PHI 
assign ( resid   21 and name C  ) ( resid   22 and name N  )
       ( resid   22 and name CA ) ( resid   22 and name C  ) 1.00  66.0  44.0 2

! residue   22 cyana PSI 
assign ( resid   22 and name N  ) ( resid   22 and name CA  )
       ( resid   22 and name C  ) ( resid   23 and name N  ) 1.00  31.0  36.0 2

! residue   23 cyana PHI 
assign ( resid   22 and name C  ) ( resid   23 and name N  )
       ( resid   23 and name CA ) ( resid   23 and name C  ) 1.00 -89.0  68.0 2

! residue   23 cyana PSI 
assign ( resid   23 and name N  ) ( resid   23 and name CA  )
       ( resid   23 and name C  ) ( resid   24 and name N  ) 1.00 -26.0  72.0 2

! residue   24 cyana PHI 
assign ( resid   23 and name C  ) ( resid   24 and name N  )
       ( resid   24 and name CA ) ( resid   24 and name C  ) 1.00 -66.0  28.0 2

! residue   24 cyana PSI 
assign ( resid   24 and name N  ) ( resid   24 and name CA  )
       ( resid   24 and name C  ) ( resid   25 and name N  ) 1.00 -37.0  32.0 2

! residue   25 cyana PHI 
assign ( resid   24 and name C  ) ( resid   25 and name N  )
       ( resid   25 and name CA ) ( resid   25 and name C  ) 1.00 -69.0  28.0 2

! residue   25 cyana PSI 
assign ( resid   25 and name N  ) ( resid   25 and name CA  )
       ( resid   25 and name C  ) ( resid   26 and name N  ) 1.00 -33.0  44.0 2

! residue   26 cyana PHI 
assign ( resid   25 and name C  ) ( resid   26 and name N  )
       ( resid   26 and name CA ) ( resid   26 and name C  ) 1.00 -65.0  20.0 2

! residue   26 cyana PSI 
assign ( resid   26 and name N  ) ( resid   26 and name CA  )
       ( resid   26 and name C  ) ( resid   27 and name N  ) 1.00 -39.0  24.0 2

! residue   27 cyana PHI 
assign ( resid   26 and name C  ) ( resid   27 and name N  )
       ( resid   27 and name CA ) ( resid   27 and name C  ) 1.00 -64.0  28.0 2

! residue   27 cyana PSI 
assign ( resid   27 and name N  ) ( resid   27 and name CA  )
       ( resid   27 and name C  ) ( resid   28 and name N  ) 1.00 -40.0  24.0 2

! residue   28 cyana PHI 
assign ( resid   27 and name C  ) ( resid   28 and name N  )
       ( resid   28 and name CA ) ( resid   28 and name C  ) 1.00 -67.0  24.0 2

! residue   28 cyana PSI 
assign ( resid   28 and name N  ) ( resid   28 and name CA  )
       ( resid   28 and name C  ) ( resid   29 and name N  ) 1.00 -38.0  28.0 2

! residue   29 cyana PHI 
assign ( resid   28 and name C  ) ( resid   29 and name N  )
       ( resid   29 and name CA ) ( resid   29 and name C  ) 1.00 -68.0  40.0 2

! residue   29 cyana PSI 
assign ( resid   29 and name N  ) ( resid   29 and name CA  )
       ( resid   29 and name C  ) ( resid   30 and name N  ) 1.00 -33.0  40.0 2

! residue   30 cyana PHI 
assign ( resid   29 and name C  ) ( resid   30 and name N  )
       ( resid   30 and name CA ) ( resid   30 and name C  ) 1.00 -89.0  68.0 2

! residue   30 cyana PSI 
assign ( resid   30 and name N  ) ( resid   30 and name CA  )
       ( resid   30 and name C  ) ( resid   31 and name N  ) 1.00 -17.0 104.0 2

! residue   31 cyana PHI 
assign ( resid   30 and name C  ) ( resid   31 and name N  )
       ( resid   31 and name CA ) ( resid   31 and name C  ) 1.00 -57.0 108.0 2

! residue   31 cyana PSI 
assign ( resid   31 and name N  ) ( resid   31 and name CA  )
       ( resid   31 and name C  ) ( resid   32 and name N  ) 1.00 143.0  80.0 2

! residue   32 cyana PHI 
assign ( resid   31 and name C  ) ( resid   32 and name N  )
       ( resid   32 and name CA ) ( resid   32 and name C  ) 1.00  96.0  20.0 2

! residue   32 cyana PSI 
assign ( resid   32 and name N  ) ( resid   32 and name CA  )
       ( resid   32 and name C  ) ( resid   33 and name N  ) 1.00 -11.0  48.0 2

! residue   33 cyana PHI 
assign ( resid   32 and name C  ) ( resid   33 and name N  )
       ( resid   33 and name CA ) ( resid   33 and name C  ) 1.00 -101.0  96.0 2

! residue   33 cyana PSI 
assign ( resid   33 and name N  ) ( resid   33 and name CA  )
       ( resid   33 and name C  ) ( resid   34 and name N  ) 1.00 126.0  56.0 2

! residue   34 cyana PSI 
assign ( resid   34 and name N  ) ( resid   34 and name CA  )
       ( resid   34 and name C  ) ( resid   35 and name N  ) 1.00 140.0 100.0 2

! residue   35 cyana PHI 
assign ( resid   34 and name C  ) ( resid   35 and name N  )
       ( resid   35 and name CA ) ( resid   35 and name C  ) 1.00 -65.0  20.0 2

! residue   35 cyana PSI 
assign ( resid   35 and name N  ) ( resid   35 and name CA  )
       ( resid   35 and name C  ) ( resid   36 and name N  ) 1.00 -40.0  28.0 2

! residue   36 cyana PHI 
assign ( resid   35 and name C  ) ( resid   36 and name N  )
       ( resid   36 and name CA ) ( resid   36 and name C  ) 1.00 -67.0  40.0 2

! residue   36 cyana PSI 
assign ( resid   36 and name N  ) ( resid   36 and name CA  )
       ( resid   36 and name C  ) ( resid   37 and name N  ) 1.00 -36.0  52.0 2

! residue   37 cyana PHI 
assign ( resid   36 and name C  ) ( resid   37 and name N  )
       ( resid   37 and name CA ) ( resid   37 and name C  ) 1.00 -67.0  32.0 2

! residue   37 cyana PSI 
assign ( resid   37 and name N  ) ( resid   37 and name CA  )
       ( resid   37 and name C  ) ( resid   38 and name N  ) 1.00 -38.0  32.0 2

! residue   38 cyana PHI 
assign ( resid   37 and name C  ) ( resid   38 and name N  )
       ( resid   38 and name CA ) ( resid   38 and name C  ) 1.00 -69.0  64.0 2

! residue   38 cyana PSI 
assign ( resid   38 and name N  ) ( resid   38 and name CA  )
       ( resid   38 and name C  ) ( resid   39 and name N  ) 1.00 -45.0  56.0 2

! residue   39 cyana PHI 
assign ( resid   38 and name C  ) ( resid   39 and name N  )
       ( resid   39 and name CA ) ( resid   39 and name C  ) 1.00 -63.0  64.0 2

! residue   39 cyana PSI 
assign ( resid   39 and name N  ) ( resid   39 and name CA  )
       ( resid   39 and name C  ) ( resid   40 and name N  ) 1.00 -30.0  60.0 2

! residue   40 cyana PHI 
assign ( resid   39 and name C  ) ( resid   40 and name N  )
       ( resid   40 and name CA ) ( resid   40 and name C  ) 1.00 -75.0  48.0 2

! residue   40 cyana PSI 
assign ( resid   40 and name N  ) ( resid   40 and name CA  )
       ( resid   40 and name C  ) ( resid   41 and name N  ) 1.00 -31.0  56.0 2

! residue   42 cyana PHI 
assign ( resid   41 and name C  ) ( resid   42 and name N  )
       ( resid   42 and name CA ) ( resid   42 and name C  ) 1.00 -95.0  92.0 2

! residue   42 cyana PSI 
assign ( resid   42 and name N  ) ( resid   42 and name CA  )
       ( resid   42 and name C  ) ( resid   43 and name N  ) 1.00 154.0  36.0 2

! residue   43 cyana PHI 
assign ( resid   42 and name C  ) ( resid   43 and name N  )
       ( resid   43 and name CA ) ( resid   43 and name C  ) 1.00 -62.0  24.0 2

! residue   43 cyana PSI 
assign ( resid   43 and name N  ) ( resid   43 and name CA  )
       ( resid   43 and name C  ) ( resid   44 and name N  ) 1.00 -41.0  32.0 2

! residue   44 cyana PHI 
assign ( resid   43 and name C  ) ( resid   44 and name N  )
       ( resid   44 and name CA ) ( resid   44 and name C  ) 1.00 -66.0  20.0 2

! residue   44 cyana PSI 
assign ( resid   44 and name N  ) ( resid   44 and name CA  )
       ( resid   44 and name C  ) ( resid   45 and name N  ) 1.00 -39.0  24.0 2

! residue   45 cyana PHI 
assign ( resid   44 and name C  ) ( resid   45 and name N  )
       ( resid   45 and name CA ) ( resid   45 and name C  ) 1.00 -70.0  40.0 2

! residue   45 cyana PSI 
assign ( resid   45 and name N  ) ( resid   45 and name CA  )
       ( resid   45 and name C  ) ( resid   46 and name N  ) 1.00 -41.0  24.0 2

! residue   46 cyana PHI 
assign ( resid   45 and name C  ) ( resid   46 and name N  )
       ( resid   46 and name CA ) ( resid   46 and name C  ) 1.00 -64.0  24.0 2

! residue   46 cyana PSI 
assign ( resid   46 and name N  ) ( resid   46 and name CA  )
       ( resid   46 and name C  ) ( resid   47 and name N  ) 1.00 -38.0  40.0 2

! residue   47 cyana PHI 
assign ( resid   46 and name C  ) ( resid   47 and name N  )
       ( resid   47 and name CA ) ( resid   47 and name C  ) 1.00 -68.0  20.0 2

! residue   47 cyana PSI 
assign ( resid   47 and name N  ) ( resid   47 and name CA  )
       ( resid   47 and name C  ) ( resid   48 and name N  ) 1.00 -40.0  24.0 2

! residue   48 cyana PHI 
assign ( resid   47 and name C  ) ( resid   48 and name N  )
       ( resid   48 and name CA ) ( resid   48 and name C  ) 1.00 -71.0  32.0 2

! residue   48 cyana PSI 
assign ( resid   48 and name N  ) ( resid   48 and name CA  )
       ( resid   48 and name C  ) ( resid   49 and name N  ) 1.00 -30.0  48.0 2

! residue   49 cyana PHI 
assign ( resid   48 and name C  ) ( resid   49 and name N  )
       ( resid   49 and name CA ) ( resid   49 and name C  ) 1.00 -78.0  84.0 2

! residue   49 cyana PSI 
assign ( resid   49 and name N  ) ( resid   49 and name CA  )
       ( resid   49 and name C  ) ( resid   50 and name N  ) 1.00 -32.0  84.0 2

! residue   52 cyana PHI 
assign ( resid   51 and name C  ) ( resid   52 and name N  )
       ( resid   52 and name CA ) ( resid   52 and name C  ) 1.00 -70.0  52.0 2

! residue   52 cyana PSI 
assign ( resid   52 and name N  ) ( resid   52 and name CA  )
       ( resid   52 and name C  ) ( resid   53 and name N  ) 1.00 -26.0  60.0 2

! residue   54 cyana PHI 
assign ( resid   53 and name C  ) ( resid   54 and name N  )
       ( resid   54 and name CA ) ( resid   54 and name C  ) 1.00 -57.0  32.0 2

! residue   54 cyana PSI 
assign ( resid   54 and name N  ) ( resid   54 and name CA  )
       ( resid   54 and name C  ) ( resid   55 and name N  ) 1.00 -41.0  32.0 2

! residue   55 cyana PHI 
assign ( resid   54 and name C  ) ( resid   55 and name N  )
       ( resid   55 and name CA ) ( resid   55 and name C  ) 1.00 -64.0  20.0 2

! residue   55 cyana PSI 
assign ( resid   55 and name N  ) ( resid   55 and name CA  )
       ( resid   55 and name C  ) ( resid   56 and name N  ) 1.00 -39.0  32.0 2

! residue   56 cyana PHI 
assign ( resid   55 and name C  ) ( resid   56 and name N  )
       ( resid   56 and name CA ) ( resid   56 and name C  ) 1.00 -65.0  24.0 2

! residue   56 cyana PSI 
assign ( resid   56 and name N  ) ( resid   56 and name CA  )
       ( resid   56 and name C  ) ( resid   57 and name N  ) 1.00 -42.0  36.0 2

! residue   57 cyana PHI 
assign ( resid   56 and name C  ) ( resid   57 and name N  )
       ( resid   57 and name CA ) ( resid   57 and name C  ) 1.00 -65.0  40.0 2

! residue   57 cyana PSI 
assign ( resid   57 and name N  ) ( resid   57 and name CA  )
       ( resid   57 and name C  ) ( resid   58 and name N  ) 1.00 -41.0  36.0 2

! residue   58 cyana PHI 
assign ( resid   57 and name C  ) ( resid   58 and name N  )
       ( resid   58 and name CA ) ( resid   58 and name C  ) 1.00 -65.0  24.0 2

! residue   58 cyana PSI 
assign ( resid   58 and name N  ) ( resid   58 and name CA  )
       ( resid   58 and name C  ) ( resid   59 and name N  ) 1.00 -36.0  60.0 2

! residue   59 cyana PHI 
assign ( resid   58 and name C  ) ( resid   59 and name N  )
       ( resid   59 and name CA ) ( resid   59 and name C  ) 1.00 -66.0  32.0 2

! residue   59 cyana PSI 
assign ( resid   59 and name N  ) ( resid   59 and name CA  )
       ( resid   59 and name C  ) ( resid   60 and name N  ) 1.00 -41.0  28.0 2

! residue   60 cyana PHI 
assign ( resid   59 and name C  ) ( resid   60 and name N  )
       ( resid   60 and name CA ) ( resid   60 and name C  ) 1.00 -70.0  52.0 2

! residue   60 cyana PSI 
assign ( resid   60 and name N  ) ( resid   60 and name CA  )
       ( resid   60 and name C  ) ( resid   61 and name N  ) 1.00 -33.0  52.0 2

! residue   61 cyana PHI 
assign ( resid   60 and name C  ) ( resid   61 and name N  )
       ( resid   61 and name CA ) ( resid   61 and name C  ) 1.00 -66.0  20.0 2

! residue   61 cyana PSI 
assign ( resid   61 and name N  ) ( resid   61 and name CA  )
       ( resid   61 and name C  ) ( resid   62 and name N  ) 1.00 -37.0  24.0 2

! residue   62 cyana PHI 
assign ( resid   61 and name C  ) ( resid   62 and name N  )
       ( resid   62 and name CA ) ( resid   62 and name C  ) 1.00 -67.0  24.0 2

! residue   62 cyana PSI 
assign ( resid   62 and name N  ) ( resid   62 and name CA  )
       ( resid   62 and name C  ) ( resid   63 and name N  ) 1.00 -38.0  32.0 2

! residue   63 cyana PHI 
assign ( resid   62 and name C  ) ( resid   63 and name N  )
       ( resid   63 and name CA ) ( resid   63 and name C  ) 1.00 -68.0  40.0 2

! residue   63 cyana PSI 
assign ( resid   63 and name N  ) ( resid   63 and name CA  )
       ( resid   63 and name C  ) ( resid   64 and name N  ) 1.00 -31.0  64.0 2

! residue   64 cyana PHI 
assign ( resid   63 and name C  ) ( resid   64 and name N  )
       ( resid   64 and name CA ) ( resid   64 and name C  ) 1.00 -66.0  20.0 2

! residue   64 cyana PSI 
assign ( resid   64 and name N  ) ( resid   64 and name CA  )
       ( resid   64 and name C  ) ( resid   65 and name N  ) 1.00 -33.0  32.0 2

! residue   65 cyana PHI 
assign ( resid   64 and name C  ) ( resid   65 and name N  )
       ( resid   65 and name CA ) ( resid   65 and name C  ) 1.00 -68.0  24.0 2

! residue   65 cyana PSI 
assign ( resid   65 and name N  ) ( resid   65 and name CA  )
       ( resid   65 and name C  ) ( resid   66 and name N  ) 1.00 -36.0  20.0 2

! residue   66 cyana PHI 
assign ( resid   65 and name C  ) ( resid   66 and name N  )
       ( resid   66 and name CA ) ( resid   66 and name C  ) 1.00 -71.0  32.0 2

! residue   66 cyana PSI 
assign ( resid   66 and name N  ) ( resid   66 and name CA  )
       ( resid   66 and name C  ) ( resid   67 and name N  ) 1.00 -41.0  28.0 2

! residue   67 cyana PHI 
assign ( resid   66 and name C  ) ( resid   67 and name N  )
       ( resid   67 and name CA ) ( resid   67 and name C  ) 1.00 -66.0  32.0 2

! residue   67 cyana PSI 
assign ( resid   67 and name N  ) ( resid   67 and name CA  )
       ( resid   67 and name C  ) ( resid   68 and name N  ) 1.00 -42.0  24.0 2

! residue   68 cyana PHI 
assign ( resid   67 and name C  ) ( resid   68 and name N  )
       ( resid   68 and name CA ) ( resid   68 and name C  ) 1.00 -69.0  20.0 2

! residue   68 cyana PSI 
assign ( resid   68 and name N  ) ( resid   68 and name CA  )
       ( resid   68 and name C  ) ( resid   69 and name N  ) 1.00 -42.0  20.0 2

! residue   69 cyana PHI 
assign ( resid   68 and name C  ) ( resid   69 and name N  )
       ( resid   69 and name CA ) ( resid   69 and name C  ) 1.00 -64.0  32.0 2

! residue   69 cyana PSI 
assign ( resid   69 and name N  ) ( resid   69 and name CA  )
       ( resid   69 and name C  ) ( resid   70 and name N  ) 1.00 -39.0  36.0 2

! residue   70 cyana PHI 
assign ( resid   69 and name C  ) ( resid   70 and name N  )
       ( resid   70 and name CA ) ( resid   70 and name C  ) 1.00 -70.0  32.0 2

! residue   70 cyana PSI 
assign ( resid   70 and name N  ) ( resid   70 and name CA  )
       ( resid   70 and name C  ) ( resid   71 and name N  ) 1.00 -39.0  20.0 2

! residue   71 cyana PHI 
assign ( resid   70 and name C  ) ( resid   71 and name N  )
       ( resid   71 and name CA ) ( resid   71 and name C  ) 1.00 -66.0  24.0 2

! residue   71 cyana PSI 
assign ( resid   71 and name N  ) ( resid   71 and name CA  )
       ( resid   71 and name C  ) ( resid   72 and name N  ) 1.00 -37.0  28.0 2

! residue   72 cyana PHI 
assign ( resid   71 and name C  ) ( resid   72 and name N  )
       ( resid   72 and name CA ) ( resid   72 and name C  ) 1.00 -63.0  20.0 2

! residue   72 cyana PSI 
assign ( resid   72 and name N  ) ( resid   72 and name CA  )
       ( resid   72 and name C  ) ( resid   73 and name N  ) 1.00 -34.0  36.0 2

! residue   73 cyana PHI 
assign ( resid   72 and name C  ) ( resid   73 and name N  )
       ( resid   73 and name CA ) ( resid   73 and name C  ) 1.00 -81.0  72.0 2

! residue   73 cyana PSI 
assign ( resid   73 and name N  ) ( resid   73 and name CA  )
       ( resid   73 and name C  ) ( resid   74 and name N  ) 1.00 -16.0 108.0 2

! residue   74 cyana PHI 
assign ( resid   73 and name C  ) ( resid   74 and name N  )
       ( resid   74 and name CA ) ( resid   74 and name C  ) 1.00  55.0  20.0 2

! residue   74 cyana PSI 
assign ( resid   74 and name N  ) ( resid   74 and name CA  )
       ( resid   74 and name C  ) ( resid   75 and name N  ) 1.00  35.0  20.0 2

! residue   75 cyana PHI 
assign ( resid   74 and name C  ) ( resid   75 and name N  )
       ( resid   75 and name CA ) ( resid   75 and name C  ) 1.00 -110.0  44.0 2

! residue   75 cyana PSI 
assign ( resid   75 and name N  ) ( resid   75 and name CA  )
       ( resid   75 and name C  ) ( resid   76 and name N  ) 1.00  -3.0  72.0 2

! residue   76 cyana PHI 
assign ( resid   75 and name C  ) ( resid   76 and name N  )
       ( resid   76 and name CA ) ( resid   76 and name C  ) 1.00 -85.0  72.0 2

! residue   76 cyana PSI 
assign ( resid   76 and name N  ) ( resid   76 and name CA  )
       ( resid   76 and name C  ) ( resid   77 and name N  ) 1.00 129.0 108.0 2

! residue   77 cyana PHI 
assign ( resid   76 and name C  ) ( resid   77 and name N  )
       ( resid   77 and name CA ) ( resid   77 and name C  ) 1.00 -76.0  60.0 2

! residue   77 cyana PSI 
assign ( resid   77 and name N  ) ( resid   77 and name CA  )
       ( resid   77 and name C  ) ( resid   78 and name N  ) 1.00 124.0  64.0 2

! residue   78 cyana PHI 
assign ( resid   77 and name C  ) ( resid   78 and name N  )
       ( resid   78 and name CA ) ( resid   78 and name C  ) 1.00 -67.0  44.0 2

! residue   78 cyana PSI 
assign ( resid   78 and name N  ) ( resid   78 and name CA  )
       ( resid   78 and name C  ) ( resid   79 and name N  ) 1.00 -37.0  48.0 2

! residue   79 cyana PHI 
assign ( resid   78 and name C  ) ( resid   79 and name N  )
       ( resid   79 and name CA ) ( resid   79 and name C  ) 1.00 -67.0  36.0 2

! residue   79 cyana PSI 
assign ( resid   79 and name N  ) ( resid   79 and name CA  )
       ( resid   79 and name C  ) ( resid   80 and name N  ) 1.00 -38.0  40.0 2

! residue   80 cyana PHI 
assign ( resid   79 and name C  ) ( resid   80 and name N  )
       ( resid   80 and name CA ) ( resid   80 and name C  ) 1.00 -65.0  36.0 2

! residue   80 cyana PSI 
assign ( resid   80 and name N  ) ( resid   80 and name CA  )
       ( resid   80 and name C  ) ( resid   81 and name N  ) 1.00 -41.0  36.0 2


assign (resid  101 and name O4')
       (resid  101 and name C1')
       (resid  101 and name C2')
       (resid  101 and name C3') 1.0 -20.0 10.0 2
assign (resid  101 and name C1')
       (resid  101 and name C2')
       (resid  101 and name C3')
       (resid  101 and name C4') 1.0  35.0  5.0 2

assign (resid  102 and name O4')
       (resid  102 and name C1')
       (resid  102 and name C2')
       (resid  102 and name C3') 1.0 -20.0 10.0 2
assign (resid  102 and name C1')
       (resid  102 and name C2')
       (resid  102 and name C3')
       (resid  102 and name C4') 1.0  35.0  5.0 2

assign (resid  103 and name O4')
       (resid  103 and name C1')
       (resid  103 and name C2')
       (resid  103 and name C3') 1.0 -20.0 10.0 2
assign (resid  103 and name C1')
       (resid  103 and name C2')
       (resid  103 and name C3')
       (resid  103 and name C4') 1.0  35.0  5.0 2

assign (resid  104 and name O4')
       (resid  104 and name C1')
       (resid  104 and name C2')
       (resid  104 and name C3') 1.0 -20.0 10.0 2
assign (resid  104 and name C1')
       (resid  104 and name C2')
       (resid  104 and name C3')
       (resid  104 and name C4') 1.0  35.0  5.0 2

assign (resid  105 and name O4')
       (resid  105 and name C1')
       (resid  105 and name C2')
       (resid  105 and name C3') 1.0 -20.0 10.0 2
assign (resid  105 and name C1')
       (resid  105 and name C2')
       (resid  105 and name C3')
       (resid  105 and name C4') 1.0  35.0  5.0 2

assign (resid  106 and name O4')
       (resid  106 and name C1')
       (resid  106 and name C2')
       (resid  106 and name C3') 1.0 -20.0 10.0 2
assign (resid  106 and name C1')
       (resid  106 and name C2')
       (resid  106 and name C3')
       (resid  106 and name C4') 1.0  35.0  5.0 2

assign (resid  107 and name O4')
       (resid  107 and name C1')
       (resid  107 and name C2')
       (resid  107 and name C3') 1.0 -20.0 10.0 2
assign (resid  107 and name C1')
       (resid  107 and name C2')
       (resid  107 and name C3')
       (resid  107 and name C4') 1.0  35.0  5.0 2


!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!
! C2 endo
!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!


assign (resid  110 and name O4')
       (resid  110 and name C1')
       (resid  110 and name C2')
       (resid  110 and name C3') 1.0  35.0 10.0 2
assign (resid  110 and name C1')
       (resid  110 and name C2')
       (resid  110 and name C3')
       (resid  110 and name C4') 1.0 -35.0 10.0 2


!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!


assign (resid  113 and name O4')
       (resid  113 and name C1')
       (resid  113 and name C2')
       (resid  113 and name C3') 1.0 -20.0 10.0 2
assign (resid  113 and name C1')
       (resid  113 and name C2')
       (resid  113 and name C3')
       (resid  113 and name C4') 1.0  35.0  5.0 2
 
assign (resid  114 and name O4')
       (resid  114 and name C1')
       (resid  114 and name C2')
       (resid  114 and name C3') 1.0 -20.0 10.0 2
assign (resid  114 and name C1')
       (resid  114 and name C2')
       (resid  114 and name C3')
       (resid  114 and name C4') 1.0  35.0  5.0 2

assign (resid  115 and name O4')
       (resid  115 and name C1')
       (resid  115 and name C2')
       (resid  115 and name C3') 1.0 -20.0 10.0 2   
assign (resid  115 and name C1')
       (resid  115 and name C2')
       (resid  115 and name C3')
       (resid  115 and name C4') 1.0  35.0  5.0 2   

assign (resid  116 and name O4')
       (resid  116 and name C1')
       (resid  116 and name C2')
       (resid  116 and name C3') 1.0 -20.0 10.0 2
assign (resid  116 and name C1')
       (resid  116 and name C2')
       (resid  116 and name C3')
       (resid  116 and name C4') 1.0  35.0  5.0 2

assign (resid  117 and name O4')
       (resid  117 and name C1')
       (resid  117 and name C2')
       (resid  117 and name C3') 1.0 -20.0 10.0 2
assign (resid  117 and name C1')
       (resid  117 and name C2')
       (resid  117 and name C3')
       (resid  117 and name C4') 1.0  35.0  5.0 2

assign (resid  118 and name O4')
       (resid  118 and name C1')
       (resid  118 and name C2')
       (resid  118 and name C3') 1.0 -20.0 10.0 2
assign (resid  118 and name C1')
       (resid  118 and name C2')
       (resid  118 and name C3')
       (resid  118 and name C4') 1.0  35.0  5.0 2

assign (resid  119 and name O4')
       (resid  119 and name C1')
       (resid  119 and name C2')
       (resid  119 and name C3') 1.0 -20.0 10.0 2
assign (resid  119 and name C1')
       (resid  119 and name C2')
       (resid  119 and name C3')
       (resid  119 and name C4') 1.0  35.0  5.0 2


assign  (resid  101  and name O5' ) (resid  101  and name C5' )
        (resid  101  and name C4')  (resid  101  and name C3' )   1.0    47.0 20.0 2
assign  (resid  101  and name C4' ) (resid  101  and name C3' )
        (resid  101  and name O3')  (resid  102  and name P   )   1.0  -152.0 20.0 2
assign  (resid  101  and name C3' ) (resid  101  and name O3' )
        (resid  102  and name P)    (resid  102  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  101  and name O3' ) (resid  102  and name P )
        (resid  102  and name O5')  (resid  102  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  102  and name P )   (resid  102  and name O5' )
        (resid  102  and name C5')  (resid  102  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  102  and name O5' ) (resid  102  and name C5' )
        (resid  102  and name C4')  (resid  102  and name C3' )   1.0    47.0 20.0 2
assign  (resid  102  and name C4' ) (resid  102  and name C3' )
        (resid  102  and name O3')  (resid  103  and name P )     1.0  -152.0 20.0 2
assign  (resid  102  and name C3' ) (resid  102  and name O3' )
        (resid  103  and name P)    (resid  103  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  102  and name O3' ) (resid  103  and name P )
        (resid  103  and name O5')  (resid  103  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  103  and name P )   (resid  103  and name O5' )
        (resid  103  and name C5')  (resid  103  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  103  and name O5' ) (resid  103  and name C5' )
        (resid  103  and name C4')  (resid  103  and name C3' )   1.0    47.0 20.0 2
assign  (resid  103  and name C4' ) (resid  103  and name C3' )
        (resid  103  and name O3')  (resid  104  and name P )     1.0  -152.0 20.0 2
assign  (resid  103  and name C3' ) (resid  103  and name O3' )
        (resid  104  and name P)    (resid  104  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  103  and name O3' ) (resid  104  and name P )
        (resid  104  and name O5')  (resid  104  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  104  and name P )   (resid  104  and name O5' )
        (resid  104  and name C5')  (resid  104  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  104  and name O5' ) (resid  104  and name C5' )
        (resid  104  and name C4')  (resid  104  and name C3' )   1.0    47.0 20.0 2
assign  (resid  104  and name C4' ) (resid  104  and name C3' )
        (resid  104  and name O3')  (resid  105  and name P )     1.0  -152.0 20.0 2
assign  (resid  104  and name C3' ) (resid  104  and name O3' )
        (resid  105  and name P)    (resid  105  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  104  and name O3' ) (resid  105  and name P )
        (resid  105  and name O5')  (resid  105  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  105  and name P )   (resid  105  and name O5' )
        (resid  105  and name C5')  (resid  105  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  105  and name O5' ) (resid  105  and name C5' )
        (resid  105  and name C4')  (resid  105  and name C3' )   1.0    47.0 20.0 2
assign  (resid  105  and name C4' ) (resid  105  and name C3' )
        (resid  105  and name O3')  (resid  106  and name P )     1.0  -152.0 20.0 2
assign  (resid  105  and name C3' ) (resid  105  and name O3' )
        (resid  106  and name P)    (resid  106  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  105  and name O3' ) (resid  106  and name P )
        (resid  106  and name O5')  (resid  106  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  106  and name P )   (resid  106  and name O5' )
        (resid  106  and name C5')  (resid  106  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  106  and name O5' ) (resid  106  and name C5' )
        (resid  106  and name C4')  (resid  106  and name C3' )   1.0    47.0 20.0 2
assign  (resid  106  and name C4' ) (resid  106  and name C3' )
        (resid  106  and name O3')  (resid  107  and name P )     1.0  -152.0 20.0 2
assign  (resid  106  and name C3' ) (resid  106  and name O3' ) 
        (resid  107  and name P)    (resid  107  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  106  and name O3' ) (resid  107  and name P )
        (resid  107  and name O5')  (resid  107  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  107  and name P )   (resid  107  and name O5' )
        (resid  107  and name C5')  (resid  107  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  107  and name O5' ) (resid  107  and name C5' )
        (resid  107  and name C4')  (resid  107  and name C3' )   1.0    47.0 20.0 2

assign  (resid  113  and name P )   (resid  113  and name O5' )
        (resid  113  and name C5')  (resid  113  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  113  and name O5' ) (resid  113  and name C5' )
        (resid  113  and name C4')  (resid  113  and name C3' )   1.0    47.0 20.0 2
assign  (resid  113  and name C4' ) (resid  113  and name C3' )
        (resid  113  and name O3')  (resid  114  and name P )     1.0  -152.0 20.0 2
assign  (resid  113  and name C3' ) (resid  113  and name O3' )
        (resid  114  and name P)    (resid  114  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  113  and name O3' ) (resid  114  and name P )
        (resid  114  and name O5')  (resid  114  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  114  and name P )   (resid  114  and name O5' )
        (resid  114  and name C5')  (resid  114  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  114  and name O5' ) (resid  114  and name C5' )
        (resid  114  and name C4')  (resid  114  and name C3' )   1.0    47.0 20.0 2
assign  (resid  114  and name C4' ) (resid  114  and name C3' )
        (resid  114 and name O3')   (resid  115  and name P )     1.0  -152.0 20.0 2
assign  (resid  114  and name C3' ) (resid  114  and name O3' )
        (resid  115  and name P)    (resid  115  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  114  and name O3' ) (resid  115 and name P )
        (resid  115  and name O5')  (resid  115  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  115  and name P )   (resid  115  and name O5' )
        (resid  115  and name C5')  (resid  115  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  115  and name O5' ) (resid  115  and name C5' )
        (resid  115  and name C4')  (resid  115  and name C3' )   1.0    47.0 20.0 2
assign  (resid  115  and name C4' ) (resid  115  and name C3' )
        (resid  115  and name O3')  (resid  116  and name P )     1.0  -152.0 20.0 2
assign  (resid  115  and name C3' ) (resid  115  and name O3' )
        (resid  116  and name P)    (resid  116  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  115  and name O3' ) (resid  116  and name P )
        (resid  116  and name O5')  (resid  116  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  116  and name P )   (resid  116  and name O5' )
        (resid  116  and name C5')  (resid  116  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  116  and name O5' ) (resid  116  and name C5' )
        (resid  116  and name C4')  (resid  116  and name C3' )   1.0    47.0 20.0 2
assign  (resid  116  and name C4' ) (resid  116  and name C3' )
        (resid  116  and name O3')  (resid  117  and name P )     1.0  -152.0 20.0 2
assign  (resid  116  and name C3' ) (resid  116  and name O3' ) 
        (resid  117  and name P)    (resid  117  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  116  and name O3' ) (resid  117  and name P )
        (resid  117  and name O5')  (resid  117  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  117  and name P )   (resid  117  and name O5' )
        (resid  117  and name C5')  (resid  117  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  117  and name O5' ) (resid  117  and name C5' )
        (resid  117  and name C4')  (resid  117  and name C3' )   1.0    47.0 20.0 2
assign  (resid  117  and name C4' ) (resid  117  and name C3' )
        (resid  117  and name O3')  (resid  118  and name P )     1.0  -152.0 20.0 2
assign  (resid  117  and name C3' ) (resid  117  and name O3' )
        (resid  118  and name P)    (resid  118  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  117  and name O3' ) (resid  118  and name P )
        (resid  118  and name O5')  (resid  118  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  118  and name P )   (resid  118  and name O5' )
        (resid  118  and name C5')  (resid  118  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  118  and name O5' ) (resid  118  and name C5' )
        (resid  118  and name C4')  (resid  118  and name C3' )   1.0    47.0 20.0 2
assign  (resid  118  and name C4' ) (resid  118  and name C3' )
        (resid  118  and name O3')  (resid  119  and name P )     1.0  -152.0 20.0 2
assign  (resid  118  and name C3' ) (resid  118  and name O3' )
        (resid  119  and name P)    (resid  119  and name O5' )   1.0   -74.0 20.0 2

assign  (resid  118  and name O3' ) (resid  119  and name P )
        (resid  119  and name O5')  (resid  119  and name C5' )   1.0   -62.0 20.0 2
assign  (resid  119  and name P )   (resid  119  and name O5' )
        (resid  119  and name C5')  (resid  119  and name C4' )   1.0  -180.0 20.0 2
assign  (resid  119  and name O5' ) (resid  119  and name C5' )
        (resid  119  and name C4')  (resid  119  and name C3' )   1.0    47.0 20.0 2
 
  Entry H atom name         Submitted Coord H atom name
    1   1H5*    G   1          H5'       GUA   1  72.944   6.512   9.589
    2   2H5*    G   1          H5''      GUA   1  71.547   6.093   8.575
    3    H4*    G   1           H4'      GUA   1  71.988   8.449   8.329
    4    H3*    G   1           H3'      GUA   1  72.679   6.741   5.948
    5    H2*    G   1          H2''      GUA   1  73.581   8.590   4.790
    6   2HO*    G   1          H2'       GUA   1  73.311  10.756   5.696
    7    H1*    G   1           H1'      GUA   1  74.925   9.742   6.844
    8    H8     G   1           H8       GUA   1  75.478   6.246   7.782
    9    H1     G   1           H1       GUA   1  78.703   7.708   2.458
   10   1H2     G   1          H21       GUA   1  77.963   9.627   1.614
   11   2H2     G   1          H22       GUA   1  76.676  10.546   2.363
   12    H5T    G   1           H5T      GUA   1  72.773   4.700   7.650
   13   1H5*    G   2          H5'       GUA   2  70.978   9.802   3.974
   14   2H5*    G   2          H5''      GUA   2  69.475   9.271   3.192
   15    H4*    G   2           H4'      GUA   2  70.759  10.402   1.529
   16    H3*    G   2           H3'      GUA   2  70.960   7.392   1.205
   17    H2*    G   2          H2''      GUA   2  72.231   7.782  -0.754
   18   2HO*    G   2          H2'       GUA   2  70.952  10.260  -0.675
   19    H1*    G   2           H1'      GUA   2  73.697   9.896   0.243
   20    H8     G   2           H8       GUA   2  73.437   7.301   2.960
   21    H1     G   2           H1       GUA   2  77.818   5.838  -1.467
   22   1H2     G   2          H21       GUA   2  77.613   7.194  -3.213
   23   2H2     G   2          H22       GUA   2  76.400   8.453  -3.286
   24   1H5*    A   3          H5'       ADE   3  70.142   8.879  -2.382
   25   2H5*    A   3          H5''      ADE   3  68.951   7.980  -3.341
   26    H4*    A   3           H4'      ADE   3  71.077   8.185  -4.544
   27    H3*    A   3           H3'      ADE   3  70.483   5.350  -3.610
   28    H2*    A   3          H2''      ADE   3  72.358   4.726  -4.948
   29   2HO*    A   3          H2'       ADE   3  73.362   6.280  -6.344
   30    H1*    A   3           H1'      ADE   3  73.918   6.883  -4.195
   31    H8     A   3           H8       ADE   3  72.161   5.602  -1.109
   32   1H6     A   3          H61       ADE   3  76.590   1.317  -0.693
   33   2H6     A   3          H62       ADE   3  75.244   2.078   0.127
   34    H2     A   3           H2       ADE   3  76.991   3.335  -4.690
   35   1H5*    G   4          H5'       GUA   4  70.551   5.068  -8.030
   36   2H5*    G   4          H5''      GUA   4  69.453   3.751  -8.484
   37    H4*    G   4           H4'      GUA   4  71.840   3.464  -9.243
   38    H3*    G   4           H3'      GUA   4  70.716   1.339  -7.372
   39    H2*    G   4          H2''      GUA   4  72.705   0.121  -7.933
   40   2HO*    G   4          H2'       GUA   4  73.592   0.360  -9.821
   41    H1*    G   4           H1'      GUA   4  74.357   2.309  -7.684
   42    H8     G   4           H8       GUA   4  71.799   2.605  -4.947
   43    H1     G   4           H1       GUA   4  76.261  -1.786  -3.664
   44   1H2     G   4          H21       GUA   4  77.459  -2.210  -5.470
   45   2H2     G   4          H22       GUA   4  77.173  -1.400  -6.995
   46   1H5*    G   5          H5'       GUA   5  71.767  -0.698 -10.828
   47   2H5*    G   5          H5''      GUA   5  70.766  -2.131 -11.130
   48    H4*    G   5           H4'      GUA   5  73.219  -2.590 -10.772
   49    H3*    G   5           H3'      GUA   5  71.234  -3.874  -8.859
   50    H2*    G   5          H2''      GUA   5  73.121  -5.078  -8.010
   51   2HO*    G   5          H2'       GUA   5  75.209  -4.748  -9.131
   52    H1*    G   5           H1'      GUA   5  74.825  -2.934  -8.029
   53    H8     G   5           H8       GUA   5  71.662  -1.449  -6.774
   54    H1     G   5           H1       GUA   5  74.415  -5.170  -2.372
   55   1H2     G   5          H22       GUA   5  76.001  -6.415  -3.291
   56   2H2     G   5          H21       GUA   5  76.385  -6.333  -4.996
   57   1H5*    C   6          H5'       CYT   6  72.996  -7.386 -10.760
   58   2H5*    C   6          H5''      CYT   6  71.690  -8.559 -11.026
   59    H4*    C   6           H4'      CYT   6  73.593  -9.414  -9.628
   60    H3*    C   6           H3'      CYT   6  70.794  -9.337  -8.480
   61    H2*    C   6          H2''      CYT   6  71.599 -10.177  -6.455
   62   2HO*    C   6          H2'       CYT   6  74.061 -10.904  -7.667
   63    H1*    C   6           H1'      CYT   6  74.106  -8.968  -6.485
   64   1H4     C   6          H41       CYT   6  70.535  -5.802  -2.248
   65   2H4     C   6          H42       CYT   6  70.004  -4.724  -3.519
   66    H5     C   6           H5       CYT   6  70.569  -5.050  -5.852
   67    H6     C   6           H6       CYT   6  71.684  -6.534  -7.449
   68   1H5*    U   7          H5'       URI   7  72.979 -13.061  -7.366
   69   2H5*    U   7          H5''      URI   7  71.952 -14.329  -8.064
   70    H4*    U   7           H4'      URI   7  72.650 -15.037  -5.871
   71    H3*    U   7           H3'      URI   7  69.751 -14.227  -6.062
   72    H2*    U   7          H2''      URI   7  69.456 -14.615  -3.755
   73   2HO*    U   7          H2'       URI   7  71.285 -16.505  -4.168
   74    H1*    U   7           H1'      URI   7  71.842 -13.598  -2.872
   75    H3     U   7           H3       URI   7  68.933 -10.423  -1.478
   76    H5     U   7           H5       URI   7  69.140  -9.844  -5.647
   77    H6     U   7           H6       URI   7  70.430 -11.901  -5.793
   78   1H5*    C   8          H5'       CYT   8  67.139 -18.864  -4.639
   79   2H5*    C   8          H5''      CYT   8  66.701 -17.223  -5.156
   80    H4*    C   8           H4'      CYT   8  67.734 -18.036  -2.428
   81    H3*    C   8           H3'      CYT   8  64.974 -17.637  -3.465
   82    H2*    C   8          H2''      CYT   8  64.562 -15.729  -2.254
   83   2HO*    C   8          H2'       CYT   8  64.524 -15.884  -0.083
   84    H1*    C   8           H1'      CYT   8  67.184 -15.614  -0.876
   85   1H4     C   8          H41       CYT   8  65.408  -9.571  -2.045
   86   2H4     C   8          H42       CYT   8  66.097  -9.720  -3.646
   87    H5     C   8           H5       CYT   8  66.962 -11.788  -4.523
   88    H6     C   8           H6       CYT   8  67.290 -14.174  -4.078
   89   1H5*    U   9          H5'       URI   9  66.057 -19.888   1.978
   90   2H5*    U   9          H5''      URI   9  64.336 -19.671   2.237
   91    H4*    U   9           H4'      URI   9  65.403 -18.599   4.056
   92    H3*    U   9           H3'      URI   9  63.912 -16.998   2.223
   93    H2*    U   9          H2''      URI   9  65.643 -15.545   1.637
   94   2HO*    U   9          H2'       URI   9  65.774 -13.832   3.083
   95    H1*    U   9           H1'      URI   9  67.017 -16.075   4.271
   96    H3     U   9           H3       URI   9  70.262 -13.296   2.766
   97    H5     U   9           H5       URI   9  70.077 -16.341  -0.141
   98    H6     U   9           H6       URI   9  68.116 -17.208   0.992
   99   1H5*    G  10          H5'       GUA  10  63.115 -12.740   4.008
  100   2H5*    G  10          H5''      GUA  10  62.153 -13.607   5.221
  101    H4*    G  10           H4'      GUA  10  60.832 -11.903   4.002
  102    H3*    G  10           H3'      GUA  10  59.902 -14.402   4.604
  103    H2*    G  10          H2''      GUA  10  60.376 -15.471   2.559
  104   2HO*    G  10          H2'       GUA  10  58.428 -15.868   1.887
  105    H1*    G  10           H1'      GUA  10  59.619 -13.089   0.898
  106    H8     G  10           H8       GUA  10  63.213 -14.231   1.426
  107    H1     G  10           H1       GUA  10  60.634 -16.512  -3.963
  108   1H2     G  10          H22       GUA  10  58.432 -16.044  -4.015
  109   2H2     G  10          H21       GUA  10  57.635 -15.202  -2.713
  110   1H5*    G  11          H5'       GUA  11  58.590  -9.601   6.104
  111   2H5*    G  11          H5''      GUA  11  59.218  -9.774   4.453
  112    H4*    G  11           H4'      GUA  11  61.125  -9.930   6.772
  113    H3*    G  11           H3'      GUA  11  59.531  -7.576   6.290
  114    H2*    G  11          H2''      GUA  11  60.770  -6.748   4.529
  115   2HO*    G  11          H2'       GUA  11  63.070  -6.199   5.734
  116    H1*    G  11           H1'      GUA  11  63.248  -8.245   5.367
  117    H8     G  11           H8       GUA  11  62.101  -5.971   2.895
  118    H1     G  11           H1       GUA  11  64.898 -10.893  -0.089
  119   1H2     G  11          H21       GUA  11  65.148 -12.599   1.305
  120   2H2     G  11          H22       GUA  11  64.616 -12.536   2.970
  121   1H5*    C  12          H5'       CYT  12  62.711  -6.618   9.046
  122   2H5*    C  12          H5''      CYT  12  62.633  -5.213  10.129
  123    H4*    C  12           H4'      CYT  12  62.285  -5.273   7.121
  124    H3*    C  12           H3'      CYT  12  64.552  -4.691   8.753
  125    H2*    C  12          H2''      CYT  12  64.002  -2.491   9.266
  126   2HO*    C  12          H2'       CYT  12  64.264  -1.690   6.625
  127    H1*    C  12           H1'      CYT  12  62.322  -2.187   6.784
  128   1H4     C  12          H41       CYT  12  58.947   1.591  10.861
  129   2H4     C  12          H42       CYT  12  60.487   2.394  11.080
  130    H5     C  12           H5       CYT  12  62.558   1.536  10.201
  131    H6     C  12           H6       CYT  12  63.604  -0.268   8.924
  132   1H5*    A  13          H5'       ADE  13  65.464  -6.770   7.658
  133   2H5*    A  13          H5''      ADE  13  67.039  -6.203   8.249
  134    H4*    A  13           H4'      ADE  13  67.115  -8.603   7.997
  135    H3*    A  13           H3'      ADE  13  68.688  -7.078   5.912
  136    H2*    A  13          H2''      ADE  13  69.332  -9.119   4.914
  137   2HO*    A  13          H2'       ADE  13  69.362 -11.022   5.969
  138    H1*    A  13           H1'      ADE  13  66.925 -10.427   5.186
  139    H8     A  13           H8       ADE  13  65.785  -7.061   4.167
  140   1H6     A  13          H62       ADE  13  67.583  -8.383  -1.600
  141   2H6     A  13          H61       ADE  13  66.681  -7.265  -0.601
  142    H2     A  13           H2       ADE  13  69.265 -11.518   1.121
  143   1H5*    G  14          H5'       GUA  14  71.570  -9.706   7.637
  144   2H5*    G  14          H5''      GUA  14  73.158  -8.932   7.810
  145    H4*    G  14           H4'      GUA  14  73.164 -10.979   6.364
  146    H3*    G  14           H3'      GUA  14  74.004  -8.324   5.165
  147    H2*    G  14          H2''      GUA  14  74.452  -9.443   3.126
  148   2HO*    G  14          H2'       GUA  14  74.947 -11.522   3.004
  149    H1*    G  14           H1'      GUA  14  72.260 -11.089   3.153
  150    H8     G  14           H8       GUA  14  71.085  -7.760   4.444
  151    H1     G  14           H1       GUA  14  71.826  -7.829  -1.915
  152   1H2     G  14          H22       GUA  14  72.913  -9.664  -2.526
  153   2H2     G  14          H21       GUA  14  73.450 -10.865  -1.373
  154   1H5*    C  15          H5'       CYT  15  76.834 -10.902   3.947
  155   2H5*    C  15          H5''      CYT  15  78.493 -10.314   4.175
  156    H4*    C  15           H4'      CYT  15  78.082 -10.940   1.838
  157    H3*    C  15           H3'      CYT  15  78.476  -7.971   2.333
  158    H2*    C  15          H2''      CYT  15  78.389  -7.675  -0.014
  159   2HO*    C  15          H2'       CYT  15  78.220 -10.244  -0.863
  160    H1*    C  15           H1'      CYT  15  76.413  -9.556  -0.491
  161   1H4     C  15          H42       CYT  15  73.436  -3.913  -0.521
  162   2H4     C  15          H41       CYT  15  73.327  -3.952   1.225
  163    H5     C  15           H5       CYT  15  74.340  -5.679   2.573
  164    H6     C  15           H6       CYT  15  75.721  -7.704   2.533
  165   1H5*    U  16          H5'       URI  16  80.612  -8.667  -0.797
  166   2H5*    U  16          H5''      URI  16  82.215  -7.908  -0.784
  167    H4*    U  16           H4'      URI  16  80.870  -7.136  -2.690
  168    H3*    U  16           H3'      URI  16  81.441  -5.036  -0.573
  169    H2*    U  16          H2''      URI  16  80.295  -3.502  -1.895
  170   2HO*    U  16          H2'       URI  16  80.000  -4.796  -4.248
  171    H1*    U  16           H1'      URI  16  78.549  -5.365  -3.141
  172    H3     U  16           H3       URI  16  75.819  -2.108  -1.498
  173    H5     U  16           H5       URI  16  76.948  -4.385   1.860
  174    H6     U  16           H6       URI  16  78.547  -5.542   0.458
  175   1H5*    U  17          H5'       URI  17  83.086  -4.109  -4.894
  176   2H5*    U  17          H5''      URI  17  84.559  -3.159  -4.621
  177    H4*    U  17           H4'      URI  17  83.189  -2.142  -6.373
  178    H3*    U  17           H3'      URI  17  83.306  -0.564  -3.781
  179    H2*    U  17          H2''      URI  17  82.080   1.148  -4.893
  180   2HO*    U  17          H2'       URI  17  81.656   0.971  -7.178
  181    H1*    U  17           H1'      URI  17  80.297  -0.540  -6.117
  182    H3     U  17           H3       URI  17  77.854   1.388  -2.799
  183    H5     U  17           H5       URI  17  80.188  -1.512  -0.830
  184    H6     U  17           H6       URI  17  81.382  -1.868  -2.924
  185   1H5*    U  18          H5'       URI  18  83.814   2.011  -6.533
  186   2H5*    U  18          H5''      URI  18  84.991   3.306  -6.239
  187    H4*    U  18           H4'      URI  18  82.639   4.112  -6.529
  188    H3*    U  18           H3'      URI  18  84.022   4.635  -3.880
  189    H2*    U  18          H2''      URI  18  82.107   5.760  -3.168
  190   2HO*    U  18          H2'       URI  18  81.632   6.149  -5.931
  191    H1*    U  18           H1'      URI  18  80.247   4.280  -4.714
  192    H3     U  18           H3       URI  18  78.839   4.121  -0.362
  193    H5     U  18           H5       URI  18  81.909   1.248  -0.666
  194    H6     U  18           H6       URI  18  82.415   2.115  -2.872
  195   1H5*    C  19          H5'       CYT  19  82.004   8.064  -5.185
  196   2H5*    C  19          H5''      CYT  19  83.248   9.266  -5.586
  197    H4*    C  19           H4'      CYT  19  81.672  10.583  -4.519
  198    H3*    C  19           H3'      CYT  19  83.607   9.608  -2.420
  199    H2*    C  19          H2''      CYT  19  82.354  10.612  -0.731
  200   2HO*    C  19          H2'       CYT  19  80.724  12.212  -1.259
  201    H1*    C  19           H1'      CYT  19  79.824  10.252  -1.863
  202   1H4     C  19          H42       CYT  19  80.015   5.744   2.582
  203   2H4     C  19          H41       CYT  19  81.306   4.906   1.750
  204    H5     C  19           H5       CYT  19  82.330   5.733  -0.265
  205    H6     C  19           H6       CYT  19  82.354   7.564  -1.899
  206    H3T    C  19           H3T      CYT  19  84.578  11.279  -3.240
  207    HA   ASN 443           HA       ASN 443  45.928 -12.686   8.410
  208   1HB   ASN 443          HB2       ASN 443  47.784 -12.650   6.744
  209   2HB   ASN 443          HB1       ASN 443  47.186 -14.172   6.085
  210   1HD2  ASN 443          HD21      ASN 443  47.256 -11.954   4.380
  211   2HD2  ASN 443          HD22      ASN 443  45.677 -11.407   4.079
  212    HA   PRO 444           HA       PRO 444  43.679 -16.903   8.161
  213   1HB   PRO 444          HB2       PRO 444  42.220 -16.543  10.473
  214   2HB   PRO 444          HB1       PRO 444  43.766 -17.412  10.405
  215   1HG   PRO 444          HG2       PRO 444  43.215 -14.592  11.211
  216   2HG   PRO 444          HG1       PRO 444  44.296 -15.785  11.954
  217   1HD   PRO 444          HD2       PRO 444  45.263 -13.838  10.357
  218   2HD   PRO 444          HD1       PRO 444  45.968 -15.472  10.350
  219    H    LYS 445           HN       LYS 445  42.742 -13.597   8.941
  220    HA   LYS 445           HA       LYS 445  39.948 -13.801   8.515
  221   1HB   LYS 445          HB2       LYS 445  41.146 -11.782   9.389
  222   2HB   LYS 445          HB1       LYS 445  41.748 -11.474   7.761
  223   1HG   LYS 445          HG2       LYS 445  39.447 -11.261   6.925
  224   2HG   LYS 445          HG1       LYS 445  38.814 -11.628   8.528
  225   1HD   LYS 445          HD2       LYS 445  39.990  -9.594   9.411
  226   2HD   LYS 445          HD1       LYS 445  40.484  -9.210   7.759
  227   1HE   LYS 445          HE2       LYS 445  37.612  -9.526   8.679
  228   2HE   LYS 445          HE1       LYS 445  38.426  -7.982   8.423
  229   1HZ   LYS 445          HZ1       LYS 445  38.053 -10.082   6.358
  230   2HZ   LYS 445          HZ2       LYS 445  38.775  -8.562   6.123
  231   3HZ   LYS 445          HZ3       LYS 445  37.120  -8.671   6.493
  232    H    SER 446           HN       SER 446  42.533 -13.032   6.164
  233    HA   SER 446           HA       SER 446  40.583 -13.330   3.959
  234   1HB   SER 446          HB2       SER 446  42.356 -12.498   2.540
  235   2HB   SER 446          HB1       SER 446  42.268 -11.480   3.976
  236    HG   SER 446           HG       SER 446  44.418 -12.283   3.311
  237    H    LEU 447           HN       LEU 447  43.423 -14.987   5.299
  238    HA   LEU 447           HA       LEU 447  43.740 -16.830   3.120
  239   1HB   LEU 447          HB2       LEU 447  45.323 -16.329   5.137
  240   2HB   LEU 447          HB1       LEU 447  44.394 -17.579   5.957
  241    HG   LEU 447           HG       LEU 447  44.849 -18.908   3.710
  242   1HD1  LEU 447          HD11      LEU 447  47.098 -18.361   2.812
  243   2HD1  LEU 447          HD12      LEU 447  47.175 -16.962   3.869
  244   3HD1  LEU 447          HD13      LEU 447  45.980 -17.025   2.571
  245   1HD2  LEU 447          HD21      LEU 447  46.806 -19.906   4.779
  246   2HD2  LEU 447          HD22      LEU 447  45.586 -19.532   5.998
  247   3HD2  LEU 447          HD23      LEU 447  46.992 -18.484   5.806
  248    H    THR 448           HN       THR 448  41.768 -16.926   6.090
  249    HA   THR 448           HA       THR 448  40.847 -19.647   5.468
  250    HB   THR 448           HB       THR 448  39.630 -17.775   7.498
  251    HG1  THR 448           HG1      THR 448  41.231 -18.699   8.915
  252   1HG2  THR 448          HG21      THR 448  38.503 -19.936   7.070
  253   2HG2  THR 448          HG22      THR 448  39.196 -19.886   8.691
  254   3HG2  THR 448          HG23      THR 448  40.010 -20.786   7.412
  255    H    ASP 449           HN       ASP 449  39.977 -16.471   4.552
  256    HA   ASP 449           HA       ASP 449  37.195 -16.604   4.343
  257   1HB   ASP 449          HB2       ASP 449  39.311 -15.040   3.134
  258   2HB   ASP 449          HB1       ASP 449  38.009 -15.339   1.984
  259    HA   PRO 450           HA       PRO 450  36.872 -20.143   1.576
  260   1HB   PRO 450          HB2       PRO 450  34.197 -19.952   1.007
  261   2HB   PRO 450          HB1       PRO 450  34.836 -20.629   2.518
  262   1HG   PRO 450          HG2       PRO 450  33.770 -17.900   1.977
  263   2HG   PRO 450          HG1       PRO 450  33.490 -18.962   3.364
  264   1HD   PRO 450          HD2       PRO 450  35.231 -16.908   3.477
  265   2HD   PRO 450          HD1       PRO 450  35.527 -18.427   4.360
  266    H    LYS 451           HN       LYS 451  35.624 -16.969   0.674
  267    HA   LYS 451           HA       LYS 451  35.352 -17.529  -2.138
  268   1HB   LYS 451          HB2       LYS 451  35.730 -14.952  -0.580
  269   2HB   LYS 451          HB1       LYS 451  35.483 -14.990  -2.326
  270   1HG   LYS 451          HG2       LYS 451  33.330 -16.152  -2.003
  271   2HG   LYS 451          HG1       LYS 451  33.576 -16.142  -0.258
  272   1HD   LYS 451          HD2       LYS 451  33.583 -13.667  -0.274
  273   2HD   LYS 451          HD1       LYS 451  33.336 -13.677  -2.022
  274   1HE   LYS 451          HE2       LYS 451  31.208 -14.945  -1.660
  275   2HE   LYS 451          HE1       LYS 451  31.448 -14.780   0.080
  276   1HZ   LYS 451          HZ1       LYS 451  31.467 -12.424  -1.695
  277   2HZ   LYS 451          HZ2       LYS 451  31.201 -12.488  -0.018
  278   3HZ   LYS 451          HZ3       LYS 451  30.011 -13.050  -1.093
  279    H    LEU 452           HN       LEU 452  37.945 -16.236  -0.093
  280    HA   LEU 452           HA       LEU 452  39.734 -15.828  -2.296
  281   1HB   LEU 452          HB2       LEU 452  39.972 -15.847   0.680
  282   2HB   LEU 452          HB1       LEU 452  41.453 -16.056  -0.252
  283    HG   LEU 452           HG       LEU 452  40.771 -13.643   0.373
  284   1HD1  LEU 452          HD11      LEU 452  42.475 -13.625  -1.149
  285   2HD1  LEU 452          HD12      LEU 452  41.200 -13.047  -2.215
  286   3HD1  LEU 452          HD13      LEU 452  41.665 -14.746  -2.234
  287   1HD2  LEU 452          HD21      LEU 452  39.027 -12.617  -0.749
  288   2HD2  LEU 452          HD22      LEU 452  38.354 -14.227  -0.563
  289   3HD2  LEU 452          HD23      LEU 452  39.081 -13.748  -2.096
  290    H    LEU 453           HN       LEU 453  39.259 -18.444   0.043
  291    HA   LEU 453           HA       LEU 453  41.398 -20.067  -0.941
  292   1HB   LEU 453          HB2       LEU 453  38.814 -20.812   0.444
  293   2HB   LEU 453          HB1       LEU 453  40.120 -21.960   0.123
  294    HG   LEU 453           HG       LEU 453  40.439 -19.388   1.698
  295   1HD1  LEU 453          HD11      LEU 453  39.461 -22.027   2.445
  296   2HD1  LEU 453          HD12      LEU 453  39.475 -20.533   3.382
  297   3HD1  LEU 453          HD13      LEU 453  40.897 -21.575   3.363
  298   1HD2  LEU 453          HD21      LEU 453  42.493 -21.105   2.365
  299   2HD2  LEU 453          HD22      LEU 453  42.626 -19.776   1.215
  300   3HD2  LEU 453          HD23      LEU 453  42.295 -21.414   0.640
  301    H    LYS 454           HN       LYS 454  38.013 -19.751  -1.908
  302    HA   LYS 454           HA       LYS 454  37.938 -21.954  -3.729
  303   1HB   LYS 454          HB2       LYS 454  35.950 -20.590  -2.957
  304   2HB   LYS 454          HB1       LYS 454  36.485 -19.304  -4.040
  305   1HG   LYS 454          HG2       LYS 454  36.368 -20.902  -5.946
  306   2HG   LYS 454          HG1       LYS 454  35.758 -22.137  -4.845
  307   1HD   LYS 454          HD2       LYS 454  33.870 -20.558  -4.260
  308   2HD   LYS 454          HD1       LYS 454  34.432 -19.514  -5.566
  309   1HE   LYS 454          HE2       LYS 454  34.186 -21.431  -7.153
  310   2HE   LYS 454          HE1       LYS 454  33.501 -22.382  -5.836
  311   1HZ   LYS 454          HZ1       LYS 454  31.586 -21.539  -6.619
  312   2HZ   LYS 454          HZ2       LYS 454  32.331 -20.194  -7.342
  313   3HZ   LYS 454          HZ3       LYS 454  32.010 -20.195  -5.674
  314    H    ASN 455           HN       ASN 455  38.917 -18.549  -4.130
  315    HA   ASN 455           HA       ASN 455  39.787 -19.131  -6.906
  316   1HB   ASN 455          HB2       ASN 455  39.502 -16.604  -5.288
  317   2HB   ASN 455          HB1       ASN 455  40.396 -16.623  -6.809
  318   1HD2  ASN 455          HD21      ASN 455  37.825 -15.228  -6.299
  319   2HD2  ASN 455          HD22      ASN 455  36.701 -15.895  -7.382
  320    H    ILE 456           HN       ILE 456  41.655 -20.350  -6.704
  321    HA   ILE 456           HA       ILE 456  43.671 -20.019  -4.765
  322    HB   ILE 456           HB       ILE 456  43.581 -21.268  -7.473
  323   1HG1  ILE 456          HG12      ILE 456  43.136 -22.356  -5.156
  324   2HG1  ILE 456          HG11      ILE 456  44.144 -23.217  -6.319
  325   1HG2  ILE 456          HG21      ILE 456  45.648 -20.207  -7.822
  326   2HG2  ILE 456          HG22      ILE 456  46.120 -21.736  -7.080
  327   3HG2  ILE 456          HG23      ILE 456  46.082 -20.275  -6.112
  328   1HD1  ILE 456          HD11      ILE 456  45.433 -21.330  -4.381
  329   2HD1  ILE 456          HD12      ILE 456  46.118 -22.737  -5.178
  330   3HD1  ILE 456          HD13      ILE 456  44.980 -22.943  -3.845
  331    HA   PRO 457           HA       PRO 457  45.809 -17.027  -8.030
  332   1HB   PRO 457          HB2       PRO 457  43.292 -15.726  -8.989
  333   2HB   PRO 457          HB1       PRO 457  44.796 -16.059  -9.872
  334   1HG   PRO 457          HG2       PRO 457  42.640 -17.522 -10.295
  335   2HG   PRO 457          HG1       PRO 457  44.246 -18.275 -10.232
  336   1HD   PRO 457          HD2       PRO 457  42.077 -18.271  -8.155
  337   2HD   PRO 457          HD1       PRO 457  43.201 -19.558  -8.618
  338    H    MET 458           HN       MET 458  42.635 -15.834  -6.807
  339    HA   MET 458           HA       MET 458  43.688 -13.382  -5.783
  340   1HB   MET 458          HB2       MET 458  41.253 -14.982  -4.980
  341   2HB   MET 458          HB1       MET 458  41.605 -13.356  -4.391
  342   1HG   MET 458          HG2       MET 458  41.626 -12.522  -6.725
  343   2HG   MET 458          HG1       MET 458  41.212 -14.143  -7.287
  344   1HE   MET 458          HE1       MET 458  39.667 -12.483  -8.470
  345   2HE   MET 458          HE2       MET 458  39.354 -11.076  -7.456
  346   3HE   MET 458          HE3       MET 458  38.024 -12.139  -7.913
  347    H    TRP 459           HN       TRP 459  43.255 -16.598  -4.372
  348    HA   TRP 459           HA       TRP 459  43.995 -15.941  -1.703
  349   1HB   TRP 459          HB2       TRP 459  43.096 -18.162  -2.471
  350   2HB   TRP 459          HB1       TRP 459  44.676 -18.510  -3.171
  351    HD1  TRP 459           HD1      TRP 459  43.484 -17.142   0.255
  352    HE1  TRP 459           HE1      TRP 459  44.769 -18.393   2.097
  353    HE3  TRP 459           HE3      TRP 459  46.317 -20.275  -2.608
  354    HZ2  TRP 459           HZ2      TRP 459  46.723 -20.479   2.333
  355    HZ3  TRP 459           HZ3      TRP 459  47.871 -21.887  -1.552
  356    HH2  TRP 459           HH2      TRP 459  48.080 -21.985   0.916
  357    H    LEU 460           HN       LEU 460  45.993 -16.895  -4.501
  358    HA   LEU 460           HA       LEU 460  48.497 -16.698  -3.117
  359   1HB   LEU 460          HB2       LEU 460  47.598 -16.877  -5.931
  360   2HB   LEU 460          HB1       LEU 460  49.187 -16.182  -5.665
  361    HG   LEU 460           HG       LEU 460  49.168 -18.703  -5.977
  362   1HD1  LEU 460          HD11      LEU 460  50.553 -17.063  -4.100
  363   2HD1  LEU 460          HD12      LEU 460  51.123 -18.545  -4.868
  364   3HD1  LEU 460          HD13      LEU 460  50.260 -18.622  -3.332
  365   1HD2  LEU 460          HD21      LEU 460  48.102 -20.089  -4.487
  366   2HD2  LEU 460          HD22      LEU 460  47.035 -18.697  -4.318
  367   3HD2  LEU 460          HD23      LEU 460  48.315 -18.973  -3.140
  368    H    LYS 461           HN       LYS 461  46.583 -14.379  -5.009
  369    HA   LYS 461           HA       LYS 461  48.475 -12.240  -4.955
  370   1HB   LYS 461          HB2       LYS 461  45.445 -12.200  -5.000
  371   2HB   LYS 461          HB1       LYS 461  46.439 -10.762  -5.193
  372   1HG   LYS 461          HG2       LYS 461  47.505 -11.717  -7.174
  373   2HG   LYS 461          HG1       LYS 461  46.593 -13.211  -6.973
  374   1HD   LYS 461          HD2       LYS 461  44.483 -11.940  -7.254
  375   2HD   LYS 461          HD1       LYS 461  45.411 -10.467  -7.488
  376   1HE   LYS 461          HE2       LYS 461  45.752 -12.934  -9.208
  377   2HE   LYS 461          HE1       LYS 461  44.661 -11.611  -9.622
  378   1HZ   LYS 461          HZ1       LYS 461  46.746 -10.166  -9.222
  379   2HZ   LYS 461          HZ2       LYS 461  46.588 -11.008 -10.689
  380   3HZ   LYS 461          HZ3       LYS 461  47.598 -11.612  -9.464
  381    H    SER 462           HN       SER 462  45.996 -13.271  -2.615
  382    HA   SER 462           HA       SER 462  46.275 -11.066  -0.832
  383   1HB   SER 462          HB2       SER 462  44.474 -12.574  -0.424
  384   2HB   SER 462          HB1       SER 462  45.550 -13.968  -0.393
  385    HG   SER 462           HG       SER 462  45.945 -13.573   1.628
  386    H    LEU 463           HN       LEU 463  48.035 -14.158  -1.031
  387    HA   LEU 463           HA       LEU 463  49.786 -13.629   1.195
  388   1HB   LEU 463          HB2       LEU 463  50.123 -15.443  -1.208
  389   2HB   LEU 463          HB1       LEU 463  51.211 -15.419   0.181
  390    HG   LEU 463           HG       LEU 463  48.228 -15.898   0.384
  391   1HD1  LEU 463          HD11      LEU 463  48.668 -18.221   0.492
  392   2HD1  LEU 463          HD12      LEU 463  50.404 -17.966   0.679
  393   3HD1  LEU 463          HD13      LEU 463  49.628 -17.654  -0.874
  394   1HD2  LEU 463          HD21      LEU 463  49.501 -17.007   2.578
  395   2HD2  LEU 463          HD22      LEU 463  48.686 -15.444   2.564
  396   3HD2  LEU 463          HD23      LEU 463  50.428 -15.531   2.306
  397    H    ARG 464           HN       ARG 464  49.898 -12.903  -2.244
  398    HA   ARG 464           HA       ARG 464  51.084 -11.051  -3.214
  399   1HB   ARG 464          HB2       ARG 464  51.706 -10.423  -0.733
  400   2HB   ARG 464          HB1       ARG 464  53.218 -11.246  -1.103
  401   1HG   ARG 464          HG2       ARG 464  53.551  -8.933  -1.615
  402   2HG   ARG 464          HG1       ARG 464  53.399  -9.775  -3.156
  403   1HD   ARG 464          HD2       ARG 464  51.557  -8.609  -3.695
  404   2HD   ARG 464          HD1       ARG 464  50.792  -8.964  -2.154
  405    HE   ARG 464           HE       ARG 464  52.061  -6.494  -2.932
  406   1HH1  ARG 464          HH21      ARG 464  51.823  -8.680  -0.267
  407   2HH1  ARG 464          HH22      ARG 464  52.315  -7.498   0.901
  408   1HH2  ARG 464          HH11      ARG 464  52.688  -4.962  -1.430
  409   2HH2  ARG 464          HH12      ARG 464  52.801  -5.395   0.242
  410    H    LEU 465           HN       LEU 465  51.512 -14.131  -3.040
  411    HA   LEU 465           HA       LEU 465  54.238 -14.203  -4.261
  412   1HB   LEU 465          HB2       LEU 465  52.556 -16.505  -3.233
  413   2HB   LEU 465          HB1       LEU 465  54.217 -16.602  -3.810
  414    HG   LEU 465           HG       LEU 465  53.290 -14.960  -1.438
  415   1HD1  LEU 465          HD11      LEU 465  55.174 -17.007  -0.781
  416   2HD1  LEU 465          HD12      LEU 465  53.854 -17.746  -1.687
  417   3HD1  LEU 465          HD13      LEU 465  53.511 -16.832  -0.219
  418   1HD2  LEU 465          HD21      LEU 465  55.825 -15.191  -2.958
  419   2HD2  LEU 465          HD22      LEU 465  55.985 -15.228  -1.201
  420   3HD2  LEU 465          HD23      LEU 465  55.215 -13.851  -1.989
  421    H    HIS 466           HN       HIS 466  51.551 -13.425  -5.481
  422    HA   HIS 466           HA       HIS 466  50.386 -15.200  -7.194
  423   1HB   HIS 466          HB2       HIS 466  50.727 -13.210  -8.970
  424   2HB   HIS 466          HB1       HIS 466  49.566 -13.118  -7.646
  425    HD1  HIS 466           HD1      HIS 466  49.836 -10.548  -7.386
  426    HD2  HIS 466           HD2      HIS 466  53.390 -12.668  -6.869
  427    HE1  HIS 466           HE1      HIS 466  51.505  -8.920  -6.393
  428    HE2  HIS 466           HE2      HIS 466  53.671 -10.201  -6.075
  429    H    LYS 467           HN       LYS 467  53.722 -14.386  -7.180
  430    HA   LYS 467           HA       LYS 467  54.554 -14.872  -9.806
  431   1HB   LYS 467          HB2       LYS 467  56.082 -14.261  -7.934
  432   2HB   LYS 467          HB1       LYS 467  55.883 -15.881  -7.261
  433   1HG   LYS 467          HG2       LYS 467  56.831 -16.863  -9.300
  434   2HG   LYS 467          HG1       LYS 467  56.994 -15.260 -10.016
  435   1HD   LYS 467          HD2       LYS 467  58.535 -14.610  -8.186
  436   2HD   LYS 467          HD1       LYS 467  58.385 -16.227  -7.497
  437   1HE   LYS 467          HE2       LYS 467  60.414 -16.139  -8.841
  438   2HE   LYS 467          HE1       LYS 467  59.236 -17.169  -9.657
  439   1HZ   LYS 467          HZ1       LYS 467  58.927 -14.440 -10.399
  440   2HZ   LYS 467          HZ2       LYS 467  59.179 -15.801 -11.383
  441   3HZ   LYS 467          HZ3       LYS 467  60.505 -14.977 -10.714
  442    H    TYR 468           HN       TYR 468  53.738 -17.243  -7.267
  443    HA   TYR 468           HA       TYR 468  54.208 -19.455  -9.155
  444   1HB   TYR 468          HB2       TYR 468  52.962 -19.749  -6.429
  445   2HB   TYR 468          HB1       TYR 468  53.965 -20.891  -7.316
  446    HD1  TYR 468           HD1      TYR 468  54.037 -18.909  -4.552
  447    HD2  TYR 468           HD2      TYR 468  56.303 -19.555  -8.145
  448    HE1  TYR 468           HE1      TYR 468  56.055 -17.990  -3.446
  449    HE2  TYR 468           HE2      TYR 468  58.325 -18.640  -7.035
  450    HH   TYR 468           HH       TYR 468  58.942 -17.251  -5.198
  451    H    SER 469           HN       SER 469  51.609 -17.403  -8.292
  452    HA   SER 469           HA       SER 469  49.370 -19.113  -8.388
  453   1HB   SER 469          HB2       SER 469  48.995 -16.822  -7.877
  454   2HB   SER 469          HB1       SER 469  49.737 -16.289  -9.382
  455    HG   SER 469           HG       SER 469  48.017 -17.087 -10.505
  456    H    ASP 470           HN       ASP 470  51.317 -17.860 -11.046
  457    HA   ASP 470           HA       ASP 470  49.572 -18.679 -13.163
  458   1HB   ASP 470          HB2       ASP 470  51.592 -17.140 -13.343
  459   2HB   ASP 470          HB1       ASP 470  52.594 -18.591 -13.290
  460    H    ALA 471           HN       ALA 471  51.884 -20.430 -11.165
  461    HA   ALA 471           HA       ALA 471  51.601 -22.822 -12.924
  462   1HB   ALA 471          HB1       ALA 471  53.280 -23.538 -10.856
  463   2HB   ALA 471          HB2       ALA 471  53.630 -21.821 -11.059
  464   3HB   ALA 471          HB3       ALA 471  53.803 -22.925 -12.424
  465    H    LEU 472           HN       LEU 472  51.260 -21.907  -9.486
  466    HA   LEU 472           HA       LEU 472  50.193 -24.417  -8.629
  467   1HB   LEU 472          HB2       LEU 472  49.899 -21.629  -7.497
  468   2HB   LEU 472          HB1       LEU 472  49.314 -23.080  -6.679
  469    HG   LEU 472           HG       LEU 472  52.186 -22.616  -7.541
  470   1HD1  LEU 472          HD11      LEU 472  51.086 -22.661  -4.726
  471   2HD1  LEU 472          HD12      LEU 472  51.264 -21.164  -5.641
  472   3HD1  LEU 472          HD13      LEU 472  52.684 -22.139  -5.260
  473   1HD2  LEU 472          HD21      LEU 472  50.670 -24.914  -6.446
  474   2HD2  LEU 472          HD22      LEU 472  52.203 -24.578  -5.640
  475   3HD2  LEU 472          HD23      LEU 472  52.171 -24.894  -7.374
  476    H    SER 473           HN       SER 473  48.621 -21.487  -9.870
  477    HA   SER 473           HA       SER 473  45.942 -22.123  -9.292
  478   1HB   SER 473          HB2       SER 473  45.362 -20.747 -11.258
  479   2HB   SER 473          HB1       SER 473  46.630 -19.986 -10.304
  480    HG   SER 473           HG       SER 473  47.144 -21.696 -12.509
  481    H    GLY 474           HN       GLY 474  44.289 -23.104 -10.661
  482   1HA   GLY 474          HA2       GLY 474  43.600 -24.541 -12.485
  483   2HA   GLY 474          HA1       GLY 474  45.287 -25.001 -12.723
  484    H    THR 475           HN       THR 475  45.094 -25.096  -9.510
  485    HA   THR 475           HA       THR 475  43.880 -27.809  -9.394
  486    HB   THR 475           HB       THR 475  46.376 -27.184  -7.828
  487    HG1  THR 475           HG1      THR 475  47.518 -27.178  -9.568
  488   1HG2  THR 475          HG21      THR 475  46.698 -29.673  -8.255
  489   2HG2  THR 475          HG22      THR 475  45.075 -29.685  -8.937
  490   3HG2  THR 475          HG23      THR 475  45.324 -29.247  -7.242
  491    HA   PRO 476           HA       PRO 476  41.830 -25.882  -5.922
  492   1HB   PRO 476          HB2       PRO 476  40.861 -28.108  -4.672
  493   2HB   PRO 476          HB1       PRO 476  40.172 -27.454  -6.173
  494   1HG   PRO 476          HG2       PRO 476  42.097 -29.704  -5.800
  495   2HG   PRO 476          HG1       PRO 476  40.659 -29.614  -6.836
  496   1HD   PRO 476          HD2       PRO 476  43.144 -29.261  -7.825
  497   2HD   PRO 476          HD1       PRO 476  41.754 -28.365  -8.475
  498    H    TRP 477           HN       TRP 477  42.175 -25.413  -3.755
  499    HA   TRP 477           HA       TRP 477  44.762 -25.994  -2.697
  500   1HB   TRP 477          HB2       TRP 477  44.031 -24.801  -0.698
  501   2HB   TRP 477          HB1       TRP 477  43.487 -23.934  -2.135
  502    HD1  TRP 477           HD1      TRP 477  40.872 -24.432  -2.882
  503    HE1  TRP 477           HE1      TRP 477  38.813 -24.807  -1.377
  504    HE3  TRP 477           HE3      TRP 477  43.188 -25.658   1.499
  505    HZ2  TRP 477           HZ2      TRP 477  38.230 -25.529   1.329
  506    HZ3  TRP 477           HZ3      TRP 477  41.862 -26.186   3.520
  507    HH2  TRP 477           HH2      TRP 477  39.385 -26.123   3.442
  508    H    ILE 478           HN       ILE 478  41.703 -27.589  -2.463
  509    HA   ILE 478           HA       ILE 478  42.067 -29.014  -0.018
  510    HB   ILE 478           HB       ILE 478  40.552 -29.727  -2.546
  511   1HG1  ILE 478          HG12      ILE 478  39.525 -28.817   0.155
  512   2HG1  ILE 478          HG11      ILE 478  39.826 -27.715  -1.186
  513   1HG2  ILE 478          HG21      ILE 478  40.689 -31.115   0.131
  514   2HG2  ILE 478          HG22      ILE 478  40.970 -31.806  -1.467
  515   3HG2  ILE 478          HG23      ILE 478  39.340 -31.334  -0.984
  516   1HD1  ILE 478          HD11      ILE 478  38.273 -29.985  -2.091
  517   2HD1  ILE 478          HD12      ILE 478  37.867 -28.271  -2.153
  518   3HD1  ILE 478          HD13      ILE 478  37.482 -29.214  -0.714
  519    H    GLU 479           HN       GLU 479  42.969 -29.813  -3.369
  520    HA   GLU 479           HA       GLU 479  44.389 -32.213  -2.403
  521   1HB   GLU 479          HB2       GLU 479  43.166 -32.295  -4.564
  522   2HB   GLU 479          HB1       GLU 479  44.221 -31.030  -5.194
  523   1HG   GLU 479          HG2       GLU 479  46.176 -32.464  -4.913
  524   2HG   GLU 479          HG1       GLU 479  45.185 -33.717  -4.164
  525    H    LEU 480           HN       LEU 480  45.034 -28.924  -3.491
  526    HA   LEU 480           HA       LEU 480  47.835 -29.171  -3.908
  527   1HB   LEU 480          HB2       LEU 480  46.159 -27.092  -4.160
  528   2HB   LEU 480          HB1       LEU 480  46.810 -26.734  -2.556
  529    HG   LEU 480           HG       LEU 480  49.134 -27.135  -3.633
  530   1HD1  LEU 480          HD11      LEU 480  47.942 -26.212  -6.187
  531   2HD1  LEU 480          HD12      LEU 480  47.665 -27.907  -5.792
  532   3HD1  LEU 480          HD13      LEU 480  49.312 -27.286  -5.910
  533   1HD2  LEU 480          HD21      LEU 480  47.959 -24.893  -2.982
  534   2HD2  LEU 480          HD22      LEU 480  47.696 -24.716  -4.716
  535   3HD2  LEU 480          HD23      LEU 480  49.337 -24.830  -4.078
  536    H    ILE 481           HN       ILE 481  45.987 -28.509  -0.894
  537    HA   ILE 481           HA       ILE 481  48.299 -28.131   0.734
  538    HB   ILE 481           HB       ILE 481  46.837 -28.723   2.632
  539   1HG1  ILE 481          HG12      ILE 481  44.828 -29.412   0.487
  540   2HG1  ILE 481          HG11      ILE 481  45.684 -30.604   1.440
  541   1HG2  ILE 481          HG21      ILE 481  46.218 -26.573   2.306
  542   2HG2  ILE 481          HG22      ILE 481  44.812 -27.213   1.460
  543   3HG2  ILE 481          HG23      ILE 481  46.253 -26.763   0.553
  544   1HD1  ILE 481          HD11      ILE 481  44.210 -28.426   2.866
  545   2HD1  ILE 481          HD12      ILE 481  44.544 -30.076   3.383
  546   3HD1  ILE 481          HD13      ILE 481  43.294 -29.763   2.177
  547    H    TYR 482           HN       TYR 482  47.182 -30.938  -0.859
  548    HA   TYR 482           HA       TYR 482  48.446 -32.800   1.060
  549   1HB   TYR 482          HB2       TYR 482  46.724 -33.041  -1.340
  550   2HB   TYR 482          HB1       TYR 482  47.857 -34.356  -1.069
  551    HD1  TYR 482           HD1      TYR 482  44.789 -32.754   0.032
  552    HD2  TYR 482           HD2      TYR 482  47.850 -35.547   1.137
  553    HE1  TYR 482           HE1      TYR 482  43.309 -33.670   1.799
  554    HE2  TYR 482           HE2      TYR 482  46.376 -36.467   2.904
  555    HH   TYR 482           HH       TYR 482  43.474 -34.909   3.871
  556    H    LEU 483           HN       LEU 483  49.618 -30.762  -1.261
  557    HA   LEU 483           HA       LEU 483  51.515 -32.614  -2.510
  558   1HB   LEU 483          HB2       LEU 483  51.332 -29.582  -2.550
  559   2HB   LEU 483          HB1       LEU 483  52.483 -30.521  -3.497
  560    HG   LEU 483           HG       LEU 483  49.458 -30.842  -3.646
  561   1HD1  LEU 483          HD11      LEU 483  49.463 -29.565  -5.612
  562   2HD1  LEU 483          HD12      LEU 483  51.208 -29.719  -5.827
  563   3HD1  LEU 483          HD13      LEU 483  50.562 -28.657  -4.573
  564   1HD2  LEU 483          HD21      LEU 483  50.242 -32.866  -4.395
  565   2HD2  LEU 483          HD22      LEU 483  51.819 -32.217  -4.833
  566   3HD2  LEU 483          HD23      LEU 483  50.434 -31.952  -5.890
  567    H    ASP 484           HN       ASP 484  53.676 -32.891  -1.936
  568    HA   ASP 484           HA       ASP 484  54.433 -31.927   0.748
  569   1HB   ASP 484          HB2       ASP 484  55.651 -33.910  -1.182
  570   2HB   ASP 484          HB1       ASP 484  56.481 -33.410   0.291
  571    H    ASP 485           HN       ASP 485  56.709 -31.071   1.045
  572    HA   ASP 485           HA       ASP 485  57.132 -28.740  -0.555
  573   1HB   ASP 485          HB2       ASP 485  58.722 -30.205   1.533
  574   2HB   ASP 485          HB1       ASP 485  59.499 -28.913   0.620
  575    H    GLU 486           HN       GLU 486  58.532 -31.994  -0.712
  576    HA   GLU 486           HA       GLU 486  60.558 -31.361  -2.657
  577   1HB   GLU 486          HB2       GLU 486  59.086 -33.956  -2.071
  578   2HB   GLU 486          HB1       GLU 486  60.486 -33.831  -3.136
  579   1HG   GLU 486          HG2       GLU 486  61.857 -32.989  -1.283
  580   2HG   GLU 486          HG1       GLU 486  60.455 -33.025  -0.210
  581    H    THR 487           HN       THR 487  57.174 -32.447  -2.912
  582    HA   THR 487           HA       THR 487  57.136 -32.608  -5.776
  583    HB   THR 487           HB       THR 487  54.868 -31.988  -3.856
  584    HG1  THR 487           HG1      THR 487  54.507 -34.211  -4.018
  585   1HG2  THR 487          HG21      THR 487  53.940 -31.452  -5.906
  586   2HG2  THR 487          HG22      THR 487  53.665 -33.194  -5.901
  587   3HG2  THR 487          HG23      THR 487  55.028 -32.518  -6.794
  588    H    LEU 488           HN       LEU 488  56.372 -29.988  -3.466
  589    HA   LEU 488           HA       LEU 488  55.602 -28.066  -5.446
  590   1HB   LEU 488          HB2       LEU 488  56.918 -27.682  -2.740
  591   2HB   LEU 488          HB1       LEU 488  56.257 -26.364  -3.714
  592    HG   LEU 488           HG       LEU 488  54.673 -28.784  -2.820
  593   1HD1  LEU 488          HD11      LEU 488  55.546 -26.874  -1.124
  594   2HD1  LEU 488          HD12      LEU 488  53.974 -27.653  -0.963
  595   3HD1  LEU 488          HD13      LEU 488  54.101 -26.076  -1.743
  596   1HD2  LEU 488          HD21      LEU 488  54.164 -26.501  -4.613
  597   2HD2  LEU 488          HD22      LEU 488  52.922 -26.735  -3.384
  598   3HD2  LEU 488          HD23      LEU 488  53.325 -28.048  -4.490
  599    H    GLU 489           HN       GLU 489  58.781 -28.871  -4.038
  600    HA   GLU 489           HA       GLU 489  60.245 -26.865  -5.468
  601   1HB   GLU 489          HB2       GLU 489  61.191 -28.096  -3.552
  602   2HB   GLU 489          HB1       GLU 489  61.173 -29.582  -4.502
  603   1HG   GLU 489          HG2       GLU 489  62.715 -28.607  -6.124
  604   2HG   GLU 489          HG1       GLU 489  62.688 -27.068  -5.262
  605    H    LYS 490           HN       LYS 490  59.490 -30.274  -6.246
  606    HA   LYS 490           HA       LYS 490  60.929 -30.311  -8.722
  607   1HB   LYS 490          HB2       LYS 490  60.121 -32.370  -7.626
  608   2HB   LYS 490          HB1       LYS 490  58.456 -31.889  -7.953
  609   1HG   LYS 490          HG2       LYS 490  58.839 -31.976 -10.349
  610   2HG   LYS 490          HG1       LYS 490  60.559 -32.281 -10.103
  611   1HD   LYS 490          HD2       LYS 490  60.018 -34.405  -8.967
  612   2HD   LYS 490          HD1       LYS 490  58.300 -34.110  -9.224
  613   1HE   LYS 490          HE2       LYS 490  58.694 -34.104 -11.680
  614   2HE   LYS 490          HE1       LYS 490  60.399 -34.457 -11.392
  615   1HZ   LYS 490          HZ1       LYS 490  58.543 -36.332 -11.751
  616   2HZ   LYS 490          HZ2       LYS 490  58.504 -36.202 -10.057
  617   3HZ   LYS 490          HZ3       LYS 490  59.958 -36.581 -10.849
  618    H    LYS 491           HN       LYS 491  57.587 -29.426  -7.925
  619    HA   LYS 491           HA       LYS 491  56.746 -28.956 -10.630
  620   1HB   LYS 491          HB2       LYS 491  55.166 -29.235  -8.748
  621   2HB   LYS 491          HB1       LYS 491  55.727 -27.718  -8.048
  622   1HG   LYS 491          HG2       LYS 491  54.949 -26.493 -10.034
  623   2HG   LYS 491          HG1       LYS 491  54.440 -28.007 -10.784
  624   1HD   LYS 491          HD2       LYS 491  52.882 -28.370  -8.834
  625   2HD   LYS 491          HD1       LYS 491  53.319 -26.762  -8.256
  626   1HE   LYS 491          HE2       LYS 491  52.402 -25.713 -10.203
  627   2HE   LYS 491          HE1       LYS 491  52.215 -27.263 -11.027
  628   1HZ   LYS 491          HZ1       LYS 491  50.110 -26.871 -10.216
  629   2HZ   LYS 491          HZ2       LYS 491  50.668 -26.158  -8.778
  630   3HZ   LYS 491          HZ3       LYS 491  50.771 -27.840  -8.992
  631    H    GLY 492           HN       GLY 492  58.069 -26.802  -8.108
  632   1HA   GLY 492          HA2       GLY 492  59.605 -25.211  -9.764
  633   2HA   GLY 492          HA1       GLY 492  57.996 -24.500  -9.836
  634    H    VAL 493           HN       VAL 493  58.096 -22.719  -8.572
  635    HA   VAL 493           HA       VAL 493  58.851 -21.301  -6.804
  636    HB   VAL 493           HB       VAL 493  56.649 -22.006  -6.104
  637   1HG1  VAL 493          HG11      VAL 493  56.748 -24.374  -6.325
  638   2HG1  VAL 493          HG12      VAL 493  56.438 -24.049  -4.618
  639   3HG1  VAL 493          HG13      VAL 493  58.060 -24.496  -5.149
  640   1HG2  VAL 493          HG21      VAL 493  58.705 -21.400  -4.214
  641   2HG2  VAL 493          HG22      VAL 493  57.649 -22.615  -3.492
  642   3HG2  VAL 493          HG23      VAL 493  56.977 -21.096  -4.076
  643    H    LEU 494           HN       LEU 494  61.159 -22.338  -7.365
  644    HA   LEU 494           HA       LEU 494  62.256 -24.192  -5.492
  645   1HB   LEU 494          HB2       LEU 494  63.466 -22.154  -7.339
  646   2HB   LEU 494          HB1       LEU 494  64.478 -23.013  -6.181
  647    HG   LEU 494           HG       LEU 494  63.471 -25.179  -7.119
  648   1HD1  LEU 494          HD11      LEU 494  62.632 -23.244  -9.300
  649   2HD1  LEU 494          HD12      LEU 494  61.537 -24.131  -8.240
  650   3HD1  LEU 494          HD13      LEU 494  62.537 -25.002  -9.400
  651   1HD2  LEU 494          HD21      LEU 494  64.815 -24.535  -9.444
  652   2HD2  LEU 494          HD22      LEU 494  65.584 -25.066  -7.948
  653   3HD2  LEU 494          HD23      LEU 494  65.441 -23.345  -8.304
  654    H    ALA 495           HN       ALA 495  62.077 -20.621  -5.428
  655    HA   ALA 495           HA       ALA 495  63.687 -19.864  -3.400
  656   1HB   ALA 495          HB1       ALA 495  62.238 -18.245  -4.190
  657   2HB   ALA 495          HB2       ALA 495  61.588 -18.528  -2.576
  658   3HB   ALA 495          HB3       ALA 495  60.824 -19.265  -3.990
  659    H    LEU 496           HN       LEU 496  64.255 -21.021  -1.638
  660    HA   LEU 496           HA       LEU 496  62.597 -22.936  -0.330
  661   1HB   LEU 496          HB2       LEU 496  65.033 -22.973  -0.082
  662   2HB   LEU 496          HB1       LEU 496  64.990 -21.404   0.720
  663    HG   LEU 496           HG       LEU 496  63.582 -22.378   2.518
  664   1HD1  LEU 496          HD11      LEU 496  63.765 -25.054   2.403
  665   2HD1  LEU 496          HD12      LEU 496  63.712 -24.708   0.674
  666   3HD1  LEU 496          HD13      LEU 496  62.399 -24.171   1.723
  667   1HD2  LEU 496          HD21      LEU 496  66.244 -23.685   1.927
  668   2HD2  LEU 496          HD22      LEU 496  65.351 -24.008   3.415
  669   3HD2  LEU 496          HD23      LEU 496  65.892 -22.366   3.051
  670    H    GLY 497           HN       GLY 497  63.349 -19.530   0.364
  671   1HA   GLY 497          HA2       GLY 497  61.848 -19.251   2.750
  672   2HA   GLY 497          HA1       GLY 497  62.068 -17.961   1.558
  673    H    ALA 498           HN       ALA 498  60.760 -18.812  -0.647
  674    HA   ALA 498           HA       ALA 498  58.022 -18.330  -0.059
  675   1HB   ALA 498          HB1       ALA 498  57.596 -19.237  -2.368
  676   2HB   ALA 498          HB2       ALA 498  59.291 -19.694  -2.447
  677   3HB   ALA 498          HB3       ALA 498  58.845 -17.994  -2.315
  678    H    ARG 499           HN       ARG 499  59.797 -21.376  -0.553
  679    HA   ARG 499           HA       ARG 499  57.507 -23.085  -0.326
  680   1HB   ARG 499          HB2       ARG 499  60.450 -23.499   0.170
  681   2HB   ARG 499          HB1       ARG 499  59.289 -24.800   0.421
  682   1HG   ARG 499          HG2       ARG 499  58.490 -24.473  -1.925
  683   2HG   ARG 499          HG1       ARG 499  59.746 -23.259  -2.156
  684   1HD   ARG 499          HD2       ARG 499  60.329 -26.108  -1.308
  685   2HD   ARG 499          HD1       ARG 499  60.340 -25.579  -2.985
  686    HE   ARG 499           HE       ARG 499  62.026 -23.792  -1.689
  687   1HH1  ARG 499          HH21      ARG 499  61.734 -27.212  -1.977
  688   2HH1  ARG 499          HH22      ARG 499  63.438 -27.501  -1.863
  689   1HH2  ARG 499          HH11      ARG 499  64.255 -24.146  -1.544
  690   2HH2  ARG 499          HH12      ARG 499  64.865 -25.765  -1.618
  691    H    ARG 500           HN       ARG 500  59.660 -21.659   2.076
  692    HA   ARG 500           HA       ARG 500  58.595 -23.117   4.319
  693   1HB   ARG 500          HB2       ARG 500  60.129 -20.517   4.087
  694   2HB   ARG 500          HB1       ARG 500  59.658 -21.210   5.639
  695   1HG   ARG 500          HG2       ARG 500  60.880 -23.283   5.085
  696   2HG   ARG 500          HG1       ARG 500  61.346 -22.593   3.531
  697   1HD   ARG 500          HD2       ARG 500  62.604 -20.823   4.630
  698   2HD   ARG 500          HD1       ARG 500  62.042 -21.365   6.215
  699    HE   ARG 500           HE       ARG 500  63.290 -23.603   5.150
  700   1HH1  ARG 500          HH21      ARG 500  64.098 -20.296   5.690
  701   2HH1  ARG 500          HH22      ARG 500  65.784 -20.609   5.933
  702   1HH2  ARG 500          HH11      ARG 500  65.488 -24.032   5.466
  703   2HH2  ARG 500          HH12      ARG 500  66.571 -22.724   5.806
  704    H    LYS 501           HN       LYS 501  58.002 -19.803   3.095
  705    HA   LYS 501           HA       LYS 501  55.975 -19.173   5.009
  706   1HB   LYS 501          HB2       LYS 501  57.107 -17.493   3.532
  707   2HB   LYS 501          HB1       LYS 501  56.217 -18.145   2.157
  708   1HG   LYS 501          HG2       LYS 501  54.082 -17.600   3.309
  709   2HG   LYS 501          HG1       LYS 501  54.996 -16.902   4.645
  710   1HD   LYS 501          HD2       LYS 501  56.020 -15.271   3.069
  711   2HD   LYS 501          HD1       LYS 501  55.052 -15.954   1.761
  712   1HE   LYS 501          HE2       LYS 501  53.726 -14.155   2.437
  713   2HE   LYS 501          HE1       LYS 501  53.036 -15.482   3.375
  714   1HZ   LYS 501          HZ1       LYS 501  53.622 -13.355   4.614
  715   2HZ   LYS 501          HZ2       LYS 501  55.244 -13.825   4.430
  716   3HZ   LYS 501          HZ3       LYS 501  54.162 -14.816   5.286
  717    H    LEU 502           HN       LEU 502  55.776 -20.497   1.711
  718    HA   LEU 502           HA       LEU 502  52.937 -20.775   1.674
  719   1HB   LEU 502          HB2       LEU 502  55.097 -22.314   0.194
  720   2HB   LEU 502          HB1       LEU 502  53.377 -22.513  -0.104
  721    HG   LEU 502           HG       LEU 502  54.801 -19.846  -0.272
  722   1HD1  LEU 502          HD11      LEU 502  55.641 -21.390  -2.007
  723   2HD1  LEU 502          HD12      LEU 502  54.655 -20.110  -2.713
  724   3HD1  LEU 502          HD13      LEU 502  53.981 -21.727  -2.509
  725   1HD2  LEU 502          HD21      LEU 502  52.007 -20.788  -0.560
  726   2HD2  LEU 502          HD22      LEU 502  52.564 -19.694  -1.824
  727   3HD2  LEU 502          HD23      LEU 502  52.621 -19.193  -0.135
  728    H    LEU 503           HN       LEU 503  55.542 -22.942   2.763
  729    HA   LEU 503           HA       LEU 503  53.866 -25.181   3.321
  730   1HB   LEU 503          HB2       LEU 503  56.326 -25.323   3.342
  731   2HB   LEU 503          HB1       LEU 503  56.380 -24.257   4.747
  732    HG   LEU 503           HG       LEU 503  55.114 -25.896   6.066
  733   1HD1  LEU 503          HD11      LEU 503  55.035 -28.251   4.805
  734   2HD1  LEU 503          HD12      LEU 503  54.912 -27.207   3.389
  735   3HD1  LEU 503          HD13      LEU 503  53.711 -27.093   4.676
  736   1HD2  LEU 503          HD21      LEU 503  57.140 -26.735   6.569
  737   2HD2  LEU 503          HD22      LEU 503  57.745 -26.272   4.978
  738   3HD2  LEU 503          HD23      LEU 503  56.994 -27.850   5.212
  739    H    LYS 504           HN       LYS 504  54.879 -22.437   5.393
  740    HA   LYS 504           HA       LYS 504  53.412 -23.276   7.713
  741   1HB   LYS 504          HB2       LYS 504  55.165 -21.510   7.718
  742   2HB   LYS 504          HB1       LYS 504  54.085 -20.460   6.808
  743   1HG   LYS 504          HG2       LYS 504  52.449 -20.503   8.640
  744   2HG   LYS 504          HG1       LYS 504  53.480 -21.601   9.555
  745   1HD   LYS 504          HD2       LYS 504  54.543 -18.939   8.616
  746   2HD   LYS 504          HD1       LYS 504  53.590 -19.051  10.096
  747   1HE   LYS 504          HE2       LYS 504  55.178 -20.841  10.884
  748   2HE   LYS 504          HE1       LYS 504  56.183 -20.488   9.478
  749   1HZ   LYS 504          HZ1       LYS 504  56.259 -19.200  11.887
  750   2HZ   LYS 504          HZ2       LYS 504  55.420 -18.123  10.876
  751   3HZ   LYS 504          HZ3       LYS 504  56.970 -18.666  10.442
  752    H    ALA 505           HN       ALA 505  52.539 -21.052   5.056
  753    HA   ALA 505           HA       ALA 505  49.936 -20.398   5.976
  754   1HB   ALA 505          HB1       ALA 505  49.479 -19.702   3.728
  755   2HB   ALA 505          HB2       ALA 505  50.676 -20.816   3.071
  756   3HB   ALA 505          HB3       ALA 505  51.197 -19.404   3.987
  757    H    PHE 506           HN       PHE 506  50.977 -23.028   3.799
  758    HA   PHE 506           HA       PHE 506  48.405 -24.207   3.530
  759   1HB   PHE 506          HB2       PHE 506  51.196 -25.300   3.224
  760   2HB   PHE 506          HB1       PHE 506  49.786 -26.343   3.034
  761    HD1  PHE 506           HD1      PHE 506  52.080 -24.565   1.231
  762    HD2  PHE 506           HD2      PHE 506  47.815 -24.986   1.556
  763    HE1  PHE 506           HE1      PHE 506  51.809 -23.745  -1.091
  764    HE2  PHE 506           HE2      PHE 506  47.557 -24.145  -0.753
  765    HZ   PHE 506           HZ       PHE 506  49.554 -23.526  -2.079
  766    H    GLY 507           HN       GLY 507  50.967 -24.616   5.949
  767   1HA   GLY 507          HA2       GLY 507  49.786 -26.851   7.288
  768   2HA   GLY 507          HA1       GLY 507  50.873 -25.681   8.046
  769    H    ILE 508           HN       ILE 508  49.422 -23.317   7.766
  770    HA   ILE 508           HA       ILE 508  47.491 -23.531   9.894
  771    HB   ILE 508           HB       ILE 508  47.908 -21.348   7.820
  772   1HG1  ILE 508          HG12      ILE 508  49.879 -21.768   9.224
  773   2HG1  ILE 508          HG11      ILE 508  49.132 -20.239   9.682
  774   1HG2  ILE 508          HG21      ILE 508  46.096 -21.612  10.193
  775   2HG2  ILE 508          HG22      ILE 508  45.815 -20.802   8.651
  776   3HG2  ILE 508          HG23      ILE 508  46.828 -20.038   9.874
  777   1HD1  ILE 508          HD11      ILE 508  47.820 -21.747  11.408
  778   2HD1  ILE 508          HD12      ILE 508  49.460 -21.227  11.764
  779   3HD1  ILE 508          HD13      ILE 508  49.169 -22.851  11.155
  780    H    VAL 509           HN       VAL 509  47.148 -23.309   6.361
  781    HA   VAL 509           HA       VAL 509  44.285 -23.236   6.302
  782    HB   VAL 509           HB       VAL 509  46.297 -24.348   4.322
  783   1HG1  VAL 509          HG11      VAL 509  44.359 -25.394   3.599
  784   2HG1  VAL 509          HG12      VAL 509  44.206 -23.841   2.775
  785   3HG1  VAL 509          HG13      VAL 509  43.313 -24.139   4.267
  786   1HG2  VAL 509          HG21      VAL 509  45.324 -21.701   5.046
  787   2HG2  VAL 509          HG22      VAL 509  45.045 -22.050   3.341
  788   3HG2  VAL 509          HG23      VAL 509  46.675 -22.143   4.008
  789    H    ILE 510           HN       ILE 510  46.561 -25.961   6.276
  790    HA   ILE 510           HA       ILE 510  44.611 -28.031   6.081
  791    HB   ILE 510           HB       ILE 510  47.404 -28.004   7.256
  792   1HG1  ILE 510          HG12      ILE 510  46.360 -29.320   4.742
  793   2HG1  ILE 510          HG11      ILE 510  47.011 -27.679   4.744
  794   1HG2  ILE 510          HG21      ILE 510  47.143 -30.539   7.032
  795   2HG2  ILE 510          HG22      ILE 510  45.409 -30.250   6.888
  796   3HG2  ILE 510          HG23      ILE 510  46.260 -29.791   8.363
  797   1HD1  ILE 510          HD11      ILE 510  49.117 -28.481   4.714
  798   2HD1  ILE 510          HD12      ILE 510  48.457 -30.108   4.563
  799   3HD1  ILE 510          HD13      ILE 510  48.807 -29.441   6.159
  800    H    ASP 511           HN       ASP 511  46.107 -26.350   8.815
  801    HA   ASP 511           HA       ASP 511  44.865 -27.898  10.870
  802   1HB   ASP 511          HB2       ASP 511  45.998 -25.127  10.695
  803   2HB   ASP 511          HB1       ASP 511  45.102 -25.595  12.140
  804    H    TYR 512           HN       TYR 512  43.840 -24.885   9.243
  805    HA   TYR 512           HA       TYR 512  41.351 -24.648  10.651
  806   1HB   TYR 512          HB2       TYR 512  42.469 -23.590   8.082
  807   2HB   TYR 512          HB1       TYR 512  40.724 -23.480   8.329
  808    HD1  TYR 512           HD1      TYR 512  43.810 -21.855   8.914
  809    HD2  TYR 512           HD2      TYR 512  40.006 -22.647  10.742
  810    HE1  TYR 512           HE1      TYR 512  44.127 -19.908  10.421
  811    HE2  TYR 512           HE2      TYR 512  40.321 -20.704  12.247
  812    HH   TYR 512           HH       TYR 512  42.528 -18.316  11.726
  813    H    LYS 513           HN       LYS 513  42.260 -26.327   7.649
  814    HA   LYS 513           HA       LYS 513  39.649 -27.183   6.916
  815   1HB   LYS 513          HB2       LYS 513  41.718 -27.329   5.479
  816   2HB   LYS 513          HB1       LYS 513  42.228 -28.704   6.457
  817   1HG   LYS 513          HG2       LYS 513  40.234 -29.948   5.846
  818   2HG   LYS 513          HG1       LYS 513  39.586 -28.556   4.977
  819   1HD   LYS 513          HD2       LYS 513  41.537 -28.640   3.435
  820   2HD   LYS 513          HD1       LYS 513  42.121 -30.070   4.285
  821   1HE   LYS 513          HE2       LYS 513  40.926 -30.903   2.391
  822   2HE   LYS 513          HE1       LYS 513  39.846 -31.134   3.768
  823   1HZ   LYS 513          HZ1       LYS 513  38.687 -30.150   1.887
  824   2HZ   LYS 513          HZ2       LYS 513  39.776 -28.846   1.870
  825   3HZ   LYS 513          HZ3       LYS 513  38.734 -29.068   3.191
  826    H    GLU 514           HN       GLU 514  42.130 -28.670   8.984
  827    HA   GLU 514           HA       GLU 514  40.628 -31.051   9.571
  828   1HB   GLU 514          HB2       GLU 514  42.816 -29.587  11.060
  829   2HB   GLU 514          HB1       GLU 514  42.126 -31.105  11.634
  830   1HG   GLU 514          HG2       GLU 514  42.786 -32.232   9.581
  831   2HG   GLU 514          HG1       GLU 514  43.361 -30.713   8.892
  832    H    ARG 515           HN       ARG 515  40.912 -27.893  11.213
  833    HA   ARG 515           HA       ARG 515  39.180 -28.494  13.407
  834   1HB   ARG 515          HB2       ARG 515  40.626 -26.424  13.187
  835   2HB   ARG 515          HB1       ARG 515  39.457 -25.809  12.017
  836   1HG   ARG 515          HG2       ARG 515  37.668 -25.931  13.699
  837   2HG   ARG 515          HG1       ARG 515  38.808 -26.591  14.872
  838   1HD   ARG 515          HD2       ARG 515  39.173 -23.901  13.537
  839   2HD   ARG 515          HD1       ARG 515  38.408 -24.112  15.112
  840    HE   ARG 515           HE       ARG 515  40.839 -25.414  15.368
  841   1HH1  ARG 515          HH21      ARG 515  39.750 -22.306  14.353
  842   2HH1  ARG 515          HH22      ARG 515  41.177 -21.482  14.888
  843   1HH2  ARG 515          HH11      ARG 515  42.711 -24.359  16.071
  844   2HH2  ARG 515          HH12      ARG 515  42.854 -22.646  15.860
  845    H    ASP 516           HN       ASP 516  38.550 -27.438  10.079
  846    HA   ASP 516           HA       ASP 516  36.563 -27.673   8.809
  847   1HB   ASP 516          HB2       ASP 516  36.150 -29.596  10.604
  848   2HB   ASP 516          HB1       ASP 516  34.965 -28.447  11.228
  849    H    LEU 517           HN       LEU 517  37.405 -25.352  10.589
  850    HA   LEU 517           HA       LEU 517  34.863 -24.079  11.304
  851   1HB   LEU 517          HB2       LEU 517  37.300 -23.763  12.340
  852   2HB   LEU 517          HB1       LEU 517  37.415 -22.524  11.094
  853    HG   LEU 517           HG       LEU 517  35.262 -21.557  11.930
  854   1HD1  LEU 517          HD11      LEU 517  35.368 -24.000  13.525
  855   2HD1  LEU 517          HD12      LEU 517  34.005 -22.926  13.214
  856   3HD1  LEU 517          HD13      LEU 517  35.125 -22.570  14.528
  857   1HD2  LEU 517          HD21      LEU 517  36.542 -21.279  14.422
  858   2HD2  LEU 517          HD22      LEU 517  36.712 -20.216  13.026
  859   3HD2  LEU 517          HD23      LEU 517  37.845 -21.548  13.263
  860    H    ILE 518           HN       ILE 518  36.394 -24.656   8.453
  861    HA   ILE 518           HA       ILE 518  35.959 -22.067   7.165
  862    HB   ILE 518           HB       ILE 518  36.505 -24.808   5.979
  863   1HG1  ILE 518          HG12      ILE 518  38.402 -22.474   6.368
  864   2HG1  ILE 518          HG11      ILE 518  38.276 -23.815   7.508
  865   1HG2  ILE 518          HG21      ILE 518  36.184 -23.852   3.971
  866   2HG2  ILE 518          HG22      ILE 518  37.386 -22.620   4.355
  867   3HG2  ILE 518          HG23      ILE 518  35.691 -22.355   4.761
  868   1HD1  ILE 518          HD11      ILE 518  39.197 -23.880   4.635
  869   2HD1  ILE 518          HD12      ILE 518  38.651 -25.342   5.455
  870   3HD1  ILE 518          HD13      ILE 518  40.043 -24.455   6.072
  871    H    ASP 519           HN       ASP 519  34.122 -21.438   6.104
  872    HA   ASP 519           HA       ASP 519  31.648 -22.783   6.519
  873   1HB   ASP 519          HB2       ASP 519  31.860 -20.352   5.976
  874   2HB   ASP 519          HB1       ASP 519  32.322 -20.781   4.335
  875    H    ARG 520           HN       ARG 520  30.549 -24.281   5.309
  876    HA   ARG 520           HA       ARG 520  31.906 -26.012   3.553
  877   1HB   ARG 520          HB2       ARG 520  28.965 -25.434   3.921
  878   2HB   ARG 520          HB1       ARG 520  29.544 -26.687   2.821
  879   1HG   ARG 520          HG2       ARG 520  30.776 -27.731   4.677
  880   2HG   ARG 520          HG1       ARG 520  30.184 -26.502   5.753
  881   1HD   ARG 520          HD2       ARG 520  28.384 -28.345   4.175
  882   2HD   ARG 520          HD1       ARG 520  28.868 -28.683   5.834
  883    HE   ARG 520           HE       ARG 520  26.741 -26.952   4.999
  884   1HH1  ARG 520          HH21      ARG 520  29.438 -26.959   7.172
  885   2HH1  ARG 520          HH22      ARG 520  28.795 -25.693   8.160
  886   1HH2  ARG 520          HH11      ARG 520  25.881 -25.365   6.333
  887   2HH2  ARG 520          HH12      ARG 520  26.786 -24.815   7.704
  888    H    SER 521           HN       SER 521  30.528 -22.911   2.982
  889    HA   SER 521           HA       SER 521  29.943 -22.972   0.224
  890   1HB   SER 521          HB2       SER 521  31.237 -20.805   1.902
  891   2HB   SER 521          HB1       SER 521  30.738 -20.561   0.230
  892    HG   SER 521           HG       SER 521  29.253 -20.303   2.330
  893    H    ALA 522           HN       ALA 522  33.027 -23.202   1.875
  894    HA   ALA 522           HA       ALA 522  34.728 -22.492  -0.327
  895   1HB   ALA 522          HB1       ALA 522  35.328 -24.563   1.788
  896   2HB   ALA 522          HB2       ALA 522  35.440 -22.832   2.082
  897   3HB   ALA 522          HB3       ALA 522  36.488 -23.592   0.884
  898    H    TYR 523           HN       TYR 523  33.110 -25.517   0.577
  899    HA   TYR 523           HA       TYR 523  33.867 -26.576  -2.114
  900   1HB   TYR 523          HB2       TYR 523  33.783 -28.863  -0.655
  901   2HB   TYR 523          HB1       TYR 523  35.273 -27.978  -0.985
  902    HD1  TYR 523           HD1      TYR 523  32.581 -28.529   1.514
  903    HD2  TYR 523           HD2      TYR 523  36.420 -26.771   0.737
  904    HE1  TYR 523           HE1      TYR 523  32.879 -28.110   3.931
  905    HE2  TYR 523           HE2      TYR 523  36.715 -26.347   3.164
  906    HH   TYR 523           HH       TYR 523  35.755 -27.441   5.349