*HEADER    CELL ADHESION                           06-JUN-05   1ZWT              
*TITLE     STRUCTURE OF THE GLOBULAR HEAD DOMAIN OF THE BUNDLIN, BFPA,           
*TITLE    2 OF THE BUNDLE-FORMING PILUS OF ENTEROPATHOGENIC E.COLI               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MAJOR STRUCTURAL SUBUNIT OF BUNDLE-FORMING PILUS;          
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: BFPA;                                                      
*COMPND   5 SYNONYM: BUNDLE- FORMING PILIN, BUNDLIN, BFP;                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 STRAIN: O127:H6;                                                     
*SOURCE   5 GENE: BFPA;                                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: RY3080;                                    
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET39B+                                   
*KEYWDS    ALPHA-BETA FOLD, BETA-SANDWICH, ONE DISULFIDE BOND                    
*EXPDTA    NMR, 12 STRUCTURES                                                    
*AUTHOR    S.RAMBOARINA, P.J.FERNANDES, S.J.DANIELL, S.ISLAM,                    
*AUTHOR   2 G.FRANKEL, F.BOOY, M.S.DONNENBERG, S.J.MATTHEWS                      
*REVDAT   1   04-OCT-05 1ZWT    0                                                

 ASSI {   28}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 109  and name HB1 ))
      4.800     2.900     1.200 peak    28 spectrum    1 weight  0.10000E+01 volume  0.27251E-03 ppm1      9.631 ppm2      2.812 CV     1
 OR {   28}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
 ASSI {   78}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.000     1.100     1.100 peak    78 spectrum    1 weight  0.10000E+01 volume  0.34754E-02 ppm1      9.177 ppm2      1.074 CV     1
 OR {   78}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
 ASSI {   87}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 134  and name HB% )
      3.700     1.700     1.700 peak    87 spectrum    1 weight  0.10000E+01 volume  0.11122E-02 ppm1      8.819 ppm2      1.096 CV     1
 OR {   87}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
 ASSI {  132}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 155  and name HE% )
      4.200     2.200     1.800 peak   132 spectrum    1 weight  0.10000E+01 volume  0.57580E-03 ppm1      9.040 ppm2      6.730 CV     1
 OR {  132}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 83   and name HD% )
 ASSI {  138}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      5.000     3.200     1.000 peak   138 spectrum    1 weight  0.10000E+01 volume  0.19060E-03 ppm1      8.676 ppm2      3.978 CV     1
 OR {  138}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
 ASSI {  142}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 131  and name HG1 ))
      3.500     1.500     1.500 peak   142 spectrum    1 weight  0.10000E+01 volume  0.61120E-03 ppm1      8.677 ppm2      1.441 CV     1
 OR {  142}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 140  and name HB% )
 OR {  142}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 126  and name HB% )
 ASSI {  182}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      4.300     2.300     1.700 peak   182 spectrum    1 weight  0.10000E+01 volume  0.60307E-03 ppm1      9.527 ppm2      8.184 CV     1
 OR {  182}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  242}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      5.200     3.400     0.800 peak   242 spectrum    1 weight  0.10000E+01 volume  0.37194E-03 ppm1      8.372 ppm2      3.847 CV     1
 OR {  242}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 96   and name HB1 ))
 OR {  242}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 96   and name HB2 ))
 ASSI {  267}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 38   and name HD2%)
      3.000     3.000     3.000 peak   267 spectrum    1 weight  0.10000E+01 volume  0.74471E-03 ppm1      7.472 ppm2      0.151 CV     1
 OR {  267}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 74   and name HB% )
 ASSI {  288}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      4.600     2.700     1.400 peak   288 spectrum    1 weight  0.10000E+01 volume  0.24133E-03 ppm1      9.166 ppm2      1.089 CV     1
 OR {  288}
   (( segid "    " and resid 157  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
 ASSI {  308}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
      2.600     0.800     0.800 peak   308 spectrum    1 weight  0.10000E+01 volume  0.56746E-02 ppm1      8.681 ppm2      3.989 CV     1
 OR {  308}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
 OR {  308}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  318}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      2.700     0.900     0.900 peak   318 spectrum    1 weight  0.10000E+01 volume  0.46664E-02 ppm1      8.091 ppm2      4.220 CV     1
 OR {  318}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HA  ))
 ASSI {  330}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 83   and name HD% )
      4.900     3.000     1.100 peak   330 spectrum    1 weight  0.10000E+01 volume  0.35467E-03 ppm1     10.654 ppm2      6.779 CV     1
 OR {  330}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 156  and name HD% )
 OR {  330}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 117  and name HD22))
 ASSI {  336}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HA1 ))
      2.900     1.100     1.100 peak   336 spectrum    1 weight  0.10000E+01 volume  0.25983E-02 ppm1     10.655 ppm2      3.672 CV     1
 OR {  336}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
 ASSI {  348}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 129  and name HN  ))
      3.500     1.600     1.600 peak   348 spectrum    1 weight  0.10000E+01 volume  0.91784E-03 ppm1      8.902 ppm2      7.620 CV     1
 OR {  348}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  350}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 131  and name HD1 ))
      3.800     1.800     1.800 peak   350 spectrum    1 weight  0.10000E+01 volume  0.20396E-02 ppm1      8.903 ppm2      1.401 CV     1
 OR {  350}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 126  and name HB% )
 OR {  350}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 131  and name HG2 ))
 ASSI {  367}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 17   and name HA  ))
      2.800     0.900     0.900 peak   367 spectrum    1 weight  0.10000E+01 volume  0.37114E-02 ppm1      8.162 ppm2      4.059 CV     1
 OR {  367}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HB2 ))
 OR {  367}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HB1 ))
 ASSI {  369}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.900     1.900     1.900 peak   369 spectrum    1 weight  0.10000E+01 volume  0.12034E-02 ppm1      8.163 ppm2      2.209 CV     1
 OR {  369}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 OR {  369}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HB  ))
 ASSI {  377}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 99   and name HG2%)
      2.700     2.700     3.300 peak   377 spectrum    1 weight  0.10000E+01 volume  0.65437E-03 ppm1      8.790 ppm2      1.027 CV     1
 OR {  377}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 134  and name HB% )
 ASSI {  382}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      3.100     1.200     1.200 peak   382 spectrum    1 weight  0.10000E+01 volume  0.17151E-02 ppm1      8.789 ppm2      3.982 CV     1
 OR {  382}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 137  and name HA  ))
 ASSI {  398}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 158  and name HE1 ))
      4.900     3.000     1.100 peak   398 spectrum    1 weight  0.10000E+01 volume  0.22687E-03 ppm1      7.283 ppm2      2.815 CV     1
 OR {  398}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 107  and name HE2 ))
 OR {  398}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 109  and name HB1 ))
 OR {  398}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 107  and name HE1 ))
 ASSI {  432}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.100     0.600     0.600 peak   432 spectrum    1 weight  0.10000E+01 volume  0.11501E-01 ppm1      8.278 ppm2      3.718 CV     1
 OR {  432}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI {  437}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 156  and name HD% )
      4.100     2.100     1.900 peak   437 spectrum    1 weight  0.10000E+01 volume  0.46449E-03 ppm1      7.148 ppm2      6.811 CV     1
 OR {  437}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
 ASSI {  438}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
      4.300     2.300     1.700 peak   438 spectrum    1 weight  0.10000E+01 volume  0.70541E-03 ppm1      7.145 ppm2      8.386 CV     1
 OR {  438}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
 ASSI {  453}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 129  and name HN  ))
      2.700     0.900     0.900 peak   453 spectrum    1 weight  0.10000E+01 volume  0.32150E-02 ppm1      8.884 ppm2      7.624 CV     1
 OR {  453}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
 ASSI {  468}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.300     0.600     0.600 peak   468 spectrum    1 weight  0.10000E+01 volume  0.46042E-02 ppm1      8.810 ppm2      4.568 CV     1
 OR {  468}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 154  and name HB  ))
 ASSI {  484}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 157  and name HA  ))
      4.900     3.000     1.100 peak   484 spectrum    1 weight  0.10000E+01 volume  0.22859E-03 ppm1      8.465 ppm2      4.925 CV     1
 OR {  484}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
 OR {  484}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI {  487}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 119  and name HG2%)
      4.300     2.300     1.700 peak   487 spectrum    1 weight  0.10000E+01 volume  0.29881E-03 ppm1      8.460 ppm2      0.532 CV     1
 OR {  487}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
 OR {  487}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 119  and name HG2%)
 ASSI {  490}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
      2.200     0.600     0.600 peak   490 spectrum    1 weight  0.10000E+01 volume  0.11184E-01 ppm1      8.419 ppm2      4.553 CV     1
 OR {  490}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI {  494}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 130  and name HB% )
      4.800     2.900     1.200 peak   494 spectrum    1 weight  0.10000E+01 volume  0.20704E-03 ppm1      8.421 ppm2      0.555 CV     1
 OR {  494}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 119  and name HG2%)
 ASSI {  552}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      4.400     2.400     1.600 peak   552 spectrum    1 weight  0.10000E+01 volume  0.74064E-03 ppm1      9.129 ppm2      4.590 CV     1
 OR {  552}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
 OR {  552}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 154  and name HB  ))
 ASSI {  605}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 13   and name HD22))
      5.800     4.200     0.200 peak   605 spectrum    1 weight  0.10000E+01 volume  0.18391E-03 ppm1      8.180 ppm2      7.120 CV     1
 OR {  605}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 13   and name HD22))
 ASSI {  612}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      2.800     1.000     1.000 peak   612 spectrum    1 weight  0.10000E+01 volume  0.23341E-02 ppm1      8.175 ppm2      0.920 CV     1
 OR {  612}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {  616}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      2.300     0.600     0.600 peak   616 spectrum    1 weight  0.10000E+01 volume  0.68725E-02 ppm1      8.148 ppm2      8.388 CV     1
 OR {  616}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HN  ))
 ASSI {  618}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      2.600     0.900     0.900 peak   618 spectrum    1 weight  0.10000E+01 volume  0.49055E-02 ppm1      8.148 ppm2      4.046 CV     1
 OR {  618}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
 OR {  618}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 11   and name HB1 ))
 ASSI {  625}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 143  and name HA  ))
      2.600     0.800     0.800 peak   625 spectrum    1 weight  0.10000E+01 volume  0.46735E-02 ppm1      7.907 ppm2      4.061 CV     1
 OR {  625}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HA  ))
 ASSI {  643}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      4.400     2.400     1.600 peak   643 spectrum    1 weight  0.10000E+01 volume  0.46859E-03 ppm1      6.984 ppm2      4.582 CV     1
 OR {  643}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
 ASSI {  652}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HD21))
      3.900     1.900     1.900 peak   652 spectrum    1 weight  0.10000E+01 volume  0.37618E-03 ppm1      8.616 ppm2      7.600 CV     1
 OR {  652}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HD21))
 ASSI {  661}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.700     1.700     1.700 peak   661 spectrum    1 weight  0.10000E+01 volume  0.89807E-03 ppm1      8.602 ppm2      3.807 CV     1
 OR {  661}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
 ASSI {  663}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      2.900     1.100     1.100 peak   663 spectrum    1 weight  0.10000E+01 volume  0.31339E-02 ppm1      8.602 ppm2      3.426 CV     1
 OR {  663}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
 ASSI {  666}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.400     2.400     3.600 peak   666 spectrum    1 weight  0.10000E+01 volume  0.11696E-02 ppm1      8.601 ppm2      1.410 CV     1
 OR {  666}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 91   and name HG1 ))
 ASSI {  787}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      4.700     2.800     1.300 peak   787 spectrum    1 weight  0.10000E+01 volume  0.25857E-03 ppm1      8.225 ppm2      8.788 CV     1
 OR {  787}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
 ASSI {  794}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.500     0.800     0.800 peak   794 spectrum    1 weight  0.10000E+01 volume  0.58923E-02 ppm1      8.225 ppm2      2.192 CV     1
 OR {  794}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 18   and name HB  ))
 ASSI {  807}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      3.100     1.200     1.200 peak   807 spectrum    1 weight  0.10000E+01 volume  0.27253E-02 ppm1      8.067 ppm2      3.031 CV     1
 OR {  807}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI {  812}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 93   and name HN  ))
      2.500     0.800     0.800 peak   812 spectrum    1 weight  0.10000E+01 volume  0.42711E-02 ppm1      8.011 ppm2      8.364 CV     1
 OR {  812}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
 ASSI {  838}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 156  and name HE% )
      4.100     2.100     1.900 peak   838 spectrum    1 weight  0.10000E+01 volume  0.10171E-02 ppm1      8.522 ppm2      7.628 CV     1
 OR {  838}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HD21))
 ASSI {  845}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      3.800     3.800     2.200 peak   845 spectrum    1 weight  0.10000E+01 volume  0.11126E-02 ppm1      8.522 ppm2      3.060 CV     1
 OR {  845}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI {  860}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      3.900     1.900     1.900 peak   860 spectrum    1 weight  0.10000E+01 volume  0.41322E-03 ppm1      8.138 ppm2      4.567 CV     1
 OR {  860}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
 ASSI {  862}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 130  and name HB% )
      2.400     0.700     0.700 peak   862 spectrum    1 weight  0.10000E+01 volume  0.68671E-02 ppm1      8.137 ppm2      0.604 CV     1
 OR {  862}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 113  and name HD1%)
 ASSI {  940}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HD21))
      5.200     3.400     0.800 peak   940 spectrum    1 weight  0.10000E+01 volume  0.17955E-03 ppm1      8.568 ppm2      7.628 CV     1
 OR {  940}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 129  and name HN  ))
 ASSI {  955}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      3.500     1.500     1.500 peak   955 spectrum    1 weight  0.10000E+01 volume  0.11730E-02 ppm1      8.370 ppm2      4.042 CV     1
 OR {  955}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
 ASSI {  991}
   (( segid "    " and resid 152  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      3.600     1.600     1.600 peak   991 spectrum    1 weight  0.10000E+01 volume  0.99334E-03 ppm1      8.445 ppm2      0.962 CV     1
 OR {  991}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
 ASSI { 1021}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.900     1.900     1.900 peak  1021 spectrum    1 weight  0.10000E+01 volume  0.72005E-03 ppm1      7.469 ppm2      1.104 CV     1
 OR { 1021}
   (( segid "    " and resid 54   and name HN  ))
   (  segid "    " and resid 87   and name HG2%)
 ASSI { 1033}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      4.100     2.100     1.900 peak  1033 spectrum    1 weight  0.10000E+01 volume  0.56417E-03 ppm1      9.004 ppm2      5.242 CV     1
 OR { 1033}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
 ASSI { 1091}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.500     0.800     0.800 peak  1091 spectrum    1 weight  0.10000E+01 volume  0.46753E-02 ppm1      7.798 ppm2      8.375 CV     1
 OR { 1091}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
 ASSI { 1096}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 22   and name HG2%)
      3.400     1.400     1.400 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.21729E-02 ppm1      7.799 ppm2      1.438 CV     1
 OR { 1096}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
 ASSI { 1099}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      3.900     1.900     1.900 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.13420E-02 ppm1      7.672 ppm2      3.982 CV     1
 OR { 1099}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 1129}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HG  ))
      3.300     1.400     1.400 peak  1129 spectrum    1 weight  0.10000E+01 volume  0.40623E-02 ppm1      7.006 ppm2      1.626 CV     1
 OR { 1129}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HG11))
 OR { 1129}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HG12))
 ASSI { 1145}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      4.500     2.600     1.500 peak  1145 spectrum    1 weight  0.10000E+01 volume  0.43057E-03 ppm1      8.768 ppm2      1.591 CV     1
 OR { 1145}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 157  and name HB1 ))
 ASSI { 1155}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.700     2.700     3.300 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.62598E-03 ppm1      8.391 ppm2      1.408 CV     1
 OR { 1155}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HG1 ))
 ASSI { 1175}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.600     1.600     1.600 peak  1175 spectrum    1 weight  0.10000E+01 volume  0.29523E-02 ppm1      8.248 ppm2      1.577 CV     1
 OR { 1175}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 152  and name HD2 ))
 OR { 1175}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 152  and name HD1 ))
 ASSI { 1187}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.000     1.100     1.100 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.26164E-02 ppm1      8.068 ppm2      2.499 CV     1
 OR { 1187}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 1208}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.800     1.000     1.000 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.28109E-02 ppm1      7.823 ppm2      2.704 CV     1
 OR { 1208}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB1 ))
 OR { 1208}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI { 1223}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
      4.700     2.800     1.300 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.37337E-03 ppm1      8.768 ppm2      4.558 CV     1
 OR { 1223}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
 OR { 1223}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI { 1246}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      2.900     1.000     1.000 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.27038E-02 ppm1      7.668 ppm2      4.220 CV     1
 OR { 1246}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
 ASSI { 1255}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 122  and name HN  ))
      2.700     2.700     3.300 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.93087E-02 ppm1      7.234 ppm2      8.419 CV     1
 OR { 1255}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HN  ))
 ASSI { 1257}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 120  and name HA  ))
      2.800     1.000     1.000 peak  1257 spectrum    1 weight  0.10000E+01 volume  0.23315E-02 ppm1      7.234 ppm2      4.540 CV     1
 OR { 1257}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 1266}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      2.800     1.000     1.000 peak  1266 spectrum    1 weight  0.10000E+01 volume  0.21706E-02 ppm1      9.025 ppm2      7.801 CV     1
 OR { 1266}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 1274}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 42   and name HD1%)
      5.000     3.100     1.000 peak  1274 spectrum    1 weight  0.10000E+01 volume  0.51063E-03 ppm1      8.609 ppm2      0.942 CV     1
 OR { 1274}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 38   and name HG  ))
 ASSI { 1281}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HA  ))
      2.800     1.000     1.000 peak  1281 spectrum    1 weight  0.10000E+01 volume  0.33774E-02 ppm1      8.605 ppm2      3.854 CV     1
 OR { 1281}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
 OR { 1281}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
 ASSI { 1294}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 87   and name HB  ))
      3.200     3.200     2.800 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.10550E-02 ppm1      8.240 ppm2      4.568 CV     1
 OR { 1294}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI { 1331}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.800     1.800     1.800 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.31124E-03 ppm1      8.920 ppm2      2.209 CV     1
 OR { 1331}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HG1 ))
 OR { 1331}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
 ASSI { 1361}
   (( segid "    " and resid 31   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
      3.100     1.200     1.200 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.25241E-02 ppm1      8.923 ppm2      0.988 CV     1
 OR { 1361}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI { 1368}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 61   and name HG12))
      3.800     1.800     1.800 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.11039E-02 ppm1      8.880 ppm2      1.083 CV     1
 OR { 1368}
   (( segid "    " and resid 88   and name HN  ))
   (  segid "    " and resid 87   and name HG2%)
 OR { 1368}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 61   and name HG11))
 ASSI { 1372}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      4.200     2.200     1.800 peak  1372 spectrum    1 weight  0.10000E+01 volume  0.63598E-03 ppm1      8.780 ppm2      8.325 CV     1
 OR { 1372}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 117  and name HN  ))
 ASSI { 1376}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HA1 ))
      2.600     0.900     0.900 peak  1376 spectrum    1 weight  0.10000E+01 volume  0.49308E-02 ppm1      8.777 ppm2      3.743 CV     1
 OR { 1376}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HB1 ))
 ASSI { 1379}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HN  ))
      2.300     0.700     0.700 peak  1379 spectrum    1 weight  0.10000E+01 volume  0.50952E-02 ppm1      8.387 ppm2      8.139 CV     1
 OR { 1379}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 1384}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      4.700     2.700     1.300 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.52496E-03 ppm1      8.389 ppm2      2.161 CV     1
 OR { 1384}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 OR { 1384}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 1458}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.500     3.500     2.500 peak  1458 spectrum    1 weight  0.10000E+01 volume  0.24347E-03 ppm1      8.869 ppm2      3.105 CV     1
 OR { 1458}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
 ASSI { 1459}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      2.400     0.700     0.700 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.52034E-02 ppm1      7.662 ppm2      8.841 CV     1
 OR { 1459}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
 ASSI { 1489}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 72   and name HA2 ))
      4.500     2.500     1.500 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.51639E-03 ppm1      8.186 ppm2      4.068 CV     1
 OR { 1489}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
 OR { 1489}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 73   and name HD1 ))
 ASSI { 1499}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.900     1.100     1.100 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.30798E-02 ppm1      8.118 ppm2      4.786 CV     1
 OR { 1499}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HA2 ))
 ASSI { 1501}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.000     1.100     1.100 peak  1501 spectrum    1 weight  0.10000E+01 volume  0.30838E-02 ppm1      8.118 ppm2      3.736 CV     1
 OR { 1501}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HA1 ))
 ASSI { 1540}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 65   and name HE% )
      3.800     1.800     1.800 peak  1540 spectrum    1 weight  0.10000E+01 volume  0.13913E-02 ppm1      8.062 ppm2      7.211 CV     1
 OR { 1540}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 1549}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HG1 ))
      4.900     3.000     1.100 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.55844E-03 ppm1      8.060 ppm2      1.663 CV     1
 OR { 1549}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI { 1566}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HA1 ))
      5.100     3.300     0.900 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.21980E-03 ppm1      7.750 ppm2      3.694 CV     1
 OR { 1566}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
 OR { 1566}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 73   and name HG1 ))
 ASSI { 1579}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 42   and name HG11))
      5.100     3.200     0.900 peak  1579 spectrum    1 weight  0.10000E+01 volume  0.23551E-03 ppm1      8.911 ppm2      1.650 CV     1
 OR { 1579}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 44   and name HG  ))
 OR { 1579}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 42   and name HG12))
 ASSI { 1585}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HD21))
      4.200     2.200     1.800 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.61710E-03 ppm1      8.350 ppm2      7.634 CV     1
 OR { 1585}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 156  and name HE% )
 ASSI { 1587}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 83   and name HD% )
      4.300     2.300     1.700 peak  1587 spectrum    1 weight  0.10000E+01 volume  0.86101E-03 ppm1      8.350 ppm2      6.765 CV     1
 OR { 1587}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HD22))
 ASSI { 1597}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 119  and name HG2%)
      4.300     2.300     1.700 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.64091E-03 ppm1      8.350 ppm2      0.585 CV     1
 OR { 1597}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1608}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      3.700     1.700     1.700 peak  1608 spectrum    1 weight  0.10000E+01 volume  0.66122E-03 ppm1      7.226 ppm2      8.028 CV     1
 OR { 1608}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI { 1631}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
      2.800     1.000     1.000 peak  1631 spectrum    1 weight  0.10000E+01 volume  0.22820E-02 ppm1      7.363 ppm2      4.649 CV     1
 OR { 1631}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 132  and name HA  ))
 ASSI { 1639}
   (( segid "    " and resid 133  and name HN  ))
   (  segid "    " and resid 133  and name HG2%)
      3.200     1.300     1.300 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.21468E-02 ppm1      7.363 ppm2      1.247 CV     1
 OR { 1639}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HD2 ))
 ASSI { 1697}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 61   and name HN  ))
      3.700     1.700     1.700 peak  1697 spectrum    1 weight  0.10000E+01 volume  0.15120E-02 ppm1      7.898 ppm2      8.145 CV     1
 OR { 1697}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
 ASSI { 1703}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 67   and name HA1 ))
      4.700     2.800     1.300 peak  1703 spectrum    1 weight  0.10000E+01 volume  0.36094E-03 ppm1      7.898 ppm2      3.927 CV     1
 OR { 1703}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
 ASSI { 1715}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      3.600     1.600     1.600 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.17997E-02 ppm1      9.476 ppm2      8.803 CV     1
 OR { 1715}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 1717}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      4.000     2.000     2.000 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.94740E-03 ppm1      9.475 ppm2      6.804 CV     1
 OR { 1717}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 156  and name HD% )
 ASSI { 1737}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HB  ))
      3.000     1.100     1.100 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.22126E-02 ppm1      8.385 ppm2      4.072 CV     1
 OR { 1737}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI { 1741}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      2.300     0.700     0.700 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.84920E-02 ppm1      8.386 ppm2      1.410 CV     1
 OR { 1741}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 22   and name HG2%)
 ASSI { 1749}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.800     1.000     1.000 peak  1749 spectrum    1 weight  0.10000E+01 volume  0.30027E-02 ppm1      8.775 ppm2      4.548 CV     1
 OR { 1749}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA2 ))
 ASSI { 1753}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 156  and name HB1 ))
      5.100     3.200     0.900 peak  1753 spectrum    1 weight  0.10000E+01 volume  0.23682E-03 ppm1      8.776 ppm2      1.847 CV     1
 OR { 1753}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
 ASSI { 1771}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HN  ))
      2.300     0.600     0.600 peak  1771 spectrum    1 weight  0.10000E+01 volume  0.49794E-02 ppm1      7.242 ppm2      8.079 CV     1
 OR { 1771}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 1774}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA1 ))
      2.300     0.700     0.700 peak  1774 spectrum    1 weight  0.10000E+01 volume  0.36464E-02 ppm1      7.242 ppm2      3.882 CV     1
 OR { 1774}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 66   and name HA1 ))
 ASSI { 1779}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      4.300     2.400     1.700 peak  1779 spectrum    1 weight  0.10000E+01 volume  0.10342E-02 ppm1      7.241 ppm2      1.762 CV     1
 OR { 1779}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI { 1782}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      3.500     1.600     1.600 peak  1782 spectrum    1 weight  0.10000E+01 volume  0.69129E-03 ppm1      6.656 ppm2      2.634 CV     1
 OR { 1782}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
 ASSI { 1790}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA2 ))
      3.000     1.100     1.100 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.20584E-02 ppm1      6.658 ppm2      4.063 CV     1
 OR { 1790}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HD1 ))
 ASSI { 1828}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
      4.500     2.600     1.500 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.39145E-03 ppm1      7.514 ppm2      4.553 CV     1
 OR { 1828}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
 ASSI { 1838}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HA1 ))
      2.900     1.000     1.000 peak  1838 spectrum    1 weight  0.10000E+01 volume  0.25362E-02 ppm1      7.512 ppm2      3.995 CV     1
 OR { 1838}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 1870}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 18   and name HG1%)
      2.600     2.600     3.400 peak  1870 spectrum    1 weight  0.10000E+01 volume  0.89263E-03 ppm1      8.685 ppm2      0.852 CV     1
 OR { 1870}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
 OR { 1870}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 28   and name HD1%)
 ASSI { 1895}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 91   and name HN  ))
      4.900     3.100     1.100 peak  1895 spectrum    1 weight  0.10000E+01 volume  0.23523E-03 ppm1      8.380 ppm2      8.038 CV     1
 OR { 1895}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
 ASSI { 1912}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 93   and name HB% )
      2.600     0.800     0.800 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.38944E-02 ppm1      8.279 ppm2      0.529 CV     1
 OR { 1912}
   (( segid "    " and resid 114  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1926}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.000     1.100     1.100 peak  1926 spectrum    1 weight  0.10000E+01 volume  0.31775E-02 ppm1      8.067 ppm2      3.771 CV     1
 OR { 1926}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
 ASSI { 1957}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 129  and name HB% )
      3.400     3.400     2.600 peak  1957 spectrum    1 weight  0.10000E+01 volume  0.14919E-03 ppm1      9.634 ppm2      1.130 CV     1
 OR { 1957}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 153  and name HG1%)
 OR { 1957}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 153  and name HG2%)
 ASSI {    7}
   (  segid "    " and resid 29   and name HD% )
   (  segid "    " and resid 25   and name HD1%)
      3.000     1.200     1.200 peak     7 spectrum    1 weight  0.10000E+01 volume  0.25582E-02 ppm1      7.331 ppm2      0.159 CV     1
 OR {    7}
   (  segid "    " and resid 29   and name HD% )
   (  segid "    " and resid 38   and name HD2%)
 ASSI {   14}
   (  segid "    " and resid 155  and name HD% )
   (  segid "    " and resid 153  and name HG2%)
      3.200     1.300     1.300 peak    14 spectrum    1 weight  0.10000E+01 volume  0.13697E-02 ppm1      7.202 ppm2      1.094 CV     1
 OR {   14}
   (  segid "    " and resid 155  and name HD% )
   (  segid "    " and resid 106  and name HB% )
 OR {   14}
   (  segid "    " and resid 155  and name HD% )
   (( segid "    " and resid 61   and name HG11))
 ASSI {   37}
   (  segid "    " and resid 35   and name HD% )
   (  segid "    " and resid 38   and name HD2%)
      2.900     1.000     1.000 peak    37 spectrum    1 weight  0.10000E+01 volume  0.37154E-02 ppm1      6.191 ppm2      0.169 CV     1
 OR {   37}
   (  segid "    " and resid 35   and name HD% )
   (  segid "    " and resid 25   and name HD1%)
 ASSI {   61}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 154  and name HB  ))
      2.300     0.700     0.700 peak    61 spectrum    1 weight  0.10000E+01 volume  0.39065E-02 ppm1      5.215 ppm2      4.557 CV     1
 OR {   61}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 61   and name HA  ))
 ASSI {   63}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 64   and name HG1 ))
      2.200     2.200     3.800 peak    63 spectrum    1 weight  0.10000E+01 volume  0.17979E-02 ppm1      7.163 ppm2      1.653 CV     1
 OR {   63}
   (  segid "    " and resid 65   and name HE% )
   (  segid "    " and resid 14   and name HB% )
 OR {   63}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 69   and name HB2 ))
 OR {   63}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 84   and name HG  ))
 ASSI {   69}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 156  and name HB2 ))
      3.200     1.200     1.200 peak    69 spectrum    1 weight  0.10000E+01 volume  0.13258E-02 ppm1      6.374 ppm2      2.339 CV     1
 OR {   69}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 156  and name HB2 ))
 ASSI {   80}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 153  and name HN  ))
      2.700     0.900     0.900 peak    80 spectrum    1 weight  0.10000E+01 volume  0.16310E-02 ppm1      5.179 ppm2      8.877 CV     1
 OR {   80}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 111  and name HN  ))
 ASSI {   84}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 113  and name HB  ))
      3.500     1.600     1.600 peak    84 spectrum    1 weight  0.10000E+01 volume  0.15070E-02 ppm1      5.176 ppm2      1.496 CV     1
 OR {   84}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 61   and name HB  ))
 ASSI {  109}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
      2.400     0.700     0.700 peak   109 spectrum    1 weight  0.10000E+01 volume  0.45441E-02 ppm1      5.256 ppm2      0.990 CV     1
 OR {  109}
   (( segid "    " and resid 69   and name HA  ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {  111}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 157  and name HN  ))
      3.400     3.400     2.600 peak   111 spectrum    1 weight  0.10000E+01 volume  0.14180E-02 ppm1      5.499 ppm2      9.150 CV     1
 OR {  111}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 112  and name HN  ))
 OR {  111}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
 ASSI {  114}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 151  and name HD22))
      3.500     1.500     1.500 peak   114 spectrum    1 weight  0.10000E+01 volume  0.12323E-02 ppm1      5.500 ppm2      7.081 CV     1
 OR {  114}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 112  and name HD22))
 ASSI {  118}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.700     1.700     1.700 peak   118 spectrum    1 weight  0.10000E+01 volume  0.15509E-02 ppm1      5.502 ppm2      1.689 CV     1
 OR {  118}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 152  and name HB1 ))
 ASSI {  126}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HD1 ))
      2.800     1.000     1.000 peak   126 spectrum    1 weight  0.10000E+01 volume  0.23111E-02 ppm1      5.329 ppm2      0.557 CV     1
 OR {  126}
   (( segid "    " and resid 60   and name HA  ))
   (  segid "    " and resid 61   and name HD1%)
 OR {  126}
   (( segid "    " and resid 84   and name HA  ))
   (  segid "    " and resid 71   and name HG1%)
 ASSI {  127}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB2 ))
      2.100     0.600     0.600 peak   127 spectrum    1 weight  0.10000E+01 volume  0.50851E-02 ppm1      5.322 ppm2      1.668 CV     1
 OR {  127}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 60   and name HB1 ))
 OR {  127}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 152  and name HB1 ))
 ASSI {  130}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 59   and name HD1 ))
      3.700     1.700     1.700 peak   130 spectrum    1 weight  0.10000E+01 volume  0.12674E-02 ppm1      5.326 ppm2      1.276 CV     1
 OR {  130}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 59   and name HG2 ))
 OR {  130}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 59   and name HG1 ))
 OR {  130}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 59   and name HD2 ))
 OR {  130}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 152  and name HG1 ))
 OR {  130}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 152  and name HG2 ))
 ASSI {  135}
   (( segid "    " and resid 86   and name HA  ))
   (  segid "    " and resid 86   and name HD2%)
      3.000     1.100     1.100 peak   135 spectrum    1 weight  0.10000E+01 volume  0.34450E-02 ppm1      5.589 ppm2      0.997 CV     1
 OR {  135}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 69   and name HB1 ))
 ASSI {  171}
   (  segid "    " and resid 29   and name HE% )
   (  segid "    " and resid 25   and name HD1%)
      2.900     1.000     1.000 peak   171 spectrum    1 weight  0.10000E+01 volume  0.25293E-02 ppm1      6.704 ppm2      0.136 CV     1
 OR {  171}
   (  segid "    " and resid 29   and name HE% )
   (  segid "    " and resid 38   and name HD2%)
 ASSI {  180}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 157  and name HG2 ))
      2.700     0.900     0.900 peak   180 spectrum    1 weight  0.10000E+01 volume  0.31322E-02 ppm1      6.728 ppm2      2.165 CV     1
 OR {  180}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 157  and name HG1 ))
 OR {  180}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 32   and name HB2 ))
 ASSI {  181}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 157  and name HB2 ))
      3.000     1.200     1.200 peak   181 spectrum    1 weight  0.10000E+01 volume  0.24631E-02 ppm1      6.728 ppm2      1.773 CV     1
 OR {  181}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 25   and name HB  ))
 ASSI {  188}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HA  ))
      2.600     2.600     3.400 peak   188 spectrum    1 weight  0.10000E+01 volume  0.27775E-02 ppm1      6.557 ppm2      4.348 CV     1
 OR {  188}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 52   and name HA  ))
 ASSI {  189}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HD2 ))
      2.900     1.100     1.100 peak   189 spectrum    1 weight  0.10000E+01 volume  0.15660E-02 ppm1      6.554 ppm2      3.675 CV     1
 OR {  189}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 116  and name HA  ))
 ASSI {  200}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 60   and name HD1 ))
      3.300     3.300     2.700 peak   200 spectrum    1 weight  0.10000E+01 volume  0.19937E-02 ppm1      3.018 ppm2      0.614 CV     1
 OR {  200}
   (( segid "    " and resid 62   and name HB  ))
   (  segid "    " and resid 119  and name HG2%)
 OR {  200}
   (( segid "    " and resid 62   and name HB  ))
   (  segid "    " and resid 113  and name HD1%)
 ASSI {  208}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HN  ))
      2.700     0.900     0.900 peak   208 spectrum    1 weight  0.10000E+01 volume  0.28520E-02 ppm1      3.418 ppm2      8.585 CV     1
 OR {  208}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  209}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HB  ))
      2.800     1.000     1.000 peak   209 spectrum    1 weight  0.10000E+01 volume  0.25732E-02 ppm1      3.419 ppm2      2.093 CV     1
 OR {  209}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
 ASSI {  210}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 21   and name HB% )
      2.300     2.300     3.700 peak   210 spectrum    1 weight  0.10000E+01 volume  0.10308E-01 ppm1      3.418 ppm2      1.410 CV     1
 OR {  210}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 140  and name HB% )
 ASSI {  211}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      2.200     0.600     0.600 peak   211 spectrum    1 weight  0.10000E+01 volume  0.13085E-01 ppm1      3.419 ppm2      0.873 CV     1
 OR {  211}
   (( segid "    " and resid 18   and name HA  ))
   (  segid "    " and resid 18   and name HG1%)
 OR {  211}
   (( segid "    " and resid 95   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  212}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 17   and name HA  ))
      3.700     1.700     1.700 peak   212 spectrum    1 weight  0.10000E+01 volume  0.13086E-02 ppm1      3.412 ppm2      3.997 CV     1
 OR {  212}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 OR {  212}
   (( segid "    " and resid 95   and name HA  ))
   (( segid "    " and resid 92   and name HA  ))
 OR {  212}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI {  215}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 24   and name HB% )
      3.500     1.500     1.500 peak   215 spectrum    1 weight  0.10000E+01 volume  0.12842E-02 ppm1      3.496 ppm2      1.459 CV     1
 OR {  215}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 100  and name HG  ))
 ASSI {  220}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      3.000     1.100     1.100 peak   220 spectrum    1 weight  0.10000E+01 volume  0.20290E-02 ppm1      3.485 ppm2      8.210 CV     1
 OR {  220}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
 ASSI {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 14   and name HA  ))
      3.600     1.600     1.600 peak   221 spectrum    1 weight  0.10000E+01 volume  0.15031E-02 ppm1      3.487 ppm2      4.026 CV     1
 OR {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 11   and name HA  ))
 OR {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 19   and name HA  ))
 OR {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HB1 ))
 OR {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
 OR {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
 OR {  221}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 12   and name HA  ))
 ASSI {  222}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 19   and name HB2 ))
      3.100     1.200     1.200 peak   222 spectrum    1 weight  0.10000E+01 volume  0.22560E-02 ppm1      3.485 ppm2      2.190 CV     1
 OR {  222}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 18   and name HB  ))
 OR {  222}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
 ASSI {  231}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 109  and name HD% )
      2.700     2.700     3.300 peak   231 spectrum    1 weight  0.10000E+01 volume  0.12746E-02 ppm1      3.373 ppm2      7.072 CV     1
 OR {  231}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
 ASSI {  234}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 102  and name HB2 ))
      3.300     1.400     1.400 peak   234 spectrum    1 weight  0.10000E+01 volume  0.17033E-02 ppm1      3.375 ppm2      1.678 CV     1
 OR {  234}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HB  ))
 ASSI {  238}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 67   and name HA1 ))
      3.500     3.500     2.500 peak   238 spectrum    1 weight  0.10000E+01 volume  0.51843E-02 ppm1      3.035 ppm2      3.948 CV     1
 OR {  238}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 66   and name HA1 ))
 OR {  238}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 67   and name HA1 ))
 OR {  238}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 66   and name HA1 ))
 ASSI {  240}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 64   and name HG1 ))
      2.400     0.700     0.700 peak   240 spectrum    1 weight  0.10000E+01 volume  0.34330E-02 ppm1      3.033 ppm2      1.654 CV     1
 OR {  240}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name HG1 ))
 OR {  240}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI {  241}
   (( segid "    " and resid 64   and name HD2 ))
   (  segid "    " and resid 86   and name HD2%)
      3.600     1.600     1.600 peak   241 spectrum    1 weight  0.10000E+01 volume  0.13911E-02 ppm1      3.032 ppm2      1.019 CV     1
 OR {  241}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 64   and name HB1 ))
 OR {  241}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 64   and name HB1 ))
 OR {  241}
   (( segid "    " and resid 64   and name HD1 ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {  246}
   (( segid "    " and resid 86   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
      2.800     1.000     1.000 peak   246 spectrum    1 weight  0.10000E+01 volume  0.32030E-02 ppm1      1.817 ppm2      0.996 CV     1
 OR {  246}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 69   and name HB1 ))
 ASSI {  292}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
      3.700     1.700     1.700 peak   292 spectrum    1 weight  0.10000E+01 volume  0.14171E-02 ppm1      0.996 ppm2      2.496 CV     1
 OR {  292}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 55   and name HB1 ))
 OR {  292}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 58   and name HB1 ))
 ASSI {  314}
   (( segid "    " and resid 88   and name HD1 ))
   (( segid "    " and resid 68   and name HB1 ))
      2.300     2.300     3.700 peak   314 spectrum    1 weight  0.10000E+01 volume  0.17662E-02 ppm1      3.197 ppm2      1.996 CV     1
 OR {  314}
   (( segid "    " and resid 54   and name HE2 ))
   (( segid "    " and resid 49   and name HB  ))
 OR {  314}
   (( segid "    " and resid 54   and name HE1 ))
   (( segid "    " and resid 49   and name HB  ))
 OR {  314}
   (( segid "    " and resid 54   and name HE2 ))
   (( segid "    " and resid 119  and name HB  ))
 ASSI {  338}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 109  and name HB2 ))
      2.700     2.700     3.300 peak   338 spectrum    1 weight  0.10000E+01 volume  0.47397E-02 ppm1      1.630 ppm2      3.018 CV     1
 OR {  338}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 109  and name HB2 ))
 OR {  338}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 64   and name HD2 ))
 OR {  338}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 70   and name HB2 ))
 ASSI {  339}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 109  and name HB1 ))
      2.900     1.100     1.100 peak   339 spectrum    1 weight  0.10000E+01 volume  0.35653E-02 ppm1      1.606 ppm2      2.777 CV     1
 OR {  339}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
 OR {  339}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 109  and name HB1 ))
 ASSI {  343}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 73   and name HD2 ))
      2.800     1.000     1.000 peak   343 spectrum    1 weight  0.10000E+01 volume  0.18051E-02 ppm1      1.535 ppm2      4.060 CV     1
 OR {  343}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 73   and name HD2 ))
 OR {  343}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 72   and name HA2 ))
 OR {  343}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 73   and name HD1 ))
 OR {  343}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 73   and name HD1 ))
 ASSI {  356}
   (( segid "    " and resid 54   and name HE1 ))
   (  segid "    " and resid 49   and name HG2%)
      2.500     2.500     3.500 peak   356 spectrum    1 weight  0.10000E+01 volume  0.15495E-02 ppm1      3.163 ppm2      1.215 CV     1
 OR {  356}
   (( segid "    " and resid 54   and name HE2 ))
   (  segid "    " and resid 49   and name HG2%)
 OR {  356}
   (( segid "    " and resid 54   and name HE2 ))
   (  segid "    " and resid 154  and name HG2%)
 OR {  356}
   (( segid "    " and resid 54   and name HE2 ))
   (( segid "    " and resid 116  and name HB2 ))
 ASSI {  371}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 43   and name HB2 ))
      3.400     1.400     1.400 peak   371 spectrum    1 weight  0.10000E+01 volume  0.14210E-02 ppm1      3.013 ppm2      2.044 CV     1
 OR {  371}
   (( segid "    " and resid 59   and name HE2 ))
   (( segid "    " and resid 88   and name HB2 ))
 OR {  371}
   (( segid "    " and resid 59   and name HE1 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {  372}
   (( segid "    " and resid 70   and name HB2 ))
   (  segid "    " and resid 71   and name HG1%)
      3.900     1.900     1.900 peak   372 spectrum    1 weight  0.10000E+01 volume  0.12662E-02 ppm1      3.014 ppm2      0.580 CV     1
 OR {  372}
   (( segid "    " and resid 10   and name HE1 ))
   (  segid "    " and resid 93   and name HB% )
 OR {  372}
   (( segid "    " and resid 59   and name HE1 ))
   (( segid "    " and resid 60   and name HD1 ))
 OR {  372}
   (( segid "    " and resid 10   and name HE2 ))
   (  segid "    " and resid 93   and name HB% )
 OR {  372}
   (( segid "    " and resid 59   and name HE2 ))
   (( segid "    " and resid 60   and name HD1 ))
 OR {  372}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 60   and name HD1 ))
 OR {  372}
   (( segid "    " and resid 59   and name HE2 ))
   (  segid "    " and resid 89   and name HD1%)
 OR {  372}
   (( segid "    " and resid 59   and name HE1 ))
   (  segid "    " and resid 89   and name HD1%)
 ASSI {  375}
   (( segid "    " and resid 59   and name HE2 ))
   (( segid "    " and resid 59   and name HB2 ))
      3.000     3.000     3.000 peak   375 spectrum    1 weight  0.10000E+01 volume  0.16850E-02 ppm1      2.975 ppm2      2.142 CV     1
 OR {  375}
   (( segid "    " and resid 59   and name HE1 ))
   (( segid "    " and resid 59   and name HB2 ))
 OR {  375}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR {  375}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  379}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 99   and name HA  ))
      3.300     1.300     1.300 peak   379 spectrum    1 weight  0.10000E+01 volume  0.20147E-02 ppm1      2.899 ppm2      4.290 CV     1
 OR {  379}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 6    and name HB2 ))
 OR {  379}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 6    and name HB1 ))
 ASSI {  386}
   (( segid "    " and resid 107  and name HE2 ))
   (( segid "    " and resid 107  and name HA  ))
      3.400     1.500     1.500 peak   386 spectrum    1 weight  0.10000E+01 volume  0.14821E-02 ppm1      2.831 ppm2      3.948 CV     1
 OR {  386}
   (( segid "    " and resid 107  and name HE2 ))
   (( segid "    " and resid 81   and name HA1 ))
 OR {  386}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI {  424}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 39   and name HB1 ))
      3.900     1.900     1.900 peak   424 spectrum    1 weight  0.10000E+01 volume  0.14766E-02 ppm1      1.509 ppm2      3.021 CV     1
 OR {  424}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 39   and name HB1 ))
 OR {  424}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI {  430}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HN  ))
      2.900     1.100     1.100 peak   430 spectrum    1 weight  0.10000E+01 volume  0.19606E-02 ppm1      2.815 ppm2      8.388 CV     1
 OR {  430}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HN  ))
 ASSI {  434}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 57   and name HN  ))
      3.500     1.500     1.500 peak   434 spectrum    1 weight  0.10000E+01 volume  0.12565E-02 ppm1      2.519 ppm2      8.388 CV     1
 OR {  434}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HN  ))
 ASSI {  440}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HN  ))
      3.000     1.100     1.100 peak   440 spectrum    1 weight  0.10000E+01 volume  0.19747E-02 ppm1      2.790 ppm2      8.341 CV     1
 OR {  440}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 8    and name HN  ))
 ASSI {  441}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
      3.000     1.100     1.100 peak   441 spectrum    1 weight  0.10000E+01 volume  0.29280E-02 ppm1      2.784 ppm2      4.631 CV     1
 OR {  441}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 132  and name HA  ))
 ASSI {  442}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 137  and name HD1 ))
      3.400     3.400     2.600 peak   442 spectrum    1 weight  0.10000E+01 volume  0.13430E-02 ppm1      2.773 ppm2      2.240 CV     1
 OR {  442}
   (( segid "    " and resid 7    and name HB1 ))
   (( segid "    " and resid 137  and name HD2 ))
 OR {  442}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI {  456}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      3.500     3.500     2.500 peak   456 spectrum    1 weight  0.10000E+01 volume  0.16418E-02 ppm1      3.018 ppm2      3.957 CV     1
 OR {  456}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 47   and name HB2 ))
 OR {  456}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 47   and name HB1 ))
 OR {  456}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 85   and name HB  ))
 ASSI {  458}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 60   and name HB2 ))
      2.400     2.400     3.600 peak   458 spectrum    1 weight  0.10000E+01 volume  0.22683E-02 ppm1      3.022 ppm2      1.658 CV     1
 OR {  458}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
 OR {  458}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 152  and name HB1 ))
 ASSI {  460}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 89   and name HB1 ))
      3.500     3.500     2.500 peak   460 spectrum    1 weight  0.10000E+01 volume  0.18181E-02 ppm1      3.022 ppm2      0.997 CV     1
 OR {  460}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 85   and name HG2%)
 OR {  460}
   (( segid "    " and resid 55   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
 OR {  460}
   (( segid "    " and resid 90   and name HB2 ))
   (  segid "    " and resid 97   and name HD1%)
 ASSI {  465}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 148  and name HA  ))
      2.900     1.100     1.100 peak   465 spectrum    1 weight  0.10000E+01 volume  0.21639E-02 ppm1      2.673 ppm2      4.729 CV     1
 OR {  465}
   (( segid "    " and resid 151  and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
 OR {  465}
   (( segid "    " and resid 151  and name HB2 ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI {  468}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 109  and name HA  ))
      2.900     1.100     1.100 peak   468 spectrum    1 weight  0.10000E+01 volume  0.15368E-02 ppm1      2.648 ppm2      5.510 CV     1
 OR {  468}
   (( segid "    " and resid 63   and name HB1 ))
   (( segid "    " and resid 63   and name HA  ))
 ASSI {  483}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 91   and name HN  ))
      3.500     1.500     1.500 peak   483 spectrum    1 weight  0.10000E+01 volume  0.18301E-02 ppm1      3.081 ppm2      8.033 CV     1
 OR {  483}
   (( segid "    " and resid 90   and name HB2 ))
   (( segid "    " and resid 92   and name HN  ))
 OR {  483}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 58   and name HN  ))
 ASSI {  488}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 91   and name HN  ))
      3.000     1.100     1.100 peak   488 spectrum    1 weight  0.10000E+01 volume  0.13742E-02 ppm1      2.874 ppm2      8.048 CV     1
 OR {  488}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 92   and name HN  ))
 ASSI {  491}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 25   and name HG12))
      3.600     1.600     1.600 peak   491 spectrum    1 weight  0.10000E+01 volume  0.15296E-02 ppm1      2.867 ppm2      1.345 CV     1
 OR {  491}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 25   and name HG11))
 OR {  491}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 28   and name HB1 ))
 OR {  491}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 143  and name HB% )
 OR {  491}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 91   and name HG1 ))
 ASSI {  495}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HN  ))
      2.700     0.900     0.900 peak   495 spectrum    1 weight  0.10000E+01 volume  0.40651E-02 ppm1      2.631 ppm2      8.048 CV     1
 OR {  495}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 118  and name HN  ))
 OR {  495}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 155  and name HN  ))
 ASSI {  497}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 35   and name HE% )
      3.800     1.800     1.800 peak   497 spectrum    1 weight  0.10000E+01 volume  0.12982E-02 ppm1      2.631 ppm2      6.828 CV     1
 OR {  497}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 118  and name HD22))
 OR {  497}
   (( segid "    " and resid 29   and name HB1 ))
   (  segid "    " and resid 35   and name HE% )
 ASSI {  501}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 25   and name HG2%)
      3.600     1.600     1.600 peak   501 spectrum    1 weight  0.10000E+01 volume  0.13712E-02 ppm1      2.613 ppm2      0.551 CV     1
 OR {  501}
   (( segid "    " and resid 118  and name HB1 ))
   (  segid "    " and resid 119  and name HG2%)
 OR {  501}
   (( segid "    " and resid 63   and name HB1 ))
   (  segid "    " and resid 61   and name HD1%)
 OR {  501}
   (( segid "    " and resid 155  and name HB1 ))
   (  segid "    " and resid 102  and name HD1%)
 OR {  501}
   (( segid "    " and resid 29   and name HB1 ))
   (  segid "    " and resid 25   and name HG2%)
 OR {  501}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 71   and name HG1%)
 ASSI {  505}
   (( segid "    " and resid 127  and name HB1 ))
   (  segid "    " and resid 143  and name HB% )
      3.600     1.600     1.600 peak   505 spectrum    1 weight  0.10000E+01 volume  0.15317E-02 ppm1      2.428 ppm2      1.345 CV     1
 OR {  505}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HG1 ))
 OR {  505}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HG2 ))
 ASSI {  508}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 93   and name HB% )
      3.100     3.100     2.900 peak   508 spectrum    1 weight  0.10000E+01 volume  0.23155E-02 ppm1      1.780 ppm2      0.523 CV     1
 OR {  508}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 102  and name HD1%)
 OR {  508}
   (( segid "    " and resid 97   and name HB1 ))
   (  segid "    " and resid 93   and name HB% )
 OR {  508}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 61   and name HD1%)
 OR {  508}
   (( segid "    " and resid 97   and name HB2 ))
   (  segid "    " and resid 102  and name HD1%)
 ASSI {  517}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 78   and name HN  ))
      2.800     1.000     1.000 peak   517 spectrum    1 weight  0.10000E+01 volume  0.28988E-02 ppm1      2.864 ppm2      8.104 CV     1
 OR {  517}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI {  518}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.100     1.200     1.200 peak   518 spectrum    1 weight  0.10000E+01 volume  0.22104E-02 ppm1      2.868 ppm2      8.341 CV     1
 OR {  518}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
 OR {  518}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 93   and name HN  ))
 OR {  518}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
 OR {  518}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 8    and name HN  ))
 OR {  518}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 8    and name HN  ))
 ASSI {  519}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HN  ))
      2.800     1.000     1.000 peak   519 spectrum    1 weight  0.10000E+01 volume  0.27924E-02 ppm1      2.866 ppm2      7.609 CV     1
 OR {  519}
   (( segid "    " and resid 77   and name HB1 ))
   (( segid "    " and resid 77   and name HD21))
 ASSI {  521}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 18   and name HG1%)
      3.700     1.700     1.700 peak   521 spectrum    1 weight  0.10000E+01 volume  0.13636E-02 ppm1      2.848 ppm2      0.873 CV     1
 OR {  521}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 111  and name HG1%)
 OR {  521}
   (( segid "    " and resid 63   and name HB2 ))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {  539}
   (( segid "    " and resid 101  and name HB2 ))
   (  segid "    " and resid 15   and name HD1%)
      2.900     2.900     3.100 peak   539 spectrum    1 weight  0.10000E+01 volume  0.18258E-02 ppm1      3.124 ppm2      0.922 CV     1
 OR {  539}
   (( segid "    " and resid 26   and name HB2 ))
   (  segid "    " and resid 30   and name HD1%)
 OR {  539}
   (( segid "    " and resid 26   and name HB2 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI {  547}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.000     1.100     1.100 peak   547 spectrum    1 weight  0.10000E+01 volume  0.22426E-02 ppm1      2.886 ppm2      8.338 CV     1
 OR {  547}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HN  ))
 OR {  547}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 93   and name HN  ))
 OR {  547}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
 OR {  547}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 8    and name HN  ))
 ASSI {  548}
   (( segid "    " and resid 124  and name HB2 ))
   (( segid "    " and resid 131  and name HB2 ))
      3.800     1.800     1.800 peak   548 spectrum    1 weight  0.10000E+01 volume  0.14355E-02 ppm1      2.893 ppm2      2.162 CV     1
 OR {  548}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 32   and name HB2 ))
 ASSI {  549}
   (( segid "    " and resid 13   and name HB1 ))
   (  segid "    " and resid 14   and name HB% )
      3.300     1.300     1.300 peak   549 spectrum    1 weight  0.10000E+01 volume  0.20404E-02 ppm1      2.852 ppm2      1.654 CV     1
 OR {  549}
   (( segid "    " and resid 13   and name HB2 ))
   (  segid "    " and resid 14   and name HB% )
 OR {  549}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 28   and name HG  ))
 OR {  549}
   (( segid "    " and resid 155  and name HB2 ))
   (( segid "    " and resid 157  and name HB1 ))
 OR {  549}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 91   and name HD2 ))
 ASSI {  552}
   (( segid "    " and resid 155  and name HB2 ))
   (( segid "    " and resid 156  and name HN  ))
      2.700     0.900     0.900 peak   552 spectrum    1 weight  0.10000E+01 volume  0.25403E-02 ppm1      2.809 ppm2      8.488 CV     1
 OR {  552}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  557}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 45   and name HD21))
      2.700     0.900     0.900 peak   557 spectrum    1 weight  0.10000E+01 volume  0.28844E-02 ppm1      2.722 ppm2      7.598 CV     1
 OR {  557}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 76   and name HD21))
 OR {  557}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HD21))
 OR {  557}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HD21))
 ASSI {  559}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 82   and name HN  ))
      3.600     1.700     1.700 peak   559 spectrum    1 weight  0.10000E+01 volume  0.17334E-02 ppm1      2.713 ppm2      8.048 CV     1
 OR {  559}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 44   and name HN  ))
 ASSI {  561}
   (( segid "    " and resid 45   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
      3.700     1.700     1.700 peak   561 spectrum    1 weight  0.10000E+01 volume  0.14423E-02 ppm1      2.713 ppm2      7.023 CV     1
 OR {  561}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
 OR {  561}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 74   and name HN  ))
 ASSI {  562}
   (( segid "    " and resid 76   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
      3.000     3.000     3.000 peak   562 spectrum    1 weight  0.10000E+01 volume  0.38059E-02 ppm1      2.711 ppm2      4.729 CV     1
 OR {  562}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
 OR {  562}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 77   and name HA  ))
 ASSI {  564}
   (( segid "    " and resid 75   and name HB2 ))
   (  segid "    " and resid 79   and name HB% )
      3.300     1.400     1.400 peak   564 spectrum    1 weight  0.10000E+01 volume  0.22079E-02 ppm1      2.712 ppm2      1.654 CV     1
 OR {  564}
   (( segid "    " and resid 80   and name HB1 ))
   (  segid "    " and resid 79   and name HB% )
 OR {  564}
   (( segid "    " and resid 75   and name HB1 ))
   (  segid "    " and resid 79   and name HB% )
 OR {  564}
   (( segid "    " and resid 76   and name HB1 ))
   (  segid "    " and resid 79   and name HB% )
 ASSI {  581}
   (( segid "    " and resid 127  and name HB1 ))
   (  segid "    " and resid 147  and name HG2%)
      3.600     1.600     1.600 peak   581 spectrum    1 weight  0.10000E+01 volume  0.14039E-02 ppm1      2.452 ppm2      1.263 CV     1
 OR {  581}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HD1 ))
 OR {  581}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 59   and name HD2 ))
 OR {  581}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 152  and name HG1 ))
 OR {  581}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR {  581}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR {  581}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 113  and name HG12))
 OR {  581}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 113  and name HG11))
 ASSI {  588}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HN  ))
      2.500     0.800     0.800 peak   588 spectrum    1 weight  0.10000E+01 volume  0.42639E-02 ppm1      3.120 ppm2      8.585 CV     1
 OR {  588}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 77   and name HN  ))
 ASSI {  590}
   (( segid "    " and resid 77   and name HB2 ))
   (( segid "    " and resid 33   and name HA  ))
      2.700     2.700     3.300 peak   590 spectrum    1 weight  0.10000E+01 volume  0.17560E-02 ppm1      3.114 ppm2      4.290 CV     1
 OR {  590}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 99   and name HA  ))
 OR {  590}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 29   and name HA  ))
 ASSI {  594}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 65   and name HA  ))
      2.500     0.800     0.800 peak   594 spectrum    1 weight  0.10000E+01 volume  0.37647E-02 ppm1      2.804 ppm2      4.592 CV     1
 OR {  594}
   (( segid "    " and resid 13   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR {  594}
   (( segid "    " and resid 13   and name HB1 ))
   (( segid "    " and resid 13   and name HA  ))
 ASSI {  595}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HA  ))
      2.800     1.000     1.000 peak   595 spectrum    1 weight  0.10000E+01 volume  0.21151E-02 ppm1      2.737 ppm2      4.583 CV     1
 OR {  595}
   (( segid "    " and resid 75   and name HB1 ))
   (( segid "    " and resid 75   and name HA  ))
 OR {  595}
   (( segid "    " and resid 75   and name HB2 ))
   (( segid "    " and resid 75   and name HA  ))
 ASSI {  604}
   (( segid "    " and resid 30   and name HB  ))
   (  segid "    " and resid 30   and name HG2%)
      2.500     0.800     0.800 peak   604 spectrum    1 weight  0.10000E+01 volume  0.56285E-02 ppm1      1.992 ppm2      1.070 CV     1
 OR {  604}
   (( segid "    " and resid 49   and name HB  ))
   (  segid "    " and resid 49   and name HD1%)
 ASSI {  626}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HA  ))
      3.300     3.300     2.700 peak   626 spectrum    1 weight  0.10000E+01 volume  0.14104E-02 ppm1      2.311 ppm2      3.961 CV     1
 OR {  626}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 139  and name HA  ))
 OR {  626}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 85   and name HB  ))
 ASSI {  631}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 135  and name HN  ))
      2.900     1.000     1.000 peak   631 spectrum    1 weight  0.10000E+01 volume  0.25877E-02 ppm1      1.678 ppm2      8.657 CV     1
 OR {  631}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 136  and name HN  ))
 ASSI {  634}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 85   and name HG2%)
      3.500     1.500     1.500 peak   634 spectrum    1 weight  0.10000E+01 volume  0.13520E-02 ppm1      1.667 ppm2      1.019 CV     1
 OR {  634}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 85   and name HG2%)
 OR {  634}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 89   and name HB1 ))
 OR {  634}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 89   and name HB1 ))
 OR {  634}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
 OR {  634}
   (( segid "    " and resid 152  and name HB1 ))
   (  segid "    " and resid 150  and name HG2%)
 OR {  634}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {  648}
   (( segid "    " and resid 152  and name HB2 ))
   (( segid "    " and resid 152  and name HB1 ))
      1.400     0.300     0.800 peak   648 spectrum    1 weight  0.10000E+01 volume  0.19592E-01 ppm1      1.825 ppm2      1.703 CV     1
 OR {  648}
   (( segid "    " and resid 152  and name HB2 ))
   (( segid "    " and resid 60   and name HB1 ))
 OR {  648}
   (( segid "    " and resid 152  and name HB2 ))
   (( segid "    " and resid 60   and name HB2 ))
 ASSI {  650}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 60   and name HA  ))
      2.500     0.800     0.800 peak   650 spectrum    1 weight  0.10000E+01 volume  0.20158E-02 ppm1      1.714 ppm2      5.305 CV     1
 OR {  650}
   (( segid "    " and resid 71   and name HB  ))
   (( segid "    " and resid 71   and name HA  ))
 OR {  650}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
 ASSI {  651}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 87   and name HG2%)
      2.900     1.100     1.100 peak   651 spectrum    1 weight  0.10000E+01 volume  0.28047E-02 ppm1      1.711 ppm2      1.068 CV     1
 OR {  651}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 87   and name HG2%)
 OR {  651}
   (( segid "    " and resid 60   and name HB2 ))
   (  segid "    " and resid 85   and name HG2%)
 OR {  651}
   (( segid "    " and resid 60   and name HB1 ))
   (  segid "    " and resid 85   and name HG2%)
 OR {  651}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 61   and name HG12))
 OR {  651}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 61   and name HG12))
 ASSI {  655}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 59   and name HE1 ))
      3.600     1.600     1.600 peak   655 spectrum    1 weight  0.10000E+01 volume  0.12517E-02 ppm1      1.689 ppm2      2.993 CV     1
 OR {  655}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 59   and name HE2 ))
 OR {  655}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 59   and name HE1 ))
 OR {  655}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 59   and name HE2 ))
 OR {  655}
   (( segid "    " and resid 152  and name HB1 ))
   (( segid "    " and resid 112  and name HB1 ))
 OR {  655}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 62   and name HB  ))
 OR {  655}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 62   and name HB  ))
 OR {  655}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 112  and name HB1 ))
 ASSI {  656}
   (( segid "    " and resid 152  and name HB1 ))
   (( segid "    " and resid 54   and name HB2 ))
      3.700     1.700     1.700 peak   656 spectrum    1 weight  0.10000E+01 volume  0.12401E-02 ppm1      1.694 ppm2      2.191 CV     1
 OR {  656}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 54   and name HB2 ))
 OR {  656}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 54   and name HB2 ))
 ASSI {  657}
   (( segid "    " and resid 152  and name HB1 ))
   (( segid "    " and resid 152  and name HG1 ))
      2.500     0.800     0.800 peak   657 spectrum    1 weight  0.10000E+01 volume  0.40448E-02 ppm1      1.685 ppm2      1.253 CV     1
 OR {  657}
   (( segid "    " and resid 152  and name HB1 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR {  657}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 152  and name HG1 ))
 OR {  657}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR {  657}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 152  and name HG1 ))
 ASSI {  659}
   (( segid "    " and resid 152  and name HB1 ))
   (  segid "    " and resid 153  and name HG1%)
      3.100     3.100     2.900 peak   659 spectrum    1 weight  0.10000E+01 volume  0.22986E-02 ppm1      1.622 ppm2      1.079 CV     1
 OR {  659}
   (( segid "    " and resid 152  and name HB1 ))
   (  segid "    " and resid 153  and name HG2%)
 OR {  659}
   (( segid "    " and resid 131  and name HB1 ))
   (  segid "    " and resid 134  and name HB% )
 ASSI {  666}
   (( segid "    " and resid 112  and name HB2 ))
   (  segid "    " and resid 111  and name HG2%)
      3.800     1.800     1.800 peak   666 spectrum    1 weight  0.10000E+01 volume  0.13231E-02 ppm1      3.459 ppm2      0.928 CV     1
 OR {  666}
   (( segid "    " and resid 94   and name HB2 ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI {  675}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 118  and name HB1 ))
      3.300     1.300     1.300 peak   675 spectrum    1 weight  0.10000E+01 volume  0.14110E-02 ppm1      3.036 ppm2      2.581 CV     1
 OR {  675}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 128  and name HG2 ))
 ASSI {  683}
   (( segid "    " and resid 35   and name HB2 ))
   (  segid "    " and resid 38   and name HD2%)
      4.100     2.100     1.900 peak   683 spectrum    1 weight  0.10000E+01 volume  0.14246E-02 ppm1      2.702 ppm2      0.180 CV     1
 OR {  683}
   (( segid "    " and resid 35   and name HB2 ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI {  689}
   (( segid "    " and resid 153  and name HB  ))
   (( segid "    " and resid 61   and name HB  ))
      2.800     2.800     3.200 peak   689 spectrum    1 weight  0.10000E+01 volume  0.44656E-02 ppm1      2.507 ppm2      1.486 CV     1
 OR {  689}
   (( segid "    " and resid 153  and name HB  ))
   (( segid "    " and resid 113  and name HB  ))
 ASSI {  704}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 133  and name HB  ))
      1.900     1.900     4.100 peak   704 spectrum    1 weight  0.10000E+01 volume  0.39019E-02 ppm1      2.272 ppm2      4.339 CV     1
 OR {  704}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 133  and name HB  ))
 OR {  704}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  727}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 61   and name HG2%)
      2.200     0.600     0.600 peak   727 spectrum    1 weight  0.10000E+01 volume  0.61619E-02 ppm1      1.531 ppm2      0.922 CV     1
 OR {  727}
   (( segid "    " and resid 116  and name HG2 ))
   (( segid "    " and resid 116  and name HB1 ))
 ASSI {  728}
   (( segid "    " and resid 61   and name HB  ))
   (  segid "    " and resid 61   and name HD1%)
      2.300     0.700     0.700 peak   728 spectrum    1 weight  0.10000E+01 volume  0.77877E-02 ppm1      1.533 ppm2      0.531 CV     1
 OR {  728}
   (( segid "    " and resid 116  and name HG2 ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI {  740}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 12   and name HB2 ))
      2.700     0.900     0.900 peak   740 spectrum    1 weight  0.10000E+01 volume  0.36169E-02 ppm1      2.495 ppm2      2.191 CV     1
 OR {  740}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HB1 ))
 OR {  740}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HB1 ))
 OR {  740}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  752}
   (( segid "    " and resid 157  and name HG2 ))
   (( segid "    " and resid 157  and name HB1 ))
      2.700     0.900     0.900 peak   752 spectrum    1 weight  0.10000E+01 volume  0.25897E-02 ppm1      2.159 ppm2      1.654 CV     1
 OR {  752}
   (( segid "    " and resid 157  and name HG1 ))
   (( segid "    " and resid 157  and name HB1 ))
 OR {  752}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HD1 ))
 OR {  752}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HD2 ))
 ASSI {  754}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 150  and name HG2%)
      3.000     3.000     3.000 peak   754 spectrum    1 weight  0.10000E+01 volume  0.16181E-02 ppm1      2.162 ppm2      0.971 CV     1
 OR {  754}
   (( segid "    " and resid 157  and name HG1 ))
   (( segid "    " and resid 107  and name HB1 ))
 OR {  754}
   (( segid "    " and resid 54   and name HB2 ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI {  756}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 53   and name HB1 ))
      2.700     2.700     3.300 peak   756 spectrum    1 weight  0.10000E+01 volume  0.55323E-02 ppm1      2.139 ppm2      2.386 CV     1
 OR {  756}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 52   and name HB1 ))
 ASSI {  777}
   (( segid "    " and resid 111  and name HB  ))
   (  segid "    " and resid 143  and name HB% )
      2.900     2.900     3.100 peak   777 spectrum    1 weight  0.10000E+01 volume  0.48268E-02 ppm1      2.241 ppm2      1.350 CV     1
 OR {  777}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 131  and name HD1 ))
 OR {  777}
   (( segid "    " and resid 32   and name HG1 ))
   (( segid "    " and resid 25   and name HG12))
 OR {  777}
   (( segid "    " and resid 32   and name HG1 ))
   (( segid "    " and resid 25   and name HG11))
 ASSI {  786}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 86   and name HB1 ))
      4.000     2.000     2.000 peak   786 spectrum    1 weight  0.10000E+01 volume  0.22289E-02 ppm1      2.008 ppm2      1.410 CV     1
 OR {  786}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 64   and name HG2 ))
 OR {  786}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 88   and name HG1 ))
 ASSI {  789}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 43   and name HB2 ))
      2.700     2.700     3.300 peak   789 spectrum    1 weight  0.10000E+01 volume  0.10309E-01 ppm1      1.814 ppm2      1.996 CV     1
 OR {  789}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 49   and name HB  ))
 ASSI {  806}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 153  and name HB  ))
      2.900     2.900     3.100 peak   806 spectrum    1 weight  0.10000E+01 volume  0.32327E-02 ppm1      2.184 ppm2      2.484 CV     1
 OR {  806}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI {  808}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 68   and name HN  ))
      2.700     0.900     0.900 peak   808 spectrum    1 weight  0.10000E+01 volume  0.22112E-02 ppm1      2.112 ppm2      8.237 CV     1
 OR {  808}
   (( segid "    " and resid 68   and name HB2 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  810}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HN  ))
      3.400     1.500     1.500 peak   810 spectrum    1 weight  0.10000E+01 volume  0.23534E-02 ppm1      1.971 ppm2      8.228 CV     1
 OR {  810}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 69   and name HN  ))
 ASSI {  812}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 68   and name HB2 ))
      1.900     0.400     0.400 peak   812 spectrum    1 weight  0.10000E+01 volume  0.10014E-01 ppm1      1.974 ppm2      2.070 CV     1
 OR {  812}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 137  and name HG2 ))
 OR {  812}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 137  and name HG1 ))
 ASSI {  813}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 87   and name HG2%)
      3.800     1.800     1.800 peak   813 spectrum    1 weight  0.10000E+01 volume  0.13172E-02 ppm1      1.972 ppm2      1.071 CV     1
 OR {  813}
   (( segid "    " and resid 68   and name HB1 ))
   (  segid "    " and resid 86   and name HD1%)
 ASSI {  815}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 107  and name HE2 ))
      3.200     1.300     1.300 peak   815 spectrum    1 weight  0.10000E+01 volume  0.12756E-02 ppm1      1.031 ppm2      2.797 CV     1
 OR {  815}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 107  and name HE1 ))
 OR {  815}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 80   and name HB1 ))
 ASSI {  822}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HB1 ))
      1.600     0.300     0.600 peak   822 spectrum    1 weight  0.10000E+01 volume  0.96066E-02 ppm1      2.520 ppm2      1.019 CV     1
 OR {  822}
   (( segid "    " and resid 64   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
 ASSI {  835}
   (( segid "    " and resid 91   and name HB1 ))
   (( segid "    " and resid 91   and name HG1 ))
      2.900     1.000     1.000 peak   835 spectrum    1 weight  0.10000E+01 volume  0.20736E-02 ppm1      1.897 ppm2      1.410 CV     1
 OR {  835}
   (( segid "    " and resid 91   and name HB2 ))
   (( segid "    " and resid 91   and name HG1 ))
 OR {  835}
   (( segid "    " and resid 139  and name HB1 ))
   (  segid "    " and resid 140  and name HB% )
 ASSI {  837}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
      2.100     2.100     3.900 peak   837 spectrum    1 weight  0.10000E+01 volume  0.28484E-02 ppm1      1.785 ppm2      7.999 CV     1
 OR {  837}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 44   and name HN  ))
 OR {  837}
   (( segid "    " and resid 157  and name HB2 ))
   (( segid "    " and resid 105  and name HN  ))
 OR {  837}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 155  and name HN  ))
 ASSI {  857}
   (( segid "    " and resid 19   and name HB2 ))
   (  segid "    " and resid 15   and name HG2%)
      2.900     1.000     1.000 peak   857 spectrum    1 weight  0.10000E+01 volume  0.20154E-02 ppm1      2.197 ppm2      0.934 CV     1
 OR {  857}
   (( segid "    " and resid 19   and name HB1 ))
   (  segid "    " and resid 15   and name HG2%)
 OR {  857}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 38   and name HG  ))
 ASSI {  863}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 137  and name HA  ))
      2.500     0.800     0.800 peak   863 spectrum    1 weight  0.10000E+01 volume  0.60625E-02 ppm1      2.405 ppm2      3.997 CV     1
 OR {  863}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 139  and name HA  ))
 OR {  863}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  866}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 138  and name HB% )
      3.500     1.600     1.600 peak   866 spectrum    1 weight  0.10000E+01 volume  0.20531E-02 ppm1      2.400 ppm2      1.388 CV     1
 OR {  866}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 98   and name HB% )
 OR {  866}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 126  and name HB% )
 OR {  866}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 140  and name HB% )
 OR {  866}
   (( segid "    " and resid 137  and name HB2 ))
   (  segid "    " and resid 138  and name HB% )
 ASSI {  869}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 71   and name HB  ))
      2.600     2.600     3.400 peak   869 spectrum    1 weight  0.10000E+01 volume  0.76150E-02 ppm1      2.158 ppm2      1.752 CV     1
 OR {  869}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 97   and name HB2 ))
 OR {  869}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 71   and name HB  ))
 OR {  869}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI {  873}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 91   and name HD2 ))
      2.900     2.900     3.100 peak   873 spectrum    1 weight  0.10000E+01 volume  0.18253E-02 ppm1      2.156 ppm2      1.632 CV     1
 OR {  873}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 84   and name HG  ))
 OR {  873}
   (( segid "    " and resid 73   and name HB2 ))
   (  segid "    " and resid 79   and name HB% )
 OR {  873}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 84   and name HG  ))
 OR {  873}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 102  and name HB1 ))
 OR {  873}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 79   and name HB% )
 OR {  873}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 14   and name HB% )
 ASSI {  874}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 95   and name HN  ))
      2.500     0.800     0.800 peak   874 spectrum    1 weight  0.10000E+01 volume  0.42046E-02 ppm1      2.106 ppm2      8.585 CV     1
 OR {  874}
   (( segid "    " and resid 18   and name HB  ))
   (( segid "    " and resid 19   and name HN  ))
 ASSI {  875}
   (( segid "    " and resid 95   and name HB  ))
   (( segid "    " and resid 92   and name HA  ))
      2.900     1.000     1.000 peak   875 spectrum    1 weight  0.10000E+01 volume  0.29306E-02 ppm1      2.107 ppm2      3.997 CV     1
 OR {  875}
   (( segid "    " and resid 18   and name HB  ))
   (( segid "    " and resid 17   and name HA  ))
 OR {  875}
   (( segid "    " and resid 18   and name HB  ))
   (( segid "    " and resid 21   and name HA  ))
 ASSI {  876}
   (( segid "    " and resid 18   and name HB  ))
   (  segid "    " and resid 18   and name HG1%)
      2.100     0.500     0.500 peak   876 spectrum    1 weight  0.10000E+01 volume  0.13097E-01 ppm1      2.107 ppm2      0.873 CV     1
 OR {  876}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 95   and name HG2%)
 OR {  876}
   (( segid "    " and resid 95   and name HB  ))
   (  segid "    " and resid 95   and name HG1%)
 OR {  876}
   (( segid "    " and resid 18   and name HB  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI {  877}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 137  and name HA  ))
      2.600     0.800     0.800 peak   877 spectrum    1 weight  0.10000E+01 volume  0.33178E-02 ppm1      1.959 ppm2      3.968 CV     1
 OR {  877}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 17   and name HA  ))
 ASSI {  878}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 17   and name HG2 ))
      1.900     0.400     0.400 peak   878 spectrum    1 weight  0.10000E+01 volume  0.79555E-02 ppm1      1.961 ppm2      2.386 CV     1
 OR {  878}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 137  and name HB2 ))
 ASSI {  889}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HA  ))
      3.100     1.200     1.200 peak   889 spectrum    1 weight  0.10000E+01 volume  0.22830E-02 ppm1      2.179 ppm2      4.076 CV     1
 OR {  889}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HD2 ))
 OR {  889}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 36   and name HA  ))
 OR {  889}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HD1 ))
 OR {  889}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HD1 ))
 OR {  889}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HD2 ))
 ASSI {  900}
   (( segid "    " and resid 54   and name HG1 ))
   (( segid "    " and resid 51   and name HA  ))
      3.200     1.300     1.300 peak   900 spectrum    1 weight  0.10000E+01 volume  0.14414E-02 ppm1      2.175 ppm2      4.188 CV     1
 OR {  900}
   (( segid "    " and resid 54   and name HG2 ))
   (( segid "    " and resid 51   and name HA  ))
 OR {  900}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 20   and name HA  ))
 ASSI {  903}
   (( segid "    " and resid 15   and name HG12))
   (  segid "    " and resid 100  and name HD2%)
      2.500     2.500     3.500 peak   903 spectrum    1 weight  0.10000E+01 volume  0.59977E-02 ppm1      1.972 ppm2      0.895 CV     1
 OR {  903}
   (( segid "    " and resid 15   and name HG11))
   (  segid "    " and resid 100  and name HD2%)
 OR {  903}
   (( segid "    " and resid 15   and name HG12))
   (  segid "    " and resid 18   and name HG2%)
 ASSI {  945}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HE2 ))
      2.700     0.900     0.900 peak   945 spectrum    1 weight  0.10000E+01 volume  0.63724E-02 ppm1      1.623 ppm2      3.021 CV     1
 OR {  945}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HE1 ))
 OR {  945}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 55   and name HB2 ))
 ASSI {  946}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
      2.600     2.600     3.400 peak   946 spectrum    1 weight  0.10000E+01 volume  0.33124E-02 ppm1      1.608 ppm2      4.727 CV     1
 OR {  946}
   (( segid "    " and resid 91   and name HD2 ))
   (( segid "    " and resid 148  and name HA  ))
 OR {  946}
   (( segid "    " and resid 91   and name HD1 ))
   (( segid "    " and resid 148  and name HA  ))
 ASSI {  948}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 87   and name HG2%)
      2.500     2.500     3.500 peak   948 spectrum    1 weight  0.10000E+01 volume  0.71655E-02 ppm1      1.609 ppm2      1.068 CV     1
 OR {  948}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 61   and name HG12))
 OR {  948}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 61   and name HG11))
 OR {  948}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 153  and name HG2%)
 OR {  948}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 153  and name HG1%)
 OR {  948}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 86   and name HD1%)
 ASSI {  955}
   (( segid "    " and resid 131  and name HG1 ))
   (( segid "    " and resid 135  and name HB  ))
      2.800     2.800     3.200 peak   955 spectrum    1 weight  0.10000E+01 volume  0.51548E-02 ppm1      1.406 ppm2      1.703 CV     1
 OR {  955}
   (( segid "    " and resid 131  and name HG2 ))
   (( segid "    " and resid 135  and name HB  ))
 OR {  955}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 30   and name HG12))
 OR {  955}
   (( segid "    " and resid 25   and name HG11))
   (( segid "    " and resid 30   and name HG12))
 OR {  955}
   (( segid "    " and resid 25   and name HG11))
   (( segid "    " and resid 30   and name HG11))
 OR {  955}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 30   and name HG11))
 OR {  955}
   (( segid "    " and resid 25   and name HG12))
   (( segid "    " and resid 84   and name HB2 ))
 ASSI {  966}
   (( segid "    " and resid 50   and name HG2 ))
   (  segid "    " and resid 43   and name HD1%)
      3.700     1.700     1.700 peak   966 spectrum    1 weight  0.10000E+01 volume  0.12672E-02 ppm1      2.147 ppm2      0.922 CV     1
 OR {  966}
   (( segid "    " and resid 17   and name HB2 ))
   (  segid "    " and resid 18   and name HG2%)
 OR {  966}
   (( segid "    " and resid 59   and name HB2 ))
   (  segid "    " and resid 61   and name HG2%)
 ASSI {  973}
   (( segid "    " and resid 42   and name HG12))
   (  segid "    " and resid 41   and name HG2%)
      2.100     2.100     3.900 peak   973 spectrum    1 weight  0.10000E+01 volume  0.18078E-01 ppm1      1.716 ppm2      1.312 CV     1
 OR {  973}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 59   and name HG2 ))
 OR {  973}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 152  and name HG1 ))
 OR {  973}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 59   and name HG1 ))
 OR {  973}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR {  973}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 89   and name HG  ))
 ASSI {  977}
   (( segid "    " and resid 30   and name HG12))
   (  segid "    " and resid 30   and name HD1%)
      2.000     0.500     0.500 peak   977 spectrum    1 weight  0.10000E+01 volume  0.14390E-01 ppm1      1.696 ppm2      0.925 CV     1
 OR {  977}
   (( segid "    " and resid 42   and name HG11))
   (  segid "    " and resid 42   and name HD1%)
 OR {  977}
   (( segid "    " and resid 30   and name HG11))
   (  segid "    " and resid 30   and name HD1%)
 OR {  977}
   (( segid "    " and resid 42   and name HG12))
   (  segid "    " and resid 42   and name HD1%)
 ASSI {  980}
   (( segid "    " and resid 152  and name HD1 ))
   (( segid "    " and resid 152  and name HG2 ))
      2.300     0.600     0.600 peak   980 spectrum    1 weight  0.10000E+01 volume  0.65623E-02 ppm1      1.632 ppm2      1.263 CV     1
 OR {  980}
   (( segid "    " and resid 152  and name HD2 ))
   (( segid "    " and resid 152  and name HG1 ))
 OR {  980}
   (( segid "    " and resid 91   and name HD1 ))
   (( segid "    " and resid 91   and name HG2 ))
 OR {  980}
   (( segid "    " and resid 91   and name HD2 ))
   (( segid "    " and resid 91   and name HG2 ))
 OR {  980}
   (( segid "    " and resid 152  and name HD2 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR {  980}
   (( segid "    " and resid 152  and name HD1 ))
   (( segid "    " and resid 152  and name HG1 ))
 ASSI {  983}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 129  and name HA  ))
      3.300     1.400     1.400 peak   983 spectrum    1 weight  0.10000E+01 volume  0.18679E-02 ppm1      1.318 ppm2      4.059 CV     1
 OR {  983}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 129  and name HA  ))
 OR {  983}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 108  and name HA1 ))
 ASSI {  989}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 69   and name HG  ))
      1.900     1.900     4.100 peak   989 spectrum    1 weight  0.10000E+01 volume  0.16270E-01 ppm1      0.915 ppm2      1.430 CV     1
 OR {  989}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 86   and name HB1 ))
 OR {  989}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 86   and name HB1 ))
 OR {  989}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 64   and name HG2 ))
 OR {  989}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 1005}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      2.300     0.700     0.700 peak  1005 spectrum    1 weight  0.10000E+01 volume  0.39420E-02 ppm1      2.081 ppm2      3.948 CV     1
 OR { 1005}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 67   and name HA1 ))
 ASSI { 1011}
   (( segid "    " and resid 88   and name HB2 ))
   (  segid "    " and resid 86   and name HD1%)
      3.800     1.800     1.800 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.12414E-02 ppm1      2.040 ppm2      1.031 CV     1
 OR { 1011}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI { 1016}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 86   and name HB1 ))
      3.100     3.100     2.900 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.25519E-02 ppm1      1.795 ppm2      1.459 CV     1
 OR { 1016}
   (( segid "    " and resid 97   and name HG  ))
   (( segid "    " and resid 10   and name HD2 ))
 OR { 1016}
   (( segid "    " and resid 97   and name HG  ))
   (( segid "    " and resid 100  and name HG  ))
 OR { 1016}
   (( segid "    " and resid 97   and name HG  ))
   (  segid "    " and resid 140  and name HB% )
 ASSI { 1019}
   (( segid "    " and resid 43   and name HG  ))
   (  segid "    " and resid 43   and name HD1%)
      2.300     0.600     0.600 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.77287E-02 ppm1      1.666 ppm2      0.882 CV     1
 OR { 1019}
   (( segid "    " and resid 28   and name HG  ))
   (  segid "    " and resid 28   and name HD1%)
 ASSI { 1023}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 88   and name HN  ))
      3.200     1.300     1.300 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.17934E-02 ppm1      1.721 ppm2      8.878 CV     1
 OR { 1023}
   (( segid "    " and resid 30   and name HG12))
   (( segid "    " and resid 31   and name HN  ))
 OR { 1023}
   (( segid "    " and resid 30   and name HG11))
   (( segid "    " and resid 31   and name HN  ))
 OR { 1023}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 88   and name HN  ))
 ASSI { 1024}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 67   and name HA2 ))
      3.900     1.900     1.900 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.13778E-02 ppm1      1.723 ppm2      4.387 CV     1
 OR { 1024}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 54   and name HA  ))
 OR { 1024}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 52   and name HA  ))
 ASSI { 1026}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 61   and name HA  ))
      3.400     1.400     1.400 peak  1026 spectrum    1 weight  0.10000E+01 volume  0.13876E-02 ppm1      1.717 ppm2      4.534 CV     1
 OR { 1026}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 87   and name HB  ))
 OR { 1026}
   (( segid "    " and resid 88   and name HB1 ))
   (( segid "    " and resid 66   and name HA2 ))
 ASSI { 1027}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 63   and name HB2 ))
      3.700     1.700     1.700 peak  1027 spectrum    1 weight  0.10000E+01 volume  0.12932E-02 ppm1      1.668 ppm2      2.848 CV     1
 OR { 1027}
   (( segid "    " and resid 30   and name HG12))
   (( segid "    " and resid 29   and name HB2 ))
 OR { 1027}
   (( segid "    " and resid 30   and name HG11))
   (( segid "    " and resid 29   and name HB2 ))
 OR { 1027}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 29   and name HB2 ))
 ASSI { 1028}
   (( segid "    " and resid 42   and name HG12))
   (( segid "    " and resid 71   and name HA  ))
      3.800     1.800     1.800 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.21175E-02 ppm1      1.662 ppm2      5.273 CV     1
 OR { 1028}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 154  and name HA  ))
 OR { 1028}
   (( segid "    " and resid 42   and name HG11))
   (( segid "    " and resid 71   and name HA  ))
 OR { 1028}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 1029}
   (( segid "    " and resid 59   and name HB1 ))
   (  segid "    " and resid 89   and name HD1%)
      3.400     3.400     2.600 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.29861E-02 ppm1      1.664 ppm2      0.606 CV     1
 OR { 1029}
   (( segid "    " and resid 28   and name HG  ))
   (  segid "    " and resid 25   and name HG2%)
 OR { 1029}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 60   and name HD1 ))
 ASSI { 1037}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 119  and name HN  ))
      3.700     3.700     2.300 peak  1037 spectrum    1 weight  0.10000E+01 volume  0.13465E-02 ppm1      1.324 ppm2      7.116 CV     1
 OR { 1037}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 119  and name HN  ))
 OR { 1037}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 112  and name HD22))
 ASSI { 1051}
   (( segid "    " and resid 60   and name HD1 ))
   (( segid "    " and resid 85   and name HB  ))
      3.500     1.600     1.600 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.12831E-02 ppm1      0.563 ppm2      4.046 CV     1
 OR { 1051}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 108  and name HA1 ))
 OR { 1051}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 105  and name HB2 ))
 OR { 1051}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 92   and name HA  ))
 ASSI { 1058}
   (( segid "    " and resid 119  and name HG12))
   (  segid "    " and resid 119  and name HG2%)
      2.300     0.700     0.700 peak  1058 spectrum    1 weight  0.10000E+01 volume  0.61914E-02 ppm1      1.581 ppm2      0.580 CV     1
 OR { 1058}
   (( segid "    " and resid 64   and name HG1 ))
   (  segid "    " and resid 61   and name HD1%)
 OR { 1058}
   (( segid "    " and resid 119  and name HG12))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1064}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 22   and name HB  ))
      3.300     3.300     2.700 peak  1064 spectrum    1 weight  0.10000E+01 volume  0.15888E-02 ppm1      1.496 ppm2      4.095 CV     1
 OR { 1064}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 22   and name HB  ))
 OR { 1064}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 1066}
   (( segid "    " and resid 69   and name HG  ))
   (  segid "    " and resid 71   and name HG2%)
      2.800     2.800     3.200 peak  1066 spectrum    1 weight  0.10000E+01 volume  0.57620E-02 ppm1      1.486 ppm2      0.824 CV     1
 OR { 1066}
   (( segid "    " and resid 107  and name HD1 ))
   (  segid "    " and resid 18   and name HG1%)
 ASSI { 1069}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 61   and name HG11))
      2.400     0.700     0.700 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.45312E-02 ppm1      1.439 ppm2      1.117 CV     1
 OR { 1069}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 61   and name HG12))
 OR { 1069}
   (( segid "    " and resid 64   and name HG2 ))
   (  segid "    " and resid 86   and name HD1%)
 ASSI { 1070}
   (( segid "    " and resid 131  and name HD1 ))
   (  segid "    " and resid 111  and name HG1%)
      2.700     2.700     3.300 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.87083E-02 ppm1      1.429 ppm2      0.824 CV     1
 OR { 1070}
   (( segid "    " and resid 69   and name HG  ))
   (  segid "    " and resid 71   and name HG2%)
 OR { 1070}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 60   and name HG1 ))
 ASSI { 1071}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 132  and name HA  ))
      3.400     1.500     1.500 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.14064E-02 ppm1      1.423 ppm2      4.680 CV     1
 OR { 1071}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 133  and name HA  ))
 ASSI { 1080}
   (( segid "    " and resid 119  and name HG11))
   (  segid "    " and resid 119  and name HG2%)
      2.800     1.000     1.000 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.57419E-02 ppm1      1.143 ppm2      0.562 CV     1
 OR { 1080}
   (( segid "    " and resid 119  and name HG11))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1081}
   (( segid "    " and resid 119  and name HG11))
   (  segid "    " and resid 122  and name HD% )
      3.700     1.700     1.700 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.12570E-02 ppm1      1.140 ppm2      6.781 CV     1
 OR { 1081}
   (( segid "    " and resid 119  and name HG11))
   (  segid "    " and resid 156  and name HD% )
 ASSI { 1082}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HB1 ))
      3.000     1.100     1.100 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.16962E-02 ppm1      1.104 ppm2      1.410 CV     1
 OR { 1082}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 64   and name HG2 ))
 ASSI { 1095}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 94   and name HA  ))
      2.700     2.700     3.300 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.52392E-02 ppm1      0.569 ppm2      3.797 CV     1
 OR { 1095}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 93   and name HA  ))
 ASSI { 1096}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 94   and name HB1 ))
      3.800     1.800     1.800 peak  1096 spectrum    1 weight  0.10000E+01 volume  0.15592E-02 ppm1      0.567 ppm2      2.484 CV     1
 OR { 1096}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 153  and name HB  ))
 OR { 1096}
   (( segid "    " and resid 60   and name HD1 ))
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 1126}
   (( segid "    " and resid 28   and name HG  ))
   (  segid "    " and resid 28   and name HD2%)
      1.900     0.500     0.500 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.20893E-01 ppm1      1.637 ppm2      0.803 CV     1
 OR { 1126}
   (( segid "    " and resid 28   and name HG  ))
   (  segid "    " and resid 28   and name HD1%)
 OR { 1126}
   (( segid "    " and resid 43   and name HG  ))
   (  segid "    " and resid 43   and name HD2%)
 ASSI { 1127}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 27   and name HA2 ))
      3.100     1.200     1.200 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.34648E-02 ppm1      1.639 ppm2      3.989 CV     1
 OR { 1127}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 27   and name HA1 ))
 OR { 1127}
   (( segid "    " and resid 43   and name HG  ))
   (( segid "    " and resid 42   and name HA  ))
 ASSI { 1128}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.100     1.200     1.200 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.85562E-02 ppm1      1.637 ppm2      1.849 CV     1
 OR { 1128}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 1134}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 67   and name HA1 ))
      3.900     1.900     1.900 peak  1134 spectrum    1 weight  0.10000E+01 volume  0.23636E-02 ppm1      1.406 ppm2      3.948 CV     1
 OR { 1134}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 66   and name HA1 ))
 ASSI { 1144}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HA  ))
      3.600     1.600     1.600 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.14179E-02 ppm1      0.975 ppm2      4.091 CV     1
 OR { 1144}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 1147}
   (  segid "    " and resid 102  and name HD2%)
   (  segid "    " and resid 15   and name HD1%)
      3.000     3.000     3.000 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.12897E-02 ppm1      0.636 ppm2      0.922 CV     1
 OR { 1147}
   (  segid "    " and resid 102  and name HD2%)
   (  segid "    " and resid 18   and name HG2%)
 OR { 1147}
   (  segid "    " and resid 102  and name HD2%)
   (  segid "    " and resid 15   and name HG2%)
 ASSI { 1149}
   (  segid "    " and resid 102  and name HD1%)
   (  segid "    " and resid 155  and name HD% )
      2.900     1.000     1.000 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.25963E-02 ppm1      0.556 ppm2      7.210 CV     1
 OR { 1149}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 151  and name HD21))
 ASSI { 1151}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 155  and name HB2 ))
      3.300     3.300     2.700 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.19455E-02 ppm1      0.553 ppm2      2.841 CV     1
 OR { 1151}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 90   and name HB1 ))
 ASSI { 1152}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 101  and name HB1 ))
      3.600     3.600     2.400 peak  1152 spectrum    1 weight  0.10000E+01 volume  0.14209E-02 ppm1      0.551 ppm2      2.596 CV     1
 OR { 1152}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 155  and name HB1 ))
 ASSI { 1179}
   (( segid "    " and resid 84   and name HG  ))
   (( segid "    " and resid 84   and name HB2 ))
      2.600     0.800     0.800 peak  1179 spectrum    1 weight  0.10000E+01 volume  0.28322E-02 ppm1      1.603 ppm2      1.756 CV     1
 OR { 1179}
   (( segid "    " and resid 86   and name HG  ))
   (( segid "    " and resid 88   and name HB1 ))
 OR { 1179}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 1182}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 64   and name HG1 ))
      1.700     0.400     0.500 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.10176E-01 ppm1      1.393 ppm2      1.609 CV     1
 OR { 1182}
   (( segid "    " and resid 91   and name HG1 ))
   (( segid "    " and resid 91   and name HD2 ))
 OR { 1182}
   (( segid "    " and resid 91   and name HG1 ))
   (( segid "    " and resid 91   and name HD1 ))
 ASSI { 1185}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 10   and name HB1 ))
      2.600     0.800     0.800 peak  1185 spectrum    1 weight  0.10000E+01 volume  0.32073E-02 ppm1      1.146 ppm2      0.940 CV     1
 OR { 1185}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 10   and name HB1 ))
 OR { 1185}
   (( segid "    " and resid 10   and name HG2 ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 1186}
   (  segid "    " and resid 97   and name HD2%)
   (  segid "    " and resid 98   and name HB% )
      3.200     3.200     2.800 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.27001E-02 ppm1      0.990 ppm2      1.317 CV     1
 OR { 1186}
   (  segid "    " and resid 97   and name HD2%)
   (( segid "    " and resid 131  and name HD2 ))
 OR { 1186}
   (  segid "    " and resid 97   and name HD2%)
   (  segid "    " and resid 143  and name HB% )
 OR { 1186}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 59   and name HG2 ))
 OR { 1186}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 89   and name HG  ))
 OR { 1186}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 59   and name HG1 ))
 ASSI { 1188}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 88   and name HA  ))
      3.100     1.200     1.200 peak  1188 spectrum    1 weight  0.10000E+01 volume  0.19975E-02 ppm1      0.980 ppm2      3.989 CV     1
 OR { 1188}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 11   and name HB2 ))
 ASSI { 1193}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HG  ))
      2.000     2.000     4.000 peak  1193 spectrum    1 weight  0.10000E+01 volume  0.14074E-01 ppm1      0.964 ppm2      1.618 CV     1
 OR { 1193}
   (  segid "    " and resid 100  and name HD1%)
   (  segid "    " and resid 14   and name HB% )
 ASSI { 1194}
   (  segid "    " and resid 86   and name HD2%)
   (  segid "    " and resid 61   and name HD1%)
      2.300     2.300     3.700 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.13392E-01 ppm1      0.970 ppm2      0.508 CV     1
 OR { 1194}
   (  segid "    " and resid 97   and name HD2%)
   (  segid "    " and resid 61   and name HD1%)
 OR { 1194}
   (  segid "    " and resid 97   and name HD2%)
   (  segid "    " and resid 102  and name HD1%)
 ASSI { 1198}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 100  and name HG  ))
      2.000     0.500     0.500 peak  1198 spectrum    1 weight  0.10000E+01 volume  0.14074E-01 ppm1      0.965 ppm2      1.487 CV     1
 OR { 1198}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HB1 ))
 OR { 1198}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 88   and name HG1 ))
 ASSI { 1204}
   (  segid "    " and resid 28   and name HD2%)
   (  segid "    " and resid 29   and name HE% )
      2.600     2.600     3.400 peak  1204 spectrum    1 weight  0.10000E+01 volume  0.18625E-02 ppm1      0.843 ppm2      6.711 CV     1
 OR { 1204}
   (  segid "    " and resid 100  and name HD2%)
   (  segid "    " and resid 155  and name HE% )
 ASSI { 1205}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HA  ))
      3.100     1.200     1.200 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.14940E-02 ppm1      0.843 ppm2      4.082 CV     1
 OR { 1205}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 11   and name HA  ))
 ASSI { 1210}
   (  segid "    " and resid 100  and name HD2%)
   (  segid "    " and resid 102  and name HD1%)
      2.800     2.800     3.200 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.50141E-02 ppm1      0.835 ppm2      0.525 CV     1
 OR { 1210}
   (  segid "    " and resid 38   and name HD1%)
   (  segid "    " and resid 71   and name HG1%)
 ASSI { 1219}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 64   and name HD2 ))
      2.700     0.900     0.900 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.41628E-02 ppm1      0.993 ppm2      3.024 CV     1
 OR { 1219}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 10   and name HE1 ))
 OR { 1219}
   (  segid "    " and resid 100  and name HD1%)
   (( segid "    " and resid 10   and name HE2 ))
 ASSI { 1222}
   (( segid "    " and resid 38   and name HG  ))
   (( segid "    " and resid 38   and name HN  ))
      2.600     2.600     3.400 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.20536E-02 ppm1      0.989 ppm2      7.857 CV     1
 OR { 1222}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 87   and name HN  ))
 ASSI { 1227}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 10   and name HG2 ))
      2.400     2.400     3.600 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.37297E-02 ppm1      0.881 ppm2      1.166 CV     1
 OR { 1227}
   (  segid "    " and resid 100  and name HD2%)
   (  segid "    " and resid 106  and name HB% )
 ASSI { 1245}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 60   and name HN  ))
      3.800     1.800     1.800 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.14885E-02 ppm1      1.276 ppm2      8.243 CV     1
 OR { 1245}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 89   and name HN  ))
 OR { 1245}
   (( segid "    " and resid 152  and name HG1 ))
   (( segid "    " and resid 60   and name HN  ))
 OR { 1245}
   (( segid "    " and resid 152  and name HG2 ))
   (( segid "    " and resid 60   and name HN  ))
 OR { 1245}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 89   and name HN  ))
 ASSI { 1246}
   (( segid "    " and resid 152  and name HG2 ))
   (( segid "    " and resid 152  and name HA  ))
      3.300     1.300     1.300 peak  1246 spectrum    1 weight  0.10000E+01 volume  0.20802E-02 ppm1      1.271 ppm2      4.763 CV     1
 OR { 1246}
   (( segid "    " and resid 152  and name HG1 ))
   (( segid "    " and resid 152  and name HA  ))
 OR { 1246}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 1250}
   (( segid "    " and resid 91   and name HG2 ))
   (( segid "    " and resid 91   and name HD1 ))
      2.300     0.700     0.700 peak  1250 spectrum    1 weight  0.10000E+01 volume  0.69169E-02 ppm1      1.264 ppm2      1.654 CV     1
 OR { 1250}
   (( segid "    " and resid 152  and name HG1 ))
   (( segid "    " and resid 152  and name HB1 ))
 OR { 1250}
   (( segid "    " and resid 152  and name HG2 ))
   (( segid "    " and resid 152  and name HB1 ))
 OR { 1250}
   (( segid "    " and resid 91   and name HG2 ))
   (( segid "    " and resid 91   and name HD2 ))
 OR { 1250}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HB1 ))
 OR { 1250}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HB1 ))
 ASSI { 1251}
   (( segid "    " and resid 152  and name HG1 ))
   (( segid "    " and resid 60   and name HG1 ))
      2.900     2.900     3.100 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.36842E-02 ppm1      1.258 ppm2      0.775 CV     1
 OR { 1251}
   (( segid "    " and resid 152  and name HG2 ))
   (( segid "    " and resid 60   and name HG1 ))
 OR { 1251}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 1252}
   (( segid "    " and resid 152  and name HG1 ))
   (( segid "    " and resid 54   and name HB2 ))
      2.700     0.900     0.900 peak  1252 spectrum    1 weight  0.10000E+01 volume  0.24338E-02 ppm1      1.250 ppm2      2.191 CV     1
 OR { 1252}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HB2 ))
 OR { 1252}
   (( segid "    " and resid 152  and name HG2 ))
   (( segid "    " and resid 54   and name HB2 ))
 OR { 1252}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HB2 ))
 ASSI { 1264}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 101  and name HA  ))
      3.700     1.700     1.700 peak  1264 spectrum    1 weight  0.10000E+01 volume  0.12870E-02 ppm1      1.510 ppm2      4.793 CV     1
 OR { 1264}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 101  and name HA  ))
 ASSI { 1265}
   (( segid "    " and resid 102  and name HG  ))
   (  segid "    " and resid 134  and name HB% )
      2.900     2.900     3.100 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.38979E-02 ppm1      1.510 ppm2      1.056 CV     1
 OR { 1265}
   (( segid "    " and resid 102  and name HG  ))
   (  segid "    " and resid 97   and name HD1%)
 OR { 1265}
   (( segid "    " and resid 100  and name HG  ))
   (  segid "    " and resid 134  and name HB% )
 ASSI { 1273}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 59   and name HB2 ))
      2.700     2.700     3.300 peak  1273 spectrum    1 weight  0.10000E+01 volume  0.10235E-01 ppm1      1.136 ppm2      2.191 CV     1
 OR { 1273}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 59   and name HB2 ))
 OR { 1273}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 157  and name HG2 ))
 OR { 1273}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 157  and name HG1 ))
 OR { 1273}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 157  and name HG2 ))
 ASSI { 1277}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 86   and name HN  ))
      2.800     1.000     1.000 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.41239E-02 ppm1      1.087 ppm2      9.171 CV     1
 OR { 1277}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 86   and name HN  ))
 ASSI { 1284}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 63   and name HB1 ))
      3.800     1.800     1.800 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.12304E-02 ppm1      1.090 ppm2      2.580 CV     1
 OR { 1284}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 63   and name HB1 ))
 OR { 1284}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 155  and name HB1 ))
 ASSI { 1285}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 64   and name HG1 ))
      2.000     0.500     0.500 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.64658E-02 ppm1      1.083 ppm2      1.584 CV     1
 OR { 1285}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 61   and name HB  ))
 OR { 1285}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 61   and name HB  ))
 OR { 1285}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI { 1288}
   (( segid "    " and resid 38   and name HG  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.000     1.200     1.200 peak  1288 spectrum    1 weight  0.10000E+01 volume  0.19998E-02 ppm1      0.969 ppm2      2.130 CV     1
 OR { 1288}
   (( segid "    " and resid 38   and name HG  ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 1288}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 1297}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 10   and name HB1 ))
      2.600     2.600     3.400 peak  1297 spectrum    1 weight  0.10000E+01 volume  0.18766E-02 ppm1      1.533 ppm2      0.900 CV     1
 OR { 1297}
   (( segid "    " and resid 102  and name HG  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI { 1305}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 89   and name HG  ))
      2.800     2.800     3.200 peak  1305 spectrum    1 weight  0.10000E+01 volume  0.29119E-02 ppm1      1.004 ppm2      1.263 CV     1
 OR { 1305}
   (( segid "    " and resid 38   and name HG  ))
   (  segid "    " and resid 41   and name HG2%)
 OR { 1305}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 131  and name HD2 ))
 ASSI { 1311}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 152  and name HB2 ))
      2.900     2.900     3.100 peak  1311 spectrum    1 weight  0.10000E+01 volume  0.44833E-02 ppm1      0.911 ppm2      1.786 CV     1
 OR { 1311}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 50   and name HB1 ))
 OR { 1311}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 157  and name HB2 ))
 OR { 1311}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 60   and name HD2 ))
 ASSI { 1312}
   (  segid "    " and resid 18   and name HG2%)
   (  segid "    " and resid 21   and name HB% )
      2.700     2.700     3.300 peak  1312 spectrum    1 weight  0.10000E+01 volume  0.96922E-02 ppm1      0.910 ppm2      1.480 CV     1
 OR { 1312}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 88   and name HG2 ))
 OR { 1312}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 88   and name HG1 ))
 OR { 1312}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 1339}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 96   and name HB1 ))
      3.100     1.200     1.200 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.17833E-02 ppm1      1.033 ppm2      3.890 CV     1
 OR { 1339}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 67   and name HA1 ))
 ASSI { 1343}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 88   and name HH22))
      3.500     1.600     1.600 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.23704E-02 ppm1      1.092 ppm2      7.275 CV     1
 OR { 1343}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 88   and name HH22))
 OR { 1343}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 88   and name HH21))
 OR { 1343}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 88   and name HH21))
 OR { 1343}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 67   and name HN  ))
 ASSI { 1345}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 152  and name HA  ))
      3.100     3.100     2.900 peak  1345 spectrum    1 weight  0.10000E+01 volume  0.51659E-02 ppm1      1.089 ppm2      4.773 CV     1
 OR { 1345}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 152  and name HA  ))
 OR { 1345}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 152  and name HA  ))
 ASSI { 1347}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 88   and name HB2 ))
      3.000     1.100     1.100 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.17565E-02 ppm1      1.095 ppm2      2.086 CV     1
 OR { 1347}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 68   and name HB2 ))
 OR { 1347}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI { 1348}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 68   and name HB1 ))
      2.500     2.500     3.500 peak  1348 spectrum    1 weight  0.10000E+01 volume  0.13088E-02 ppm1      1.092 ppm2      1.995 CV     1
 OR { 1348}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 68   and name HB1 ))
 ASSI { 1359}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 60   and name HE1 ))
      3.000     1.100     1.100 peak  1359 spectrum    1 weight  0.10000E+01 volume  0.20877E-02 ppm1      1.032 ppm2      3.471 CV     1
 OR { 1359}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 60   and name HE2 ))
 OR { 1359}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 60   and name HE2 ))
 ASSI { 1362}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 60   and name HB2 ))
      2.400     2.400     3.600 peak  1362 spectrum    1 weight  0.10000E+01 volume  0.10400E-01 ppm1      1.032 ppm2      1.656 CV     1
 OR { 1362}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 86   and name HG  ))
 OR { 1362}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
 OR { 1362}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 60   and name HB2 ))
 OR { 1362}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 1368}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 40   and name HA  ))
      2.400     2.400     3.600 peak  1368 spectrum    1 weight  0.10000E+01 volume  0.77593E-02 ppm1      0.791 ppm2      4.095 CV     1
 OR { 1368}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 72   and name HA2 ))
 OR { 1368}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 48   and name HA  ))
 OR { 1368}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 48   and name HA  ))
 OR { 1368}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 73   and name HD1 ))
 ASSI { 1370}
   (  segid "    " and resid 43   and name HD2%)
   (  segid "    " and resid 43   and name HD1%)
      2.000     2.000     4.000 peak  1370 spectrum    1 weight  0.10000E+01 volume  0.25999E-01 ppm1      0.782 ppm2      0.922 CV     1
 OR { 1370}
   (  segid "    " and resid 71   and name HG2%)
   (  segid "    " and resid 42   and name HD1%)
 ASSI { 1389}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 119  and name HG12))
      3.400     1.400     1.400 peak  1389 spectrum    1 weight  0.10000E+01 volume  0.12847E-02 ppm1      0.565 ppm2      1.565 CV     1
 OR { 1389}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 113  and name HB  ))
 OR { 1389}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 131  and name HB1 ))
 ASSI { 1390}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 119  and name HG11))
      2.000     2.000     4.000 peak  1390 spectrum    1 weight  0.10000E+01 volume  0.33256E-02 ppm1      0.563 ppm2      1.128 CV     1
 OR { 1390}
   (  segid "    " and resid 130  and name HB% )
   (  segid "    " and resid 129  and name HB% )
 OR { 1390}
   (  segid "    " and resid 130  and name HB% )
   (  segid "    " and resid 120  and name HG2%)
 ASSI { 1392}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 93   and name HN  ))
      3.400     1.400     1.400 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.25804E-02 ppm1      0.288 ppm2      8.297 CV     1
 OR { 1392}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HN  ))
 ASSI { 1403}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 88   and name HG2 ))
      2.900     2.900     3.100 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.18524E-02 ppm1      0.285 ppm2      1.430 CV     1
 OR { 1403}
   (  segid "    " and resid 89   and name HD2%)
   (  segid "    " and resid 92   and name HB% )
 OR { 1403}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 91   and name HG1 ))
 ASSI { 1408}
   (  segid "    " and resid 62   and name HG2%)
   (  segid "    " and resid 83   and name HD% )
      2.700     0.900     0.900 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.37079E-02 ppm1      0.021 ppm2      6.770 CV     1
 OR { 1408}
   (  segid "    " and resid 62   and name HG2%)
   (  segid "    " and resid 156  and name HD% )
 ASSI { 1414}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 116  and name HG2 ))
      2.900     2.900     3.100 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.28604E-02 ppm1      0.021 ppm2      1.459 CV     1
 OR { 1414}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 1415}
   (  segid "    " and resid 62   and name HG2%)
   (  segid "    " and resid 154  and name HG2%)
      3.600     3.600     2.400 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.17592E-02 ppm1      0.017 ppm2      1.166 CV     1
 OR { 1415}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 116  and name HB2 ))
 ASSI { 1416}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 116  and name HB1 ))
      3.300     3.300     2.700 peak  1416 spectrum    1 weight  0.10000E+01 volume  0.21587E-02 ppm1      0.022 ppm2      0.936 CV     1
 OR { 1416}
   (  segid "    " and resid 62   and name HG2%)
   (  segid "    " and resid 84   and name HD1%)
 OR { 1416}
   (  segid "    " and resid 62   and name HG2%)
   (  segid "    " and resid 84   and name HD2%)
 OR { 1416}
   (  segid "    " and resid 62   and name HG2%)
   (  segid "    " and resid 61   and name HG2%)
 ASSI { 1424}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 157  and name HB1 ))
      2.800     2.800     3.200 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.50760E-02 ppm1      1.373 ppm2      1.654 CV     1
 OR { 1424}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 102  and name HB1 ))
 OR { 1424}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 43   and name HG  ))
 OR { 1424}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 84   and name HG  ))
 OR { 1424}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 102  and name HB2 ))
 OR { 1424}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 157  and name HB1 ))
 ASSI { 1428}
   (  segid "    " and resid 41   and name HG2%)
   (  segid "    " and resid 44   and name HD2%)
      2.400     2.400     3.600 peak  1428 spectrum    1 weight  0.10000E+01 volume  0.15846E-01 ppm1      1.313 ppm2      0.775 CV     1
 OR { 1428}
   (  segid "    " and resid 41   and name HG2%)
   (  segid "    " and resid 44   and name HD1%)
 OR { 1428}
   (  segid "    " and resid 41   and name HG2%)
   (  segid "    " and resid 42   and name HG2%)
 ASSI { 1430}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 56   and name HB  ))
      2.200     0.600     0.600 peak  1430 spectrum    1 weight  0.10000E+01 volume  0.12824E-01 ppm1      1.307 ppm2      4.387 CV     1
 OR { 1430}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 104  and name HB  ))
 OR { 1430}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 56   and name HA  ))
 ASSI { 1431}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 42   and name HA  ))
      2.700     2.700     3.300 peak  1431 spectrum    1 weight  0.10000E+01 volume  0.76087E-02 ppm1      1.307 ppm2      3.987 CV     1
 OR { 1431}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 105  and name HB2 ))
 OR { 1431}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 149  and name HA  ))
 ASSI { 1434}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 38   and name HB1 ))
      2.300     2.300     3.700 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.21753E-01 ppm1      1.304 ppm2      1.459 CV     1
 OR { 1434}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 38   and name HB2 ))
 OR { 1434}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 43   and name HB1 ))
 ASSI { 1438}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 154  and name HA  ))
      2.400     2.400     3.600 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.62598E-02 ppm1      1.221 ppm2      5.224 CV     1
 OR { 1438}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 153  and name HA  ))
 OR { 1438}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 1440}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HB1 ))
      3.600     3.600     2.400 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.13541E-02 ppm1      1.222 ppm2      2.484 CV     1
 OR { 1440}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 153  and name HB  ))
 OR { 1440}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 55   and name HB1 ))
 ASSI { 1442}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 59   and name HG1 ))
      2.400     2.400     3.600 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.13600E-01 ppm1      1.208 ppm2      1.361 CV     1
 OR { 1442}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 116  and name HG1 ))
 OR { 1442}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 59   and name HG2 ))
 OR { 1442}
   (  segid "    " and resid 142  and name HG2%)
   (  segid "    " and resid 143  and name HB% )
 ASSI { 1447}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 17   and name HA  ))
      3.000     1.200     1.200 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.37171E-02 ppm1      0.901 ppm2      4.003 CV     1
 OR { 1447}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 17   and name HA  ))
 OR { 1447}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 88   and name HA  ))
 OR { 1447}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 42   and name HA  ))
 OR { 1447}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 21   and name HA  ))
 OR { 1447}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 20   and name HB2 ))
 OR { 1447}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 21   and name HA  ))
 OR { 1447}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 20   and name HB1 ))
 ASSI { 1450}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 63   and name HB2 ))
      3.300     1.300     1.300 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.25125E-02 ppm1      0.900 ppm2      2.862 CV     1
 OR { 1450}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 117  and name HB1 ))
 OR { 1450}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
 OR { 1450}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 63   and name HB2 ))
 OR { 1450}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 155  and name HB2 ))
 ASSI { 1455}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 42   and name HA  ))
      2.700     2.700     3.300 peak  1455 spectrum    1 weight  0.10000E+01 volume  0.42402E-02 ppm1      0.818 ppm2      3.972 CV     1
 OR { 1455}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 42   and name HA  ))
 OR { 1455}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 142  and name HA  ))
 OR { 1455}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 85   and name HB  ))
 OR { 1455}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 139  and name HA  ))
 OR { 1455}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1459}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 122  and name HA  ))
      2.900     1.000     1.000 peak  1459 spectrum    1 weight  0.10000E+01 volume  0.19914E-02 ppm1      0.567 ppm2      4.544 CV     1
 OR { 1459}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 131  and name HA  ))
 ASSI { 1462}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 104  and name HN  ))
      2.900     1.100     1.100 peak  1462 spectrum    1 weight  0.10000E+01 volume  0.26505E-02 ppm1      1.344 ppm2      8.683 CV     1
 OR { 1462}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 51   and name HN  ))
 ASSI { 1463}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 56   and name HB  ))
      2.200     0.600     0.600 peak  1463 spectrum    1 weight  0.10000E+01 volume  0.11361E-01 ppm1      1.341 ppm2      4.436 CV     1
 OR { 1463}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 104  and name HB  ))
 ASSI { 1466}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 41   and name HN  ))
      2.700     0.900     0.900 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.53681E-02 ppm1      1.315 ppm2      8.582 CV     1
 OR { 1466}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 77   and name HN  ))
 ASSI { 1467}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 77   and name HA  ))
      3.100     3.100     2.900 peak  1467 spectrum    1 weight  0.10000E+01 volume  0.47543E-02 ppm1      1.314 ppm2      4.729 CV     1
 OR { 1467}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 39   and name HA  ))
 ASSI { 1470}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 133  and name HB  ))
      2.000     0.500     0.500 peak  1470 spectrum    1 weight  0.10000E+01 volume  0.20048E-01 ppm1      1.283 ppm2      4.339 CV     1
 OR { 1470}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HB  ))
 OR { 1470}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 41   and name HB  ))
 ASSI { 1477}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 77   and name HB1 ))
      3.000     3.000     3.000 peak  1477 spectrum    1 weight  0.10000E+01 volume  0.22287E-02 ppm1      1.270 ppm2      2.874 CV     1
 OR { 1477}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 77   and name HB1 ))
 ASSI { 1483}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 133  and name HB  ))
      2.200     0.600     0.600 peak  1483 spectrum    1 weight  0.10000E+01 volume  0.12692E-01 ppm1      1.253 ppm2      4.339 CV     1
 OR { 1483}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HB  ))
 ASSI { 1484}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 60   and name HD2 ))
      2.900     2.900     3.100 peak  1484 spectrum    1 weight  0.10000E+01 volume  0.21131E-02 ppm1      1.247 ppm2      1.703 CV     1
 OR { 1484}
   (  segid "    " and resid 78   and name HG2%)
   (  segid "    " and resid 79   and name HB% )
 OR { 1484}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 135  and name HB  ))
 ASSI { 1485}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 33   and name HN  ))
      3.100     1.200     1.200 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.28199E-02 ppm1      1.231 ppm2      8.780 CV     1
 OR { 1485}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 1489}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 142  and name HB  ))
      2.100     0.600     0.600 peak  1489 spectrum    1 weight  0.10000E+01 volume  0.12150E-01 ppm1      1.204 ppm2      4.095 CV     1
 OR { 1489}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HA  ))
 ASSI { 1490}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HN  ))
      3.800     1.800     1.800 peak  1490 spectrum    1 weight  0.10000E+01 volume  0.13754E-02 ppm1      1.191 ppm2      8.048 CV     1
 OR { 1490}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 155  and name HN  ))
 ASSI { 1492}
   (  segid "    " and resid 120  and name HG2%)
   (  segid "    " and resid 113  and name HD1%)
      1.900     1.900     4.100 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.66832E-02 ppm1      1.177 ppm2      0.678 CV     1
 OR { 1492}
   (  segid "    " and resid 154  and name HG2%)
   (  segid "    " and resid 113  and name HD1%)
 OR { 1492}
   (  segid "    " and resid 154  and name HG2%)
   (  segid "    " and resid 102  and name HD2%)
 ASSI { 1493}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
      2.200     2.200     3.800 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.79458E-02 ppm1      1.176 ppm2      1.654 CV     1
 OR { 1493}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 59   and name HB1 ))
 OR { 1493}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 64   and name HG1 ))
 OR { 1493}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 152  and name HB1 ))
 OR { 1493}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 60   and name HB2 ))
 OR { 1493}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 1494}
   (  segid "    " and resid 120  and name HG2%)
   (( segid "    " and resid 120  and name HN  ))
      2.800     1.000     1.000 peak  1494 spectrum    1 weight  0.10000E+01 volume  0.30726E-02 ppm1      1.170 ppm2      8.385 CV     1
 OR { 1494}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HN  ))
 ASSI { 1500}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 53   and name HB2 ))
      3.800     1.800     1.800 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.13824E-02 ppm1      1.162 ppm2      3.850 CV     1
 OR { 1500}
   (  segid "    " and resid 120  and name HG2%)
   (( segid "    " and resid 119  and name HA  ))
 ASSI { 1508}
   (  segid "    " and resid 129  and name HB% )
   (( segid "    " and resid 128  and name HB2 ))
      3.000     1.200     1.200 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.13335E-02 ppm1      1.126 ppm2      2.337 CV     1
 OR { 1508}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 68   and name HG1 ))
 ASSI { 1511}
   (  segid "    " and resid 129  and name HB% )
   (  segid "    " and resid 126  and name HB% )
      2.700     2.700     3.300 peak  1511 spectrum    1 weight  0.10000E+01 volume  0.10150E-01 ppm1      1.104 ppm2      1.410 CV     1
 OR { 1511}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
 OR { 1511}
   (  segid "    " and resid 129  and name HB% )
   (( segid "    " and resid 131  and name HD1 ))
 OR { 1511}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 64   and name HG2 ))
 OR { 1511}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 88   and name HG1 ))
 ASSI { 1513}
   (  segid "    " and resid 99   and name HG2%)
   (  segid "    " and resid 5    and name HB% )
      2.200     2.200     3.800 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.70782E-02 ppm1      1.033 ppm2      1.410 CV     1
 OR { 1513}
   (  segid "    " and resid 99   and name HG2%)
   (  segid "    " and resid 140  and name HB% )
 OR { 1513}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 86   and name HB1 ))
 OR { 1513}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 64   and name HG2 ))
 OR { 1513}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 88   and name HG1 ))
 OR { 1513}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 88   and name HG2 ))
 ASSI { 1519}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 150  and name HA  ))
      3.400     3.400     2.600 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.18478E-02 ppm1      0.844 ppm2      4.583 CV     1
 OR { 1519}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 61   and name HA  ))
 OR { 1519}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 155  and name HA  ))
 OR { 1519}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 47   and name HA  ))
 OR { 1519}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 131  and name HA  ))
 OR { 1519}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 154  and name HB  ))
 OR { 1519}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 122  and name HA  ))
 ASSI { 1520}
   (  segid "    " and resid 111  and name HG1%)
   (  segid "    " and resid 143  and name HB% )
      2.300     2.300     3.700 peak  1520 spectrum    1 weight  0.10000E+01 volume  0.18697E-01 ppm1      0.844 ppm2      1.361 CV     1
 OR { 1520}
   (  segid "    " and resid 43   and name HD2%)
   (  segid "    " and resid 48   and name HB% )
 OR { 1520}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 131  and name HD1 ))
 ASSI { 1529}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 47   and name HN  ))
      3.400     1.500     1.500 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.25396E-02 ppm1      1.417 ppm2      8.878 CV     1
 OR { 1529}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 128  and name HN  ))
 ASSI { 1537}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 131  and name HB1 ))
      2.300     2.300     3.700 peak  1537 spectrum    1 weight  0.10000E+01 volume  0.99684E-02 ppm1      1.409 ppm2      1.556 CV     1
 OR { 1537}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 107  and name HD1 ))
 OR { 1537}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 107  and name HD2 ))
 ASSI { 1546}
   (  segid "    " and resid 48   and name HB% )
   (( segid "    " and resid 44   and name HB2 ))
      2.500     2.500     3.500 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.21786E-02 ppm1      1.356 ppm2      1.903 CV     1
 OR { 1546}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 44   and name HB2 ))
 OR { 1546}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 158  and name HB1 ))
 ASSI { 1547}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 42   and name HG11))
      3.200     1.300     1.300 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.31477E-02 ppm1      1.305 ppm2      1.654 CV     1
 OR { 1547}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 44   and name HG  ))
 OR { 1547}
   (  segid "    " and resid 78   and name HG2%)
   (  segid "    " and resid 79   and name HB% )
 OR { 1547}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 42   and name HG12))
 ASSI { 1549}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 54   and name HG2 ))
      2.500     2.500     3.500 peak  1549 spectrum    1 weight  0.10000E+01 volume  0.13253E-02 ppm1      1.302 ppm2      2.093 CV     1
 OR { 1549}
   (  segid "    " and resid 56   and name HG2%)
   (( segid "    " and resid 54   and name HG1 ))
 OR { 1549}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 50   and name HG1 ))
 OR { 1549}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 50   and name HG2 ))
 ASSI { 1552}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HA  ))
      3.100     3.100     2.900 peak  1552 spectrum    1 weight  0.10000E+01 volume  0.29959E-02 ppm1      1.185 ppm2      4.729 CV     1
 OR { 1552}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 77   and name HA  ))
 ASSI { 1561}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 137  and name HA  ))
      2.400     2.400     3.600 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.10484E-01 ppm1      1.033 ppm2      3.997 CV     1
 OR { 1561}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 149  and name HA  ))
 ASSI { 1563}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 128  and name HG1 ))
      2.600     2.600     3.400 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.13492E-02 ppm1      1.025 ppm2      2.435 CV     1
 OR { 1563}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 58   and name HB1 ))
 ASSI { 1568}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 111  and name HN  ))
      3.200     1.300     1.300 peak  1568 spectrum    1 weight  0.10000E+01 volume  0.15001E-02 ppm1      0.975 ppm2      8.883 CV     1
 OR { 1568}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 128  and name HN  ))
 ASSI { 1569}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 127  and name HA  ))
      2.500     0.800     0.800 peak  1569 spectrum    1 weight  0.10000E+01 volume  0.47996E-02 ppm1      0.972 ppm2      4.778 CV     1
 OR { 1569}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 111  and name HA  ))
 ASSI { 1572}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 19   and name HN  ))
      3.200     3.200     2.800 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.28423E-02 ppm1      0.873 ppm2      8.592 CV     1
 OR { 1572}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 113  and name HN  ))
 ASSI { 1574}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 17   and name HA  ))
      3.100     1.200     1.200 peak  1574 spectrum    1 weight  0.10000E+01 volume  0.38045E-02 ppm1      0.870 ppm2      4.003 CV     1
 OR { 1574}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 129  and name HA  ))
 OR { 1574}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 42   and name HA  ))
 OR { 1574}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 21   and name HA  ))
 OR { 1574}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 42   and name HA  ))
 OR { 1574}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 142  and name HA  ))
 OR { 1574}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 20   and name HB1 ))
 OR { 1574}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 139  and name HA  ))
 ASSI { 1576}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 18   and name HB  ))
      2.200     0.600     0.600 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.10312E-01 ppm1      0.874 ppm2      2.100 CV     1
 OR { 1576}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 50   and name HG1 ))
 ASSI { 1577}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 43   and name HB1 ))
      2.200     2.200     3.800 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.13082E-01 ppm1      0.868 ppm2      1.409 CV     1
 OR { 1577}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 43   and name HB1 ))
 OR { 1577}
   (  segid "    " and resid 111  and name HG1%)
   (  segid "    " and resid 126  and name HB% )
 ASSI { 1596}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 116  and name HG2 ))
      3.300     1.400     1.400 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.17378E-02 ppm1      1.219 ppm2      1.459 CV     1
 OR { 1596}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 131  and name HG2 ))
 OR { 1596}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 131  and name HG1 ))
 ASSI { 1598}
   (  segid "    " and resid 106  and name HB% )
   (  segid "    " and resid 102  and name HD1%)
      2.500     2.500     3.500 peak  1598 spectrum    1 weight  0.10000E+01 volume  0.69135E-02 ppm1      1.127 ppm2      0.557 CV     1
 OR { 1598}
   (  segid "    " and resid 129  and name HB% )
   (  segid "    " and resid 130  and name HB% )
 ASSI { 1599}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 99   and name HB  ))
      2.000     0.500     0.500 peak  1599 spectrum    1 weight  0.10000E+01 volume  0.18949E-01 ppm1      1.031 ppm2      4.534 CV     1
 OR { 1599}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 150  and name HA  ))
 ASSI { 1600}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 150  and name HN  ))
      3.100     1.200     1.200 peak  1600 spectrum    1 weight  0.10000E+01 volume  0.20279E-02 ppm1      1.033 ppm2      7.030 CV     1
 OR { 1600}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 100  and name HN  ))
 ASSI { 1602}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HB2 ))
      3.300     1.400     1.400 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.13450E-02 ppm1      0.978 ppm2      3.492 CV     1
 OR { 1602}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 152  and name HE1 ))
 OR { 1602}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 152  and name HE2 ))
 ASSI { 1603}
   (  segid "    " and resid 99   and name HG2%)
   (  segid "    " and resid 98   and name HB% )
      2.700     2.700     3.300 peak  1603 spectrum    1 weight  0.10000E+01 volume  0.44321E-02 ppm1      0.978 ppm2      1.361 CV     1
 OR { 1603}
   (  segid "    " and resid 111  and name HG2%)
   (  segid "    " and resid 143  and name HB% )
 ASSI { 1604}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 112  and name HD21))
      3.400     1.400     1.400 peak  1604 spectrum    1 weight  0.10000E+01 volume  0.16292E-02 ppm1      0.973 ppm2      7.560 CV     1
 OR { 1604}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HD21))
 ASSI { 1605}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 112  and name HD22))
      3.300     1.400     1.400 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.18987E-02 ppm1      0.973 ppm2      7.072 CV     1
 OR { 1605}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HD22))
 ASSI { 1639}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 106  and name HN  ))
      2.200     0.600     0.600 peak  1639 spectrum    1 weight  0.10000E+01 volume  0.75895E-02 ppm1      1.126 ppm2      7.249 CV     1
 OR { 1639}
   (  segid "    " and resid 153  and name HG2%)
   (  segid "    " and resid 155  and name HD% )
 ASSI { 1641}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 106  and name HA  ))
      2.000     0.500     0.500 peak  1641 spectrum    1 weight  0.10000E+01 volume  0.97541E-02 ppm1      1.126 ppm2      4.902 CV     1
 OR { 1641}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 157  and name HA  ))
 ASSI { 1642}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 157  and name HB1 ))
      2.200     0.600     0.600 peak  1642 spectrum    1 weight  0.10000E+01 volume  0.99211E-02 ppm1      1.130 ppm2      1.642 CV     1
 OR { 1642}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 102  and name HB1 ))
 OR { 1642}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 102  and name HB2 ))
 ASSI { 1667}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
      2.700     2.700     3.300 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.74422E-02 ppm1      1.453 ppm2      4.387 CV     1
 OR { 1667}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 22   and name HA  ))
 ASSI { 1668}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 22   and name HN  ))
      2.600     0.900     0.900 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.45747E-02 ppm1      1.445 ppm2      8.390 CV     1
 OR { 1668}
   (  segid "    " and resid 5    and name HB% )
   (( segid "    " and resid 5    and name HN  ))
 OR { 1668}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
 ASSI { 1670}
   (  segid "    " and resid 140  and name HB% )
   (( segid "    " and resid 137  and name HB2 ))
      2.300     2.300     3.700 peak  1670 spectrum    1 weight  0.10000E+01 volume  0.21555E-02 ppm1      1.440 ppm2      2.435 CV     1
 OR { 1670}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 17   and name HB1 ))
 OR { 1670}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 17   and name HG2 ))
 OR { 1670}
   (  segid "    " and resid 140  and name HB% )
   (( segid "    " and resid 127  and name HB1 ))
 OR { 1670}
   (  segid "    " and resid 5    and name HB% )
   (( segid "    " and resid 12   and name HG1 ))
 ASSI { 1672}
   (  segid "    " and resid 140  and name HB% )
   (( segid "    " and resid 137  and name HB1 ))
      2.100     2.100     3.900 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.66686E-02 ppm1      1.438 ppm2      1.947 CV     1
 OR { 1672}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 28   and name HB2 ))
 ASSI { 1674}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 137  and name HD2 ))
      3.400     1.400     1.400 peak  1674 spectrum    1 weight  0.10000E+01 volume  0.21501E-02 ppm1      1.403 ppm2      2.288 CV     1
 OR { 1674}
   (  segid "    " and resid 140  and name HB% )
   (( segid "    " and resid 139  and name HG2 ))
 OR { 1674}
   (  segid "    " and resid 140  and name HB% )
   (( segid "    " and resid 139  and name HG1 ))
 OR { 1674}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 139  and name HG2 ))
 ASSI { 1675}
   (  segid "    " and resid 140  and name HB% )
   (( segid "    " and resid 139  and name HB1 ))
      2.900     1.100     1.100 peak  1675 spectrum    1 weight  0.10000E+01 volume  0.49746E-02 ppm1      1.405 ppm2      1.849 CV     1
 OR { 1675}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 91   and name HB1 ))
 OR { 1675}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 139  and name HB1 ))
 ASSI { 1680}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 107  and name HN  ))
      2.400     0.700     0.700 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.37733E-02 ppm1      1.114 ppm2      9.415 CV     1
 OR { 1680}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 154  and name HN  ))
 ASSI { 1687}
   (  segid "    " and resid 153  and name HG2%)
   (( segid "    " and resid 60   and name HN  ))
      2.300     2.300     3.700 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.13146E-02 ppm1      1.106 ppm2      8.243 CV     1
 OR { 1687}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 60   and name HN  ))
 OR { 1687}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 18   and name HN  ))
 ASSI { 1688}
   (  segid "    " and resid 153  and name HG2%)
   (( segid "    " and resid 94   and name HA  ))
      2.300     2.300     3.700 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.23758E-02 ppm1      1.108 ppm2      3.802 CV     1
 OR { 1688}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 94   and name HA  ))
 OR { 1688}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 132  and name HB1 ))
 OR { 1688}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 53   and name HB2 ))
 ASSI { 1696}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 90   and name HN  ))
      2.000     0.500     0.500 peak  1696 spectrum    1 weight  0.10000E+01 volume  0.12518E-01 ppm1      0.556 ppm2      8.318 CV     1
 OR { 1696}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 93   and name HN  ))
 ASSI { 1715}
   (  segid "    " and resid 141  and name HB% )
   (( segid "    " and resid 141  and name HN  ))
      2.200     0.600     0.600 peak  1715 spectrum    1 weight  0.10000E+01 volume  0.98463E-02 ppm1      1.476 ppm2      8.097 CV     1
 OR { 1715}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 24   and name HN  ))
 ASSI { 1716}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 22   and name HN  ))
      2.500     0.800     0.800 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.55916E-02 ppm1      1.472 ppm2      8.341 CV     1
 OR { 1716}
   (  segid "    " and resid 5    and name HB% )
   (( segid "    " and resid 6    and name HN  ))
 OR { 1716}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 25   and name HN  ))
 ASSI { 1724}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 97   and name HN  ))
      3.700     1.700     1.700 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.13890E-02 ppm1      1.342 ppm2      8.048 CV     1
 OR { 1724}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 141  and name HN  ))
 OR { 1724}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 141  and name HN  ))
 ASSI { 1726}
   (  segid "    " and resid 143  and name HB% )
   (( segid "    " and resid 143  and name HA  ))
      2.000     0.500     0.500 peak  1726 spectrum    1 weight  0.10000E+01 volume  0.16572E-01 ppm1      1.344 ppm2      4.046 CV     1
 OR { 1726}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 1728}
   (  segid "    " and resid 143  and name HB% )
   (  segid "    " and resid 111  and name HG1%)
      1.600     1.600     4.400 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.27392E-01 ppm1      1.347 ppm2      0.824 CV     1
 OR { 1728}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 135  and name HD1%)
 OR { 1728}
   (  segid "    " and resid 98   and name HB% )
   (  segid "    " and resid 100  and name HD2%)
 ASSI { 1737}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 92   and name HA  ))
      3.200     3.200     2.800 peak  1737 spectrum    1 weight  0.10000E+01 volume  0.54721E-02 ppm1      0.562 ppm2      4.027 CV     1
 OR { 1737}
   (  segid "    " and resid 71   and name HG1%)
   (( segid "    " and resid 72   and name HA2 ))
 OR { 1737}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 96   and name HA  ))
 ASSI { 1753}
   (  segid "    " and resid 21   and name HB% )
   (( segid "    " and resid 21   and name HA  ))
      2.100     0.500     0.500 peak  1753 spectrum    1 weight  0.10000E+01 volume  0.16247E-01 ppm1      1.417 ppm2      3.997 CV     1
 OR { 1753}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 92   and name HA  ))
 ASSI { 1758}
   (  segid "    " and resid 143  and name HB% )
   (( segid "    " and resid 139  and name HG2 ))
      2.500     2.500     3.500 peak  1758 spectrum    1 weight  0.10000E+01 volume  0.68293E-02 ppm1      1.350 ppm2      2.240 CV     1
 OR { 1758}
   (  segid "    " and resid 143  and name HB% )
   (( segid "    " and resid 139  and name HG1 ))
 OR { 1758}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 139  and name HG2 ))
 OR { 1758}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 137  and name HD2 ))
 OR { 1758}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 139  and name HG1 ))
 ASSI { 1759}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 139  and name HB2 ))
      3.200     1.300     1.300 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.25250E-02 ppm1      1.343 ppm2      2.386 CV     1
 OR { 1759}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 139  and name HB2 ))
 OR { 1759}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 137  and name HB2 ))
 ASSI { 1781}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 92   and name HN  ))
      2.200     0.600     0.600 peak  1781 spectrum    1 weight  0.10000E+01 volume  0.11795E-01 ppm1      1.447 ppm2      8.048 CV     1
 OR { 1781}
   (  segid "    " and resid 141  and name HB% )
   (( segid "    " and resid 141  and name HN  ))
 OR { 1781}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 24   and name HN  ))
 ASSI { 1798}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 119  and name HG11))
      2.900     1.000     1.000 peak  1798 spectrum    1 weight  0.10000E+01 volume  0.47936E-02 ppm1      0.590 ppm2      1.170 CV     1
 OR { 1798}
   (  segid "    " and resid 113  and name HG2%)
   (  segid "    " and resid 154  and name HG2%)
 ASSI { 1873}
   (  segid "    " and resid 15   and name HD1%)
   (  segid "    " and resid 104  and name HG2%)
      3.000     3.000     3.000 peak  1873 spectrum    1 weight  0.10000E+01 volume  0.21558E-02 ppm1      0.942 ppm2      1.361 CV     1
 OR { 1873}
   (  segid "    " and resid 42   and name HD1%)
   (  segid "    " and resid 46   and name HG2%)
 OR { 1873}
   (  segid "    " and resid 15   and name HD1%)
   (( segid "    " and resid 158  and name HG2 ))
 OR { 1873}
   (  segid "    " and resid 15   and name HD1%)
   (( segid "    " and resid 135  and name HG12))
 OR { 1873}
   (  segid "    " and resid 15   and name HD1%)
   (( segid "    " and resid 158  and name HG1 ))
 OR { 1873}
   (  segid "    " and resid 42   and name HD1%)
   (  segid "    " and resid 48   and name HB% )
 ASSI { 1874}
   (  segid "    " and resid 15   and name HD1%)
   (  segid "    " and resid 102  and name HD1%)
      3.500     1.500     1.500 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.27506E-02 ppm1      0.916 ppm2      0.580 CV     1
 OR { 1874}
   (  segid "    " and resid 42   and name HD1%)
   (  segid "    " and resid 71   and name HG1%)
 OR { 1874}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 93   and name HB% )
 ASSI { 1876}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 92   and name HA  ))
      2.700     0.900     0.900 peak  1876 spectrum    1 weight  0.10000E+01 volume  0.57677E-02 ppm1      0.880 ppm2      4.046 CV     1
 OR { 1876}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 96   and name HA  ))
 OR { 1876}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 92   and name HA  ))
 OR { 1876}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 96   and name HA  ))
 OR { 1876}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 98   and name HA  ))
 ASSI { 1887}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 129  and name HA  ))
      2.300     0.700     0.700 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.63065E-02 ppm1      0.655 ppm2      4.092 CV     1
 OR { 1887}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 110  and name HA1 ))
 ASSI { 1890}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 112  and name HB1 ))
      3.500     3.500     2.500 peak  1890 spectrum    1 weight  0.10000E+01 volume  0.15551E-02 ppm1      0.651 ppm2      3.021 CV     1
 OR { 1890}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 109  and name HB2 ))
 ASSI { 1891}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 119  and name HG11))
      3.000     3.000     3.000 peak  1891 spectrum    1 weight  0.10000E+01 volume  0.45418E-02 ppm1      0.651 ppm2      1.164 CV     1
 OR { 1891}
   (  segid "    " and resid 113  and name HD1%)
   (  segid "    " and resid 120  and name HG2%)
 OR { 1891}
   (  segid "    " and resid 113  and name HD1%)
   (  segid "    " and resid 154  and name HG2%)
 ASSI { 1904}
   (  segid "    " and resid 42   and name HD1%)
   (  segid "    " and resid 41   and name HG2%)
      2.300     2.300     3.700 peak  1904 spectrum    1 weight  0.10000E+01 volume  0.28563E-02 ppm1      0.912 ppm2      1.263 CV     1
 OR { 1904}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 91   and name HG2 ))
 OR { 1904}
   (  segid "    " and resid 95   and name HG1%)
   (  segid "    " and resid 136  and name HG2%)
 OR { 1904}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 147  and name HG2%)
 OR { 1904}
   (  segid "    " and resid 95   and name HG2%)
   (  segid "    " and resid 136  and name HG2%)
 ASSI { 1911}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      3.100     3.100     2.900 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.26342E-02 ppm1      0.777 ppm2      4.407 CV     1
 OR { 1911}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1912}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 42   and name HA  ))
      3.000     1.100     1.100 peak  1912 spectrum    1 weight  0.10000E+01 volume  0.17338E-02 ppm1      0.777 ppm2      4.054 CV     1
 OR { 1912}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 72   and name HA2 ))
 ASSI { 1930}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 118  and name HN  ))
      2.500     2.500     3.500 peak  1930 spectrum    1 weight  0.10000E+01 volume  0.13517E-02 ppm1      0.588 ppm2      8.097 CV     1
 OR { 1930}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 130  and name HN  ))
 ASSI { 1979}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 140  and name HB% )
      2.600     0.900     0.900 peak  1979 spectrum    1 weight  0.10000E+01 volume  0.46077E-02 ppm1      4.010 ppm2      1.410 CV     1
 OR { 1979}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 138  and name HB% )
 ASSI { 2003}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HG1 ))
      3.200     1.300     1.300 peak  2003 spectrum    1 weight  0.10000E+01 volume  0.20213E-02 ppm1      4.359 ppm2      1.599 CV     1
 OR { 2003}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 152  and name HD2 ))
 OR { 2003}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 86   and name HG  ))
 ASSI { 2010}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HB2 ))
      3.500     1.500     1.500 peak  2010 spectrum    1 weight  0.10000E+01 volume  0.16838E-02 ppm1      4.246 ppm2      3.997 CV     1
 OR { 2010}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 11   and name HB2 ))
 OR { 2010}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 11   and name HB1 ))
 OR { 2010}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 11   and name HB1 ))
 OR { 2010}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 11   and name HB2 ))
 OR { 2010}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 8    and name HB1 ))
 OR { 2010}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 8    and name HB2 ))
 OR { 2010}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 8    and name HB1 ))
 ASSI { 2030}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 33   and name HB  ))
      1.900     1.900     4.100 peak  2030 spectrum    1 weight  0.10000E+01 volume  0.88011E-02 ppm1      3.990 ppm2      4.418 CV     1
 OR { 2030}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 33   and name HB  ))
 OR { 2030}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 78   and name HB  ))
 OR { 2030}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 78   and name HB  ))
 OR { 2030}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 79   and name HA  ))
 ASSI { 2033}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 93   and name HN  ))
      2.500     2.500     3.500 peak  2033 spectrum    1 weight  0.10000E+01 volume  0.15514E-02 ppm1      3.911 ppm2      8.292 CV     1
 OR { 2033}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 93   and name HN  ))
 OR { 2033}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 6    and name HN  ))
 OR { 2033}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 101  and name HN  ))
 OR { 2033}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
 ASSI { 2041}
   (( segid "    " and resid 6    and name HB2 ))
   (  segid "    " and resid 99   and name HG2%)
      3.500     1.600     1.600 peak  2041 spectrum    1 weight  0.10000E+01 volume  0.18025E-02 ppm1      4.312 ppm2      1.003 CV     1
 OR { 2041}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 150  and name HG2%)
 OR { 2041}
   (( segid "    " and resid 6    and name HB1 ))
   (  segid "    " and resid 99   and name HG2%)
 ASSI { 2049}
   (( segid "    " and resid 78   and name HA  ))
   (( segid "    " and resid 78   and name HB  ))
      2.600     0.800     0.800 peak  2049 spectrum    1 weight  0.10000E+01 volume  0.45312E-02 ppm1      3.984 ppm2      4.401 CV     1
 OR { 2049}
   (( segid "    " and resid 105  and name HB2 ))
   (( segid "    " and resid 105  and name HA  ))
 OR { 2049}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 8    and name HA  ))
 OR { 2049}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 8    and name HA  ))
 ASSI { 2052}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 50   and name HB1 ))
      3.100     3.100     2.900 peak  2052 spectrum    1 weight  0.10000E+01 volume  0.35086E-02 ppm1      4.008 ppm2      1.800 CV     1
 OR { 2052}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 71   and name HB  ))
 OR { 2052}
   (( segid "    " and resid 47   and name HB2 ))
   (( segid "    " and resid 50   and name HB1 ))
 OR { 2052}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 50   and name HB1 ))
 OR { 2052}
   (( segid "    " and resid 20   and name HB2 ))
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 2053}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 46   and name HG2%)
      3.100     3.100     2.900 peak  2053 spectrum    1 weight  0.10000E+01 volume  0.22245E-02 ppm1      3.945 ppm2      1.410 CV     1
 OR { 2053}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 46   and name HG2%)
 OR { 2053}
   (( segid "    " and resid 47   and name HB2 ))
   (  segid "    " and resid 48   and name HB% )
 OR { 2053}
   (( segid "    " and resid 47   and name HB1 ))
   (  segid "    " and resid 48   and name HB% )
 ASSI { 2059}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 100  and name HD2%)
      3.700     1.700     1.700 peak  2059 spectrum    1 weight  0.10000E+01 volume  0.14723E-02 ppm1      3.884 ppm2      0.873 CV     1
 OR { 2059}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 95   and name HG1%)
 OR { 2059}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 95   and name HG1%)
 OR { 2059}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 95   and name HG2%)
 OR { 2059}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 10   and name HB1 ))
 OR { 2059}
   (( segid "    " and resid 40   and name HB1 ))
   (  segid "    " and resid 43   and name HD1%)
 OR { 2059}
   (( segid "    " and resid 40   and name HB2 ))
   (  segid "    " and resid 43   and name HD1%)
 ASSI { 2067}
   (( segid "    " and resid 33   and name HA  ))
   (  segid "    " and resid 33   and name HG2%)
      2.300     0.700     0.700 peak  2067 spectrum    1 weight  0.10000E+01 volume  0.10833E-01 ppm1      4.307 ppm2      1.247 CV     1
 OR { 2067}
   (( segid "    " and resid 147  and name HA  ))
   (  segid "    " and resid 147  and name HG2%)
 ASSI { 2075}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 13   and name HA  ))
      2.700     0.900     0.900 peak  2075 spectrum    1 weight  0.10000E+01 volume  0.47503E-02 ppm1      4.070 ppm2      4.557 CV     1
 OR { 2075}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 13   and name HA  ))
 OR { 2075}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 99   and name HB  ))
 ASSI { 2076}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB  ))
      3.100     1.200     1.200 peak  2076 spectrum    1 weight  0.10000E+01 volume  0.19664E-02 ppm1      4.069 ppm2      2.184 CV     1
 OR { 2076}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 19   and name HB1 ))
 OR { 2076}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 19   and name HB1 ))
 OR { 2076}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 12   and name HB2 ))
 OR { 2076}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
 OR { 2076}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 17   and name HB2 ))
 OR { 2076}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 17   and name HB2 ))
 OR { 2076}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 12   and name HB2 ))
 OR { 2076}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI { 2078}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
      3.800     1.800     1.800 peak  2078 spectrum    1 weight  0.10000E+01 volume  0.16984E-02 ppm1      4.071 ppm2      3.510 CV     1
 OR { 2078}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
 OR { 2078}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
 OR { 2078}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 2079}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB  ))
      2.500     0.800     0.800 peak  2079 spectrum    1 weight  0.10000E+01 volume  0.66878E-02 ppm1      4.065 ppm2      1.982 CV     1
 OR { 2079}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 43   and name HB2 ))
 OR { 2079}
   (( segid "    " and resid 16   and name HB1 ))
   (( segid "    " and resid 15   and name HB  ))
 OR { 2079}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 15   and name HG11))
 OR { 2079}
   (( segid "    " and resid 16   and name HB2 ))
   (( segid "    " and resid 15   and name HB  ))
 OR { 2079}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 15   and name HG12))
 ASSI { 2080}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HD1%)
      2.300     0.700     0.700 peak  2080 spectrum    1 weight  0.10000E+01 volume  0.72793E-02 ppm1      4.066 ppm2      0.962 CV     1
 OR { 2080}
   (( segid "    " and resid 30   and name HA  ))
   (  segid "    " and resid 30   and name HD1%)
 ASSI { 2083}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      3.100     1.200     1.200 peak  2083 spectrum    1 weight  0.10000E+01 volume  0.27548E-02 ppm1      4.025 ppm2      1.441 CV     1
 OR { 2083}
   (( segid "    " and resid 23   and name HB2 ))
   (  segid "    " and resid 24   and name HB% )
 OR { 2083}
   (( segid "    " and resid 20   and name HB1 ))
   (  segid "    " and resid 24   and name HB% )
 OR { 2083}
   (( segid "    " and resid 23   and name HB1 ))
   (  segid "    " and resid 24   and name HB% )
 OR { 2083}
   (( segid "    " and resid 23   and name HB1 ))
   (  segid "    " and resid 22   and name HG2%)
 OR { 2083}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 21   and name HB% )
 OR { 2083}
   (( segid "    " and resid 20   and name HB1 ))
   (  segid "    " and resid 21   and name HB% )
 OR { 2083}
   (( segid "    " and resid 20   and name HB2 ))
   (  segid "    " and resid 24   and name HB% )
 OR { 2083}
   (( segid "    " and resid 23   and name HB2 ))
   (  segid "    " and resid 22   and name HG2%)
 OR { 2083}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 49   and name HG11))
 OR { 2083}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
 OR { 2083}
   (( segid "    " and resid 23   and name HB1 ))
   (  segid "    " and resid 21   and name HB% )
 OR { 2083}
   (( segid "    " and resid 23   and name HB2 ))
   (  segid "    " and resid 21   and name HB% )
 ASSI { 2089}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG12))
      2.700     0.900     0.900 peak  2089 spectrum    1 weight  0.10000E+01 volume  0.49078E-02 ppm1      4.010 ppm2      1.676 CV     1
 OR { 2089}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HG11))
 OR { 2089}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HG11))
 OR { 2089}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HG12))
 ASSI { 2096}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 22   and name HG2%)
      3.800     1.800     1.800 peak  2096 spectrum    1 weight  0.10000E+01 volume  0.12826E-02 ppm1      4.250 ppm2      1.451 CV     1
 OR { 2096}
   (( segid "    " and resid 23   and name HA  ))
   (  segid "    " and resid 24   and name HB% )
 ASSI { 2097}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB1 ))
      2.100     0.600     0.600 peak  2097 spectrum    1 weight  0.10000E+01 volume  0.15151E-01 ppm1      4.234 ppm2      4.071 CV     1
 OR { 2097}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB1 ))
 OR { 2097}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HB2 ))
 OR { 2097}
   (( segid "    " and resid 23   and name HA  ))
   (( segid "    " and resid 23   and name HB2 ))
 ASSI { 2101}
   (( segid "    " and resid 23   and name HB2 ))
   (  segid "    " and resid 25   and name HG2%)
      3.300     3.300     2.700 peak  2101 spectrum    1 weight  0.10000E+01 volume  0.40691E-02 ppm1      4.025 ppm2      0.552 CV     1
 OR { 2101}
   (( segid "    " and resid 23   and name HB1 ))
   (  segid "    " and resid 25   and name HG2%)
 OR { 2101}
   (( segid "    " and resid 96   and name HA  ))
   (  segid "    " and resid 93   and name HB% )
 OR { 2101}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 71   and name HG1%)
 ASSI { 2102}
   (( segid "    " and resid 30   and name HA  ))
   (( segid "    " and resid 30   and name HB  ))
      3.300     1.300     1.300 peak  2102 spectrum    1 weight  0.10000E+01 volume  0.12738E-02 ppm1      4.017 ppm2      1.996 CV     1
 OR { 2102}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 15   and name HG11))
 OR { 2102}
   (( segid "    " and resid 47   and name HB1 ))
   (( segid "    " and resid 49   and name HB  ))
 OR { 2102}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 15   and name HG11))
 OR { 2102}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 15   and name HG12))
 ASSI { 2104}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.300     1.400     1.400 peak  2104 spectrum    1 weight  0.10000E+01 volume  0.12657E-02 ppm1      4.296 ppm2      3.118 CV     1
 OR { 2104}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
 ASSI { 2106}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 16   and name HN  ))
      2.700     0.900     0.900 peak  2106 spectrum    1 weight  0.10000E+01 volume  0.31027E-02 ppm1      4.229 ppm2      8.194 CV     1
 OR { 2106}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
 ASSI { 2109}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 73   and name HB2 ))
      3.000     1.100     1.100 peak  2109 spectrum    1 weight  0.10000E+01 volume  0.21756E-02 ppm1      4.077 ppm2      2.195 CV     1
 OR { 2109}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 2109}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 100  and name HB1 ))
 OR { 2109}
   (( segid "    " and resid 11   and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
 OR { 2109}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 2110}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 148  and name HA  ))
      3.800     1.800     1.800 peak  2110 spectrum    1 weight  0.10000E+01 volume  0.17383E-02 ppm1      3.913 ppm2      4.729 CV     1
 OR { 2110}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 148  and name HA  ))
 OR { 2110}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
 ASSI { 2118}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 135  and name HD1%)
      3.200     1.300     1.300 peak  2118 spectrum    1 weight  0.10000E+01 volume  0.17144E-02 ppm1      4.292 ppm2      0.848 CV     1
 OR { 2118}
   (( segid "    " and resid 99   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
 ASSI { 2121}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 13   and name HN  ))
      2.700     0.900     0.900 peak  2121 spectrum    1 weight  0.10000E+01 volume  0.31471E-02 ppm1      3.828 ppm2      8.360 CV     1
 OR { 2121}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 11   and name HN  ))
 ASSI { 2122}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HN  ))
      2.800     1.000     1.000 peak  2122 spectrum    1 weight  0.10000E+01 volume  0.21469E-02 ppm1      3.824 ppm2      8.166 CV     1
 OR { 2122}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI { 2133}
   (( segid "    " and resid 136  and name HA  ))
   (  segid "    " and resid 138  and name HB% )
      3.200     3.200     2.800 peak  2133 spectrum    1 weight  0.10000E+01 volume  0.32757E-02 ppm1      3.959 ppm2      1.410 CV     1
 OR { 2133}
   (( segid "    " and resid 136  and name HA  ))
   (  segid "    " and resid 140  and name HB% )
 ASSI { 2138}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HG11))
      3.000     1.100     1.100 peak  2138 spectrum    1 weight  0.10000E+01 volume  0.17598E-02 ppm1      3.876 ppm2      1.142 CV     1
 OR { 2138}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 120  and name HG2%)
 ASSI { 2142}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 119  and name HG2%)
      2.700     0.900     0.900 peak  2142 spectrum    1 weight  0.10000E+01 volume  0.58915E-02 ppm1      3.831 ppm2      0.554 CV     1
 OR { 2142}
   (( segid "    " and resid 94   and name HA  ))
   (  segid "    " and resid 89   and name HD1%)
 OR { 2142}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 2146}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HG1 ))
      3.100     1.200     1.200 peak  2146 spectrum    1 weight  0.10000E+01 volume  0.47821E-02 ppm1      3.972 ppm2      1.996 CV     1
 OR { 2146}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 137  and name HG2 ))
 OR { 2146}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 137  and name HG1 ))
 ASSI { 2157}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 18   and name HG2%)
      3.100     1.200     1.200 peak  2157 spectrum    1 weight  0.10000E+01 volume  0.41849E-02 ppm1      4.053 ppm2      0.910 CV     1
 OR { 2157}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 18   and name HG1%)
 OR { 2157}
   (( segid "    " and resid 17   and name HA  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI { 2158}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 13   and name HN  ))
      3.100     1.200     1.200 peak  2158 spectrum    1 weight  0.10000E+01 volume  0.18904E-02 ppm1      4.053 ppm2      8.409 CV     1
 OR { 2158}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
 ASSI { 2171}
   (( segid "    " and resid 29   and name HA  ))
   (  segid "    " and resid 29   and name HD% )
      3.000     1.100     1.100 peak  2171 spectrum    1 weight  0.10000E+01 volume  0.19670E-02 ppm1      4.270 ppm2      7.311 CV     1
 OR { 2171}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 29   and name HD% )
 ASSI { 2190}
   (( segid "    " and resid 128  and name HA  ))
   (  segid "    " and resid 111  and name HG2%)
      3.600     1.600     1.600 peak  2190 spectrum    1 weight  0.10000E+01 volume  0.18036E-02 ppm1      3.808 ppm2      0.953 CV     1
 OR { 2190}
   (( segid "    " and resid 44   and name HA  ))
   (  segid "    " and resid 43   and name HD1%)
 ASSI { 2193}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 83   and name HA  ))
      3.000     3.000     3.000 peak  2193 spectrum    1 weight  0.10000E+01 volume  0.22091E-02 ppm1      4.193 ppm2      5.503 CV     1
 OR { 2193}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 63   and name HA  ))
 OR { 2193}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 109  and name HA  ))
 ASSI { 2204}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 129  and name HN  ))
      2.900     1.100     1.100 peak  2204 spectrum    1 weight  0.10000E+01 volume  0.23399E-02 ppm1      3.809 ppm2      7.621 CV     1
 OR { 2204}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HE21))
 ASSI { 2209}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HD1 ))
      3.100     1.200     1.200 peak  2209 spectrum    1 weight  0.10000E+01 volume  0.37512E-02 ppm1      3.744 ppm2      1.263 CV     1
 OR { 2209}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 89   and name HG  ))
 OR { 2209}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HD2 ))
 ASSI { 2226}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 101  and name HN  ))
      2.100     0.600     0.600 peak  2226 spectrum    1 weight  0.10000E+01 volume  0.10008E-01 ppm1      4.109 ppm2      8.286 CV     1
 OR { 2226}
   (( segid "    " and resid 138  and name HA  ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 2232}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 76   and name HN  ))
      3.400     3.400     2.600 peak  2232 spectrum    1 weight  0.10000E+01 volume  0.22474E-02 ppm1      4.371 ppm2      7.857 CV     1
 OR { 2232}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 87   and name HN  ))
 ASSI { 2233}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB1 ))
      2.300     0.700     0.700 peak  2233 spectrum    1 weight  0.10000E+01 volume  0.56128E-02 ppm1      4.371 ppm2      1.788 CV     1
 OR { 2233}
   (( segid "    " and resid 54   and name HA  ))
   (( segid "    " and resid 152  and name HB2 ))
 OR { 2233}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 2234}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 97   and name HD2%)
      2.600     0.800     0.800 peak  2234 spectrum    1 weight  0.10000E+01 volume  0.71727E-02 ppm1      4.371 ppm2      1.014 CV     1
 OR { 2234}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 97   and name HD1%)
 OR { 2234}
   (( segid "    " and resid 97   and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI { 2237}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 74   and name HA  ))
      3.400     1.500     1.500 peak  2237 spectrum    1 weight  0.10000E+01 volume  0.12445E-02 ppm1      4.303 ppm2      3.802 CV     1
 OR { 2237}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 128  and name HA  ))
 ASSI { 2240}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HB1 ))
      2.500     0.800     0.800 peak  2240 spectrum    1 weight  0.10000E+01 volume  0.42931E-02 ppm1      4.299 ppm2      3.021 CV     1
 OR { 2240}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB2 ))
 ASSI { 2243}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name HA2 ))
      3.600     1.600     1.600 peak  2243 spectrum    1 weight  0.10000E+01 volume  0.16906E-02 ppm1      4.219 ppm2      3.948 CV     1
 OR { 2243}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 21   and name HA  ))
 OR { 2243}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 27   and name HA1 ))
 ASSI { 2245}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      3.200     1.300     1.300 peak  2245 spectrum    1 weight  0.10000E+01 volume  0.14692E-02 ppm1      3.979 ppm2      8.090 CV     1
 OR { 2245}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 91   and name HN  ))
 ASSI { 2246}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 100  and name HD2%)
      2.900     2.900     3.100 peak  2246 spectrum    1 weight  0.10000E+01 volume  0.64116E-02 ppm1      3.981 ppm2      0.824 CV     1
 OR { 2246}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 18   and name HG1%)
 ASSI { 2247}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      2.700     0.900     0.900 peak  2247 spectrum    1 weight  0.10000E+01 volume  0.30428E-02 ppm1      3.977 ppm2      8.667 CV     1
 OR { 2247}
   (( segid "    " and resid 21   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
 ASSI { 2256}
   (( segid "    " and resid 48   and name HA  ))
   (  segid "    " and resid 48   and name HB% )
      2.100     0.500     0.500 peak  2256 spectrum    1 weight  0.10000E+01 volume  0.15170E-01 ppm1      4.118 ppm2      1.410 CV     1
 OR { 2256}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 138  and name HB% )
 ASSI { 2258}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
      2.900     1.000     1.000 peak  2258 spectrum    1 weight  0.10000E+01 volume  0.49313E-02 ppm1      4.047 ppm2      0.873 CV     1
 OR { 2258}
   (( segid "    " and resid 143  and name HA  ))
   (  segid "    " and resid 111  and name HG1%)
 OR { 2258}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 100  and name HD2%)
 OR { 2258}
   (( segid "    " and resid 14   and name HA  ))
   (  segid "    " and resid 18   and name HG2%)
 OR { 2258}
   (( segid "    " and resid 92   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
 OR { 2258}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
 ASSI { 2261}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 10   and name HE2 ))
      3.600     1.700     1.700 peak  2261 spectrum    1 weight  0.10000E+01 volume  0.13688E-02 ppm1      4.026 ppm2      3.016 CV     1
 OR { 2261}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 10   and name HE1 ))
 OR { 2261}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 90   and name HB2 ))
 ASSI { 2270}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HB1 ))
      3.600     1.600     1.600 peak  2270 spectrum    1 weight  0.10000E+01 volume  0.13329E-02 ppm1      3.978 ppm2      2.825 CV     1
 OR { 2270}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HE2 ))
 OR { 2270}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 2270}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HE1 ))
 ASSI { 2273}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 92   and name HA  ))
      3.900     1.900     1.900 peak  2273 spectrum    1 weight  0.10000E+01 volume  0.12273E-02 ppm1      3.804 ppm2      4.046 CV     1
 OR { 2273}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 96   and name HA  ))
 ASSI { 2284}
   (( segid "    " and resid 143  and name HA  ))
   (  segid "    " and resid 143  and name HB% )
      2.100     0.600     0.600 peak  2284 spectrum    1 weight  0.10000E+01 volume  0.13103E-01 ppm1      4.063 ppm2      1.361 CV     1
 OR { 2284}
   (( segid "    " and resid 138  and name HA  ))
   (  segid "    " and resid 138  and name HB% )
 OR { 2284}
   (( segid "    " and resid 98   and name HA  ))
   (  segid "    " and resid 98   and name HB% )
 ASSI { 2295}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 89   and name HD1%)
      3.100     1.200     1.200 peak  2295 spectrum    1 weight  0.10000E+01 volume  0.23580E-02 ppm1      4.189 ppm2      0.531 CV     1
 OR { 2295}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 93   and name HB% )
 ASSI { 2299}
   (( segid "    " and resid 74   and name HA  ))
   (  segid "    " and resid 156  and name HE% )
      3.200     1.300     1.300 peak  2299 spectrum    1 weight  0.10000E+01 volume  0.20701E-02 ppm1      3.837 ppm2      7.658 CV     1
 OR { 2299}
   (( segid "    " and resid 74   and name HA  ))
   (( segid "    " and resid 117  and name HD21))
 ASSI { 2326}
   (( segid "    " and resid 108  and name HA1 ))
   (( segid "    " and resid 109  and name HN  ))
      2.800     1.000     1.000 peak  2326 spectrum    1 weight  0.10000E+01 volume  0.31248E-02 ppm1      3.997 ppm2      8.780 CV     1
 OR { 2326}
   (( segid "    " and resid 81   and name HA1 ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI { 2328}
   (( segid "    " and resid 81   and name HA1 ))
   (  segid "    " and resid 35   and name HE% )
      3.000     1.100     1.100 peak  2328 spectrum    1 weight  0.10000E+01 volume  0.27829E-02 ppm1      4.004 ppm2      6.826 CV     1
 OR { 2328}
   (( segid "    " and resid 81   and name HA1 ))
   (  segid "    " and resid 156  and name HD% )
 ASSI { 2335}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 131  and name HD1 ))
      4.200     2.200     1.800 peak  2335 spectrum    1 weight  0.10000E+01 volume  0.13667E-02 ppm1      4.117 ppm2      1.387 CV     1
 OR { 2335}
   (( segid "    " and resid 110  and name HA1 ))
   (  segid "    " and resid 126  and name HB% )
 ASSI { 2347}
   (( segid "    " and resid 103  and name HA1 ))
   (( segid "    " and resid 104  and name HN  ))
      2.500     0.800     0.800 peak  2347 spectrum    1 weight  0.10000E+01 volume  0.25676E-02 ppm1      3.894 ppm2      8.732 CV     1
 OR { 2347}
   (( segid "    " and resid 115  and name HA2 ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 2360}
   (( segid "    " and resid 72   and name HA1 ))
   (( segid "    " and resid 72   and name HA2 ))
      1.600     0.300     0.600 peak  2360 spectrum    1 weight  0.10000E+01 volume  0.22033E-01 ppm1      3.809 ppm2      4.095 CV     1
 OR { 2360}
   (( segid "    " and resid 31   and name HA1 ))
   (( segid "    " and resid 31   and name HA2 ))
 OR { 2360}
   (( segid "    " and resid 72   and name HA1 ))
   (( segid "    " and resid 73   and name HD1 ))
 ASSI { 2366}
   (( segid "    " and resid 72   and name HA2 ))
   (( segid "    " and resid 72   and name HA1 ))
      1.900     0.400     0.400 peak  2366 spectrum    1 weight  0.10000E+01 volume  0.79945E-02 ppm1      4.063 ppm2      3.802 CV     1
 OR { 2366}
   (( segid "    " and resid 31   and name HA2 ))
   (( segid "    " and resid 31   and name HA1 ))
 ASSI { 2368}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 66   and name HN  ))
      2.500     0.800     0.800 peak  2368 spectrum    1 weight  0.10000E+01 volume  0.37137E-02 ppm1      3.913 ppm2      8.097 CV     1
 OR { 2368}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 65   and name HN  ))
 ASSI { 2370}
   (( segid "    " and resid 72   and name HA1 ))
   (  segid "    " and resid 84   and name HD2%)
      3.900     1.900     1.900 peak  2370 spectrum    1 weight  0.10000E+01 volume  0.12488E-02 ppm1      3.807 ppm2      0.971 CV     1
 OR { 2370}
   (( segid "    " and resid 72   and name HA1 ))
   (  segid "    " and resid 42   and name HD1%)
 OR { 2370}
   (( segid "    " and resid 72   and name HA1 ))
   (( segid "    " and resid 38   and name HG  ))
 ASSI { 2373}
   (( segid "    " and resid 67   and name HA1 ))
   (( segid "    " and resid 88   and name HB1 ))
      3.300     1.400     1.400 peak  2373 spectrum    1 weight  0.10000E+01 volume  0.26600E-02 ppm1      3.907 ppm2      1.752 CV     1
 OR { 2373}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI { 2413}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 82   and name HB1 ))
      3.500     1.500     1.500 peak  2413 spectrum    1 weight  0.10000E+01 volume  0.76038E-03 ppm1      6.843 ppm2      1.806 CV     1
 OR { 2413}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 25   and name HB  ))
 ASSI { 2416}
   (( segid "    " and resid 35   and name HB1 ))
   (  segid "    " and resid 38   and name HD2%)
      3.800     1.800     1.800 peak  2416 spectrum    1 weight  0.10000E+01 volume  0.10379E-02 ppm1      2.409 ppm2      0.160 CV     1
 OR { 2416}
   (( segid "    " and resid 35   and name HB1 ))
   (  segid "    " and resid 25   and name HD1%)
 ASSI { 2441}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 82   and name HA  ))
      4.000     2.000     2.000 peak  2441 spectrum    1 weight  0.10000E+01 volume  0.58826E-03 ppm1      6.773 ppm2      5.117 CV     1
 OR { 2441}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 2442}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 72   and name HA1 ))
      3.200     1.300     1.300 peak  2442 spectrum    1 weight  0.10000E+01 volume  0.12124E-02 ppm1      6.419 ppm2      3.785 CV     1
 OR { 2442}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 73   and name HG2 ))
 ASSI { 2448}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 117  and name HN  ))
      4.100     2.100     1.900 peak  2448 spectrum    1 weight  0.10000E+01 volume  0.59173E-03 ppm1      6.422 ppm2      8.357 CV     1
 OR { 2448}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 2466}
   (  segid "    " and resid 109  and name HD% )
   (  segid "    " and resid 153  and name HG2%)
      3.800     1.800     1.800 peak  2466 spectrum    1 weight  0.10000E+01 volume  0.72612E-03 ppm1      7.064 ppm2      1.138 CV     1
 OR { 2466}
   (  segid "    " and resid 109  and name HD% )
   (  segid "    " and resid 153  and name HG1%)
 OR { 2466}
   (  segid "    " and resid 109  and name HD% )
   (  segid "    " and resid 106  and name HB% )
 ASSI { 2468}
   (  segid "    " and resid 109  and name HE% )
   (( segid "    " and resid 102  and name HG  ))
      3.700     1.700     1.700 peak  2468 spectrum    1 weight  0.10000E+01 volume  0.93313E-03 ppm1      6.863 ppm2      1.523 CV     1
 OR { 2468}
   (  segid "    " and resid 109  and name HE% )
   (( segid "    " and resid 61   and name HB  ))
 ASSI { 2482}
   (  segid "    " and resid 155  and name HD% )
   (( segid "    " and resid 62   and name HA  ))
      2.800     2.800     3.200 peak  2482 spectrum    1 weight  0.10000E+01 volume  0.52710E-03 ppm1      7.200 ppm2      5.098 CV     1
 OR { 2482}
   (  segid "    " and resid 155  and name HD% )
   (( segid "    " and resid 110  and name HA2 ))
 ASSI { 2492}
   (  segid "    " and resid 65   and name HD% )
   (( segid "    " and resid 64   and name HB1 ))
      4.400     2.400     1.600 peak  2492 spectrum    1 weight  0.10000E+01 volume  0.62338E-03 ppm1      7.084 ppm2      0.992 CV     1
 OR { 2492}
   (  segid "    " and resid 65   and name HD% )
   (  segid "    " and resid 86   and name HD2%)
 ASSI { 2506}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 108  and name HA2 ))
      4.500     2.500     1.500 peak  2506 spectrum    1 weight  0.10000E+01 volume  0.53418E-03 ppm1      6.370 ppm2      4.201 CV     1
 OR { 2506}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 108  and name HA2 ))
 ASSI { 2507}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 108  and name HA1 ))
      3.400     1.500     1.500 peak  2507 spectrum    1 weight  0.10000E+01 volume  0.68115E-03 ppm1      6.370 ppm2      4.000 CV     1
 OR { 2507}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 2509}
   (  segid "    " and resid 122  and name HE% )
   (( segid "    " and resid 122  and name HB2 ))
      4.100     2.100     1.900 peak  2509 spectrum    1 weight  0.10000E+01 volume  0.95155E-03 ppm1      6.370 ppm2      2.793 CV     1
 OR { 2509}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 80   and name HB1 ))
 OR { 2509}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 107  and name HE2 ))
 ASSI { 2513}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 107  and name HB1 ))
      3.700     1.700     1.700 peak  2513 spectrum    1 weight  0.10000E+01 volume  0.11323E-02 ppm1      2.763 ppm2      1.019 CV     1
 OR { 2513}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 69   and name HB1 ))
 OR { 2513}
   (( segid "    " and resid 65   and name HB1 ))
   (( segid "    " and resid 64   and name HB1 ))
 ASSI { 2515}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB1 ))
      2.200     0.600     0.600 peak  2515 spectrum    1 weight  0.10000E+01 volume  0.88475E-02 ppm1      4.563 ppm2      2.777 CV     1
 OR { 2515}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB1 ))
 OR { 2515}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB2 ))
 OR { 2515}
   (( segid "    " and resid 13   and name HA  ))
   (( segid "    " and resid 13   and name HB1 ))
 OR { 2515}
   (( segid "    " and resid 75   and name HA  ))
   (( segid "    " and resid 75   and name HB2 ))
 OR { 2515}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 122  and name HB2 ))
 ASSI { 2518}
   (( segid "    " and resid 122  and name HA  ))
   (( segid "    " and resid 121  and name HN  ))
      2.000     2.000     4.000 peak  2518 spectrum    1 weight  0.10000E+01 volume  0.36667E-02 ppm1      4.550 ppm2      7.212 CV     1
 OR { 2518}
   (( segid "    " and resid 80   and name HA  ))
   (  segid "    " and resid 155  and name HD% )
 ASSI { 2532}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 107  and name HD2 ))
      3.600     1.600     1.600 peak  2532 spectrum    1 weight  0.10000E+01 volume  0.65463E-03 ppm1      6.801 ppm2      1.534 CV     1
 OR { 2532}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 116  and name HG2 ))
 OR { 2532}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 107  and name HD1 ))
 ASSI { 2534}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 62   and name HB  ))
      2.600     2.600     3.400 peak  2534 spectrum    1 weight  0.10000E+01 volume  0.65514E-03 ppm1      6.800 ppm2      3.010 CV     1
 OR { 2534}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 117  and name HB2 ))
 OR { 2534}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 2535}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 110  and name HA1 ))
      3.200     3.200     2.800 peak  2535 spectrum    1 weight  0.10000E+01 volume  0.52733E-03 ppm1      6.799 ppm2      4.076 CV     1
 OR { 2535}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 22   and name HB  ))
 OR { 2535}
   (  segid "    " and resid 156  and name HD% )
   (( segid "    " and resid 19   and name HA  ))
 ASSI { 2539}
   (  segid "    " and resid 156  and name HE% )
   (( segid "    " and resid 83   and name HB2 ))
      4.200     2.300     1.800 peak  2539 spectrum    1 weight  0.10000E+01 volume  0.55936E-03 ppm1      7.655 ppm2      2.336 CV     1
 OR { 2539}
   (  segid "    " and resid 156  and name HE% )
   (( segid "    " and resid 156  and name HB2 ))
 ASSI { 2546}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 30   and name HN  ))
      3.600     1.700     1.700 peak  2546 spectrum    1 weight  0.10000E+01 volume  0.10771E-02 ppm1      4.188 ppm2      7.115 CV     1
 OR { 2546}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HZ  ))
 ASSI { 2566}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 100  and name HB1 ))
      4.000     2.000     2.000 peak  2566 spectrum    1 weight  0.10000E+01 volume  0.13063E-02 ppm1      1.661 ppm2      2.191 CV     1
 OR { 2566}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 100  and name HB2 ))
 OR { 2566}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 17   and name HB2 ))
 ASSI { 2570}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 38   and name HG  ))
      4.100     2.100     1.900 peak  2570 spectrum    1 weight  0.10000E+01 volume  0.76574E-03 ppm1      7.335 ppm2      0.915 CV     1
 OR { 2570}
   (  segid "    " and resid 29   and name HD% )
   (  segid "    " and resid 30   and name HD1%)
 ASSI { 2588}
   (( segid "    " and resid 99   and name HB  ))
   (  segid "    " and resid 135  and name HD1%)
      3.200     3.200     2.800 peak  2588 spectrum    1 weight  0.10000E+01 volume  0.33946E-02 ppm1      4.519 ppm2      0.865 CV     1
 OR { 2588}
   (( segid "    " and resid 99   and name HB  ))
   (  segid "    " and resid 95   and name HG1%)
 ASSI { 2589}
   (( segid "    " and resid 147  and name HB  ))
   (  segid "    " and resid 147  and name HG2%)
      2.100     0.600     0.600 peak  2589 spectrum    1 weight  0.10000E+01 volume  0.14520E-01 ppm1      4.456 ppm2      1.235 CV     1
 OR { 2589}
   (( segid "    " and resid 33   and name HB  ))
   (  segid "    " and resid 33   and name HG2%)
 ASSI { 2596}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 116  and name HG2 ))
      4.000     2.000     2.000 peak  2596 spectrum    1 weight  0.10000E+01 volume  0.63882E-03 ppm1      3.019 ppm2      1.502 CV     1
 OR { 2596}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 61   and name HB  ))
 ASSI { 2643}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 39   and name HA  ))
      3.900     1.900     1.900 peak  2643 spectrum    1 weight  0.10000E+01 volume  0.11974E-02 ppm1      4.082 ppm2      4.729 CV     1
 OR { 2643}
   (( segid "    " and resid 96   and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2644}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 158  and name HB2 ))
      3.200     1.200     1.200 peak  2644 spectrum    1 weight  0.10000E+01 volume  0.29082E-02 ppm1      4.389 ppm2      1.699 CV     1
 OR { 2644}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 10   and name HB2 ))
 OR { 2644}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 157  and name HB2 ))
 ASSI { 2649}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HB2 ))
      2.800     1.000     1.000 peak  2649 spectrum    1 weight  0.10000E+01 volume  0.22073E-02 ppm1      3.974 ppm2      2.386 CV     1
 OR { 2649}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB1 ))
 OR { 2649}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HG2 ))
 ASSI { 2652}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HG11))
      3.400     1.500     1.500 peak  2652 spectrum    1 weight  0.10000E+01 volume  0.15526E-02 ppm1      5.108 ppm2      1.095 CV     1
 OR { 2652}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 61   and name HG12))
 OR { 2652}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 86   and name HD1%)
 ASSI { 2653}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 60   and name HD1 ))
      3.800     1.800     1.800 peak  2653 spectrum    1 weight  0.10000E+01 volume  0.11991E-02 ppm1      5.110 ppm2      0.541 CV     1
 OR { 2653}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 61   and name HD1%)
 ASSI { 2654}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 64   and name HG2 ))
      3.700     1.700     1.700 peak  2654 spectrum    1 weight  0.10000E+01 volume  0.11283E-02 ppm1      5.109 ppm2      1.410 CV     1
 OR { 2654}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
 ASSI { 2658}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 119  and name HG2%)
      2.500     2.500     3.500 peak  2658 spectrum    1 weight  0.10000E+01 volume  0.65337E-02 ppm1      3.634 ppm2      0.592 CV     1
 OR { 2658}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 2661}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name HG12))
      3.200     3.200     2.800 peak  2661 spectrum    1 weight  0.10000E+01 volume  0.32539E-02 ppm1      3.632 ppm2      1.556 CV     1
 OR { 2661}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 113  and name HB  ))
 ASSI { 2662}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 156  and name HD% )
      3.600     1.600     1.600 peak  2662 spectrum    1 weight  0.10000E+01 volume  0.11483E-02 ppm1      3.632 ppm2      6.779 CV     1
 OR { 2662}
   (( segid "    " and resid 116  and name HA  ))
   (  segid "    " and resid 83   and name HD% )
 ASSI { 2663}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 117  and name HB2 ))
      4.100     2.200     1.900 peak  2663 spectrum    1 weight  0.10000E+01 volume  0.83798E-03 ppm1      3.629 ppm2      3.028 CV     1
 OR { 2663}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
 ASSI { 2681}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 108  and name HA2 ))
      3.900     1.900     1.900 peak  2681 spectrum    1 weight  0.10000E+01 volume  0.11258E-02 ppm1      1.423 ppm2      4.222 CV     1
 OR { 2681}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 132  and name HB2 ))
 OR { 2681}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 89   and name HA  ))
 ASSI { 2686}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 67   and name HA1 ))
      3.800     1.800     1.800 peak  2686 spectrum    1 weight  0.10000E+01 volume  0.66273E-03 ppm1      1.070 ppm2      3.961 CV     1
 OR { 2686}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 66   and name HA1 ))
 ASSI { 2687}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 88   and name HB2 ))
      3.800     1.800     1.800 peak  2687 spectrum    1 weight  0.10000E+01 volume  0.10551E-02 ppm1      1.065 ppm2      2.055 CV     1
 OR { 2687}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 68   and name HB2 ))
 ASSI { 2690}
   (( segid "    " and resid 119  and name HG11))
   (( segid "    " and resid 119  and name HA  ))
      3.300     1.400     1.400 peak  2690 spectrum    1 weight  0.10000E+01 volume  0.77980E-03 ppm1      1.138 ppm2      3.858 CV     1
 OR { 2690}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 10   and name HA  ))
 OR { 2690}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 10   and name HA  ))
 ASSI { 2715}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 102  and name HN  ))
      4.000     2.000     2.000 peak  2715 spectrum    1 weight  0.10000E+01 volume  0.80509E-03 ppm1      0.565 ppm2      8.816 CV     1
 OR { 2715}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 109  and name HN  ))
 ASSI { 2720}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 90   and name HA  ))
      3.800     1.800     1.800 peak  2720 spectrum    1 weight  0.10000E+01 volume  0.89950E-03 ppm1      0.551 ppm2      4.847 CV     1
 OR { 2720}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 106  and name HA  ))
 OR { 2720}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 101  and name HA  ))
 ASSI { 2721}
   (  segid "    " and resid 102  and name HD1%)
   (  segid "    " and resid 155  and name HE% )
      3.400     3.400     2.600 peak  2721 spectrum    1 weight  0.10000E+01 volume  0.10281E-02 ppm1      0.553 ppm2      6.722 CV     1
 OR { 2721}
   (  segid "    " and resid 89   and name HD1%)
   (  segid "    " and resid 155  and name HE% )
 ASSI { 2727}
   (( segid "    " and resid 116  and name HB1 ))
   (( segid "    " and resid 117  and name HN  ))
      3.900     1.900     1.900 peak  2727 spectrum    1 weight  0.10000E+01 volume  0.64194E-03 ppm1      0.930 ppm2      8.341 CV     1
 OR { 2727}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 84   and name HN  ))
 OR { 2727}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 2728}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 9    and name HN  ))
      4.500     2.500     1.500 peak  2728 spectrum    1 weight  0.10000E+01 volume  0.56858E-03 ppm1      1.155 ppm2      8.318 CV     1
 OR { 2728}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 9    and name HN  ))
 OR { 2728}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 6    and name HN  ))
 OR { 2728}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 101  and name HN  ))
 ASSI { 2745}
   (( segid "    " and resid 137  and name HB2 ))
   (  segid "    " and resid 99   and name HG2%)
      2.700     2.700     3.300 peak  2745 spectrum    1 weight  0.10000E+01 volume  0.11389E-02 ppm1      2.406 ppm2      1.019 CV     1
 OR { 2745}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 134  and name HB% )
 OR { 2745}
   (( segid "    " and resid 139  and name HB2 ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI { 2748}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 138  and name HN  ))
      3.300     1.300     1.300 peak  2748 spectrum    1 weight  0.10000E+01 volume  0.11150E-02 ppm1      2.408 ppm2      8.242 CV     1
 OR { 2748}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 18   and name HN  ))
 OR { 2748}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 138  and name HN  ))
 ASSI { 2749}
   (( segid "    " and resid 139  and name HB2 ))
   (( segid "    " and resid 124  and name HB2 ))
      2.700     2.700     3.300 peak  2749 spectrum    1 weight  0.10000E+01 volume  0.60593E-03 ppm1      2.404 ppm2      2.972 CV     1
 OR { 2749}
   (( segid "    " and resid 17   and name HG2 ))
   (( segid "    " and resid 10   and name HE1 ))
 ASSI { 2752}
   (( segid "    " and resid 137  and name HB1 ))
   (( segid "    " and resid 138  and name HN  ))
      3.900     1.900     1.900 peak  2752 spectrum    1 weight  0.10000E+01 volume  0.11958E-02 ppm1      1.965 ppm2      8.256 CV     1
 OR { 2752}
   (( segid "    " and resid 17   and name HG1 ))
   (( segid "    " and resid 18   and name HN  ))
 OR { 2752}
   (( segid "    " and resid 15   and name HG11))
   (( segid "    " and resid 16   and name HN  ))
 OR { 2752}
   (( segid "    " and resid 15   and name HG12))
   (( segid "    " and resid 16   and name HN  ))
 ASSI { 2753}
   (( segid "    " and resid 137  and name HB1 ))
   (  segid "    " and resid 140  and name HB% )
      3.900     1.900     1.900 peak  2753 spectrum    1 weight  0.10000E+01 volume  0.79401E-03 ppm1      1.951 ppm2      1.468 CV     1
 OR { 2753}
   (( segid "    " and resid 15   and name HG11))
   (( segid "    " and resid 100  and name HG  ))
 OR { 2753}
   (( segid "    " and resid 15   and name HG12))
   (( segid "    " and resid 100  and name HG  ))
 ASSI { 2755}
   (( segid "    " and resid 139  and name HB1 ))
   (  segid "    " and resid 98   and name HB% )
      3.400     1.500     1.500 peak  2755 spectrum    1 weight  0.10000E+01 volume  0.12866E-02 ppm1      1.869 ppm2      1.384 CV     1
 OR { 2755}
   (( segid "    " and resid 139  and name HB1 ))
   (  segid "    " and resid 140  and name HB% )
 OR { 2755}
   (( segid "    " and resid 139  and name HB1 ))
   (  segid "    " and resid 138  and name HB% )
 ASSI { 2770}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 66   and name HA1 ))
      4.200     2.200     1.800 peak  2770 spectrum    1 weight  0.10000E+01 volume  0.76935E-03 ppm1      2.519 ppm2      3.955 CV     1
 OR { 2770}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 67   and name HA1 ))
 ASSI { 2791}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB1 ))
      2.600     0.800     0.800 peak  2791 spectrum    1 weight  0.10000E+01 volume  0.29114E-02 ppm1      4.957 ppm2      2.435 CV     1
 OR { 2791}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HG2 ))
 ASSI { 2802}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 28   and name HA  ))
      3.100     1.200     1.200 peak  2802 spectrum    1 weight  0.10000E+01 volume  0.17294E-02 ppm1      1.644 ppm2      4.161 CV     1
 OR { 2802}
   (( segid "    " and resid 43   and name HG  ))
   (( segid "    " and resid 48   and name HA  ))
 OR { 2802}
   (( segid "    " and resid 44   and name HG  ))
   (( segid "    " and resid 48   and name HA  ))
 ASSI { 2804}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HN  ))
      3.400     1.400     1.400 peak  2804 spectrum    1 weight  0.10000E+01 volume  0.93138E-03 ppm1      1.214 ppm2      8.220 CV     1
 OR { 2804}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
 ASSI { 2811}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 12   and name HG2 ))
      2.900     2.900     3.100 peak  2811 spectrum    1 weight  0.10000E+01 volume  0.10546E-02 ppm1      1.980 ppm2      2.498 CV     1
 OR { 2811}
   (( segid "    " and resid 30   and name HB  ))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI { 2816}
   (( segid "    " and resid 103  and name HA2 ))
   (( segid "    " and resid 101  and name HA  ))
      4.300     2.400     1.700 peak  2816 spectrum    1 weight  0.10000E+01 volume  0.76236E-03 ppm1      4.225 ppm2      4.863 CV     1
 OR { 2816}
   (( segid "    " and resid 103  and name HA2 ))
   (( segid "    " and resid 106  and name HA  ))
 OR { 2816}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 2817}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 132  and name HA  ))
      3.300     1.300     1.300 peak  2817 spectrum    1 weight  0.10000E+01 volume  0.77943E-03 ppm1      4.228 ppm2      4.652 CV     1
 OR { 2817}
   (( segid "    " and resid 103  and name HA2 ))
   (( segid "    " and resid 133  and name HA  ))
 ASSI { 2827}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 70   and name HB1 ))
      3.200     3.200     2.800 peak  2827 spectrum    1 weight  0.10000E+01 volume  0.81692E-03 ppm1      1.765 ppm2      2.585 CV     1
 OR { 2827}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 82   and name HB2 ))
 ASSI { 2828}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 34   and name HN  ))
      3.500     1.600     1.600 peak  2828 spectrum    1 weight  0.10000E+01 volume  0.10008E-02 ppm1      2.181 ppm2      7.645 CV     1
 OR { 2828}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HN  ))
 OR { 2828}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 32   and name HE21))
 ASSI { 2836}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 153  and name HA  ))
      4.300     2.300     1.700 peak  2836 spectrum    1 weight  0.10000E+01 volume  0.56870E-03 ppm1      2.235 ppm2      5.168 CV     1
 OR { 2836}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 126  and name HA  ))
 ASSI { 2838}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 33   and name HB  ))
      4.300     2.300     1.700 peak  2838 spectrum    1 weight  0.10000E+01 volume  0.70856E-03 ppm1      2.241 ppm2      4.485 CV     1
 OR { 2838}
   (( segid "    " and resid 32   and name HG1 ))
   (( segid "    " and resid 33   and name HB  ))
 OR { 2838}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 147  and name HB  ))
 ASSI { 2857}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 107  and name HE2 ))
      3.300     1.300     1.300 peak  2857 spectrum    1 weight  0.10000E+01 volume  0.20853E-02 ppm1      4.414 ppm2      2.813 CV     1
 OR { 2857}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 107  and name HE1 ))
 OR { 2857}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 109  and name HB1 ))
 OR { 2857}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 155  and name HB2 ))
 ASSI { 2872}
   (( segid "    " and resid 118  and name HA  ))
   (( segid "    " and resid 118  and name HB2 ))
      2.400     0.700     0.700 peak  2872 spectrum    1 weight  0.10000E+01 volume  0.59127E-02 ppm1      4.950 ppm2      3.052 CV     1
 OR { 2872}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
 ASSI { 2877}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 62   and name HN  ))
      3.100     1.200     1.200 peak  2877 spectrum    1 weight  0.10000E+01 volume  0.62710E-03 ppm1      1.535 ppm2      8.773 CV     1
 OR { 2877}
   (( segid "    " and resid 116  and name HG2 ))
   (( segid "    " and resid 115  and name HN  ))
 ASSI { 2888}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 72   and name HA1 ))
      3.500     1.500     1.500 peak  2888 spectrum    1 weight  0.10000E+01 volume  0.55326E-03 ppm1      6.768 ppm2      3.802 CV     1
 OR { 2888}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 74   and name HA  ))
 ASSI { 2889}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 62   and name HB  ))
      4.200     2.200     1.800 peak  2889 spectrum    1 weight  0.10000E+01 volume  0.56732E-03 ppm1      6.774 ppm2      3.021 CV     1
 OR { 2889}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 117  and name HB2 ))
 OR { 2889}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 70   and name HB2 ))
 ASSI { 2915}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 62   and name HA  ))
      3.800     1.800     1.800 peak  2915 spectrum    1 weight  0.10000E+01 volume  0.98231E-03 ppm1      1.085 ppm2      5.114 CV     1
 OR { 2915}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 62   and name HA  ))
 ASSI { 2939}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 130  and name HN  ))
      3.500     1.500     1.500 peak  2939 spectrum    1 weight  0.10000E+01 volume  0.10010E-02 ppm1      0.646 ppm2      8.102 CV     1
 OR { 2939}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 24   and name HN  ))
 ASSI { 2956}
   (( segid "    " and resid 61   and name HA  ))
   (  segid "    " and resid 61   and name HD1%)
      3.300     1.400     1.400 peak  2956 spectrum    1 weight  0.10000E+01 volume  0.34751E-02 ppm1      4.578 ppm2      0.531 CV     1
 OR { 2956}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 60   and name HD1 ))
 ASSI { 2962}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 38   and name HN  ))
      4.000     2.000     2.000 peak  2962 spectrum    1 weight  0.10000E+01 volume  0.65065E-03 ppm1      6.703 ppm2      7.761 CV     1
 OR { 2962}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 36   and name HN  ))
 ASSI { 2965}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 81   and name HA1 ))
      3.600     3.600     2.400 peak  2965 spectrum    1 weight  0.10000E+01 volume  0.90274E-03 ppm1      0.575 ppm2      3.997 CV     1
 OR { 2965}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 27   and name HA2 ))
 OR { 2965}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 27   and name HA1 ))
 ASSI { 2991}
   (( segid "    " and resid 55   and name HA  ))
   (  segid "    " and resid 56   and name HG2%)
      3.600     1.700     1.700 peak  2991 spectrum    1 weight  0.10000E+01 volume  0.15803E-02 ppm1      5.020 ppm2      1.304 CV     1
 OR { 2991}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 152  and name HG1 ))
 OR { 2991}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 131  and name HD2 ))
 ASSI { 2994}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 54   and name HA  ))
      3.800     1.800     1.800 peak  2994 spectrum    1 weight  0.10000E+01 volume  0.10524E-02 ppm1      5.010 ppm2      4.399 CV     1
 OR { 2994}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HA  ))
 OR { 2994}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 56   and name HB  ))
 ASSI { 3012}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 127  and name HB1 ))
      3.800     1.800     1.800 peak  3012 spectrum    1 weight  0.10000E+01 volume  0.79200E-03 ppm1      1.411 ppm2      2.405 CV     1
 OR { 3012}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 139  and name HB2 ))
 ASSI { 3015}
   (  segid "    " and resid 83   and name HD% )
   (  segid "    " and resid 119  and name HG2%)
      4.400     2.400     1.600 peak  3015 spectrum    1 weight  0.10000E+01 volume  0.48823E-03 ppm1      6.780 ppm2      0.580 CV     1
 OR { 3015}
   (  segid "    " and resid 83   and name HD% )
   (  segid "    " and resid 71   and name HG1%)
 OR { 3015}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 60   and name HD1 ))
 ASSI { 3023}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 97   and name HA  ))
      2.700     2.700     3.300 peak  3023 spectrum    1 weight  0.10000E+01 volume  0.91171E-03 ppm1      0.846 ppm2      4.341 CV     1
 OR { 3023}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 133  and name HB  ))
 ASSI { 3034}
   (  segid "    " and resid 71   and name HG1%)
   (( segid "    " and resid 70   and name HB2 ))
      4.300     2.300     1.700 peak  3034 spectrum    1 weight  0.10000E+01 volume  0.80509E-03 ppm1      0.558 ppm2      2.998 CV     1
 OR { 3034}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 10   and name HE2 ))
 ASSI { 3035}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 25   and name HA  ))
      2.800     2.800     3.200 peak  3035 spectrum    1 weight  0.10000E+01 volume  0.40428E-03 ppm1      6.705 ppm2      3.470 CV     1
 OR { 3035}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 15   and name HA  ))
 ASSI { 3036}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 29   and name HB1 ))
      4.600     2.600     1.400 peak  3036 spectrum    1 weight  0.10000E+01 volume  0.66322E-03 ppm1      6.707 ppm2      2.679 CV     1
 OR { 3036}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 35   and name HB2 ))
 ASSI { 3037}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 63   and name HB2 ))
      4.100     2.100     1.900 peak  3037 spectrum    1 weight  0.10000E+01 volume  0.42931E-03 ppm1      6.703 ppm2      2.868 CV     1
 OR { 3037}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 155  and name HB2 ))
 OR { 3037}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 29   and name HB2 ))
 ASSI { 3039}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 63   and name HB2 ))
      3.600     1.700     1.700 peak  3039 spectrum    1 weight  0.10000E+01 volume  0.62512E-03 ppm1      6.732 ppm2      2.825 CV     1
 OR { 3039}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 155  and name HB2 ))
 ASSI { 3040}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 36   and name HA  ))
      3.800     1.800     1.800 peak  3040 spectrum    1 weight  0.10000E+01 volume  0.80759E-03 ppm1      6.725 ppm2      4.046 CV     1
 OR { 3040}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 73   and name HD2 ))
 OR { 3040}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 72   and name HA2 ))
 OR { 3040}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 73   and name HD1 ))
 ASSI { 3042}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 117  and name HB2 ))
      3.800     1.800     1.800 peak  3042 spectrum    1 weight  0.10000E+01 volume  0.64767E-03 ppm1      6.555 ppm2      3.021 CV     1
 OR { 3042}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 62   and name HB  ))
 ASSI { 3067}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 109  and name HN  ))
      2.600     0.800     0.800 peak  3067 spectrum    1 weight  0.10000E+01 volume  0.25292E-02 ppm1      4.230 ppm2      8.732 CV     1
 OR { 3067}
   (( segid "    " and resid 103  and name HA2 ))
   (( segid "    " and resid 104  and name HN  ))
 ASSI { 3071}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 148  and name HN  ))
      3.100     1.200     1.200 peak  3071 spectrum    1 weight  0.10000E+01 volume  0.15216E-02 ppm1      4.267 ppm2      8.341 CV     1
 OR { 3071}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 6    and name HN  ))
 OR { 3071}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 6    and name HN  ))
 OR { 3071}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 7    and name HN  ))
 OR { 3071}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 7    and name HN  ))
 ASSI { 3080}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 116  and name HB1 ))
      3.500     1.600     1.600 peak  3080 spectrum    1 weight  0.10000E+01 volume  0.20888E-02 ppm1      4.950 ppm2      0.922 CV     1
 OR { 3080}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 61   and name HG2%)
 OR { 3080}
   (( segid "    " and resid 68   and name HA  ))
   (  segid "    " and resid 84   and name HD2%)
 ASSI { 3086}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 72   and name HA2 ))
      4.000     2.000     2.000 peak  3086 spectrum    1 weight  0.10000E+01 volume  0.11188E-02 ppm1      5.256 ppm2      4.102 CV     1
 OR { 3086}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 73   and name HD1 ))
 ASSI {    2}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 126  and name HA  ))
      3.000     1.100     1.100 peak     2 spectrum    1 weight  0.10000E+01 volume  0.14275E-02 ppm1      9.220 ppm2      5.205 CV     1
 ASSI {    5}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
      4.400     2.400     1.600 peak     5 spectrum    1 weight  0.10000E+01 volume  0.42190E-03 ppm1      9.220 ppm2      8.106 CV     1
 ASSI {    6}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 127  and name HN  ))
      3.200     1.300     1.300 peak     6 spectrum    1 weight  0.10000E+01 volume  0.37360E-02 ppm1      9.220 ppm2      7.635 CV     1
 ASSI {    7}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      2.400     0.700     0.700 peak     7 spectrum    1 weight  0.10000E+01 volume  0.56122E-02 ppm1      9.220 ppm2      4.796 CV     1
 ASSI {    8}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB2 ))
      3.900     1.900     1.900 peak     8 spectrum    1 weight  0.10000E+01 volume  0.78544E-03 ppm1      9.220 ppm2      3.735 CV     1
 ASSI {    9}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      3.600     1.600     1.600 peak     9 spectrum    1 weight  0.10000E+01 volume  0.53575E-03 ppm1      9.220 ppm2      3.541 CV     1
 ASSI {   11}
   (( segid "    " and resid 126  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.700     1.700     1.700 peak    11 spectrum    1 weight  0.10000E+01 volume  0.64432E-03 ppm1      9.220 ppm2      1.569 CV     1
 ASSI {   13}
   (( segid "    " and resid 126  and name HN  ))
   (  segid "    " and resid 111  and name HG1%)
      4.900     3.000     1.100 peak    13 spectrum    1 weight  0.10000E+01 volume  0.55884E-03 ppm1      9.215 ppm2      0.855 CV     1
 ASSI {   16}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      3.000     1.100     1.100 peak    16 spectrum    1 weight  0.10000E+01 volume  0.16501E-02 ppm1      9.637 ppm2      8.768 CV     1
 ASSI {   17}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HN  ))
      4.200     2.200     1.800 peak    17 spectrum    1 weight  0.10000E+01 volume  0.49488E-03 ppm1      9.641 ppm2      8.117 CV     1
 ASSI {   20}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 109  and name HD% )
      5.500     3.800     0.500 peak    20 spectrum    1 weight  0.10000E+01 volume  0.17616E-03 ppm1      9.631 ppm2      7.063 CV     1
 ASSI {   21}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      3.600     1.600     1.600 peak    21 spectrum    1 weight  0.10000E+01 volume  0.43218E-03 ppm1      9.631 ppm2      6.786 CV     1
 ASSI {   22}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      4.700     2.800     1.300 peak    22 spectrum    1 weight  0.10000E+01 volume  0.16423E-03 ppm1      9.641 ppm2      5.528 CV     1
 ASSI {   23}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
      3.300     1.400     1.400 peak    23 spectrum    1 weight  0.10000E+01 volume  0.90878E-03 ppm1      9.631 ppm2      5.185 CV     1
 ASSI {   24}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      2.100     0.600     0.600 peak    24 spectrum    1 weight  0.10000E+01 volume  0.43215E-02 ppm1      9.631 ppm2      4.898 CV     1
 ASSI {   25}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      2.700     0.900     0.900 peak    25 spectrum    1 weight  0.10000E+01 volume  0.13045E-02 ppm1      9.631 ppm2      4.571 CV     1
 ASSI {   26}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 110  and name HA1 ))
      4.800     2.800     1.200 peak    26 spectrum    1 weight  0.10000E+01 volume  0.58285E-03 ppm1      9.630 ppm2      4.090 CV     1
 ASSI {   27}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
      5.800     4.200     0.200 peak    27 spectrum    1 weight  0.10000E+01 volume  0.21152E-03 ppm1      9.631 ppm2      3.057 CV     1
 ASSI {   30}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      2.700     0.900     0.900 peak    30 spectrum    1 weight  0.10000E+01 volume  0.19635E-02 ppm1      9.631 ppm2      1.595 CV     1
 ASSI {   31}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HD1 ))
      3.900     1.900     1.900 peak    31 spectrum    1 weight  0.10000E+01 volume  0.11663E-02 ppm1      9.631 ppm2      1.431 CV     1
 OR {   31}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HG2 ))
 OR {   31}
   (( segid "    " and resid 131  and name HN  ))
   (( segid "    " and resid 131  and name HG1 ))
 ASSI {   32}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 111  and name HG1%)
      4.700     2.700     1.300 peak    32 spectrum    1 weight  0.10000E+01 volume  0.34914E-03 ppm1      9.631 ppm2      0.859 CV     1
 ASSI {   35}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      4.500     2.600     1.500 peak    35 spectrum    1 weight  0.10000E+01 volume  0.52519E-03 ppm1      8.261 ppm2      9.491 CV     1
 ASSI {   37}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 88   and name HH12))
      5.800     4.200     0.200 peak    37 spectrum    1 weight  0.10000E+01 volume  0.17542E-03 ppm1      8.263 ppm2      6.606 CV     1
 OR {   37}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 88   and name HH11))
 ASSI {   38}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      5.100     3.300     0.900 peak    38 spectrum    1 weight  0.10000E+01 volume  0.18065E-03 ppm1      8.263 ppm2      5.585 CV     1
 ASSI {   39}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.600     0.800     0.800 peak    39 spectrum    1 weight  0.10000E+01 volume  0.27443E-02 ppm1      8.263 ppm2      5.229 CV     1
 ASSI {   40}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      2.400     0.700     0.700 peak    40 spectrum    1 weight  0.10000E+01 volume  0.42571E-02 ppm1      8.262 ppm2      4.928 CV     1
 ASSI {   45}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      3.900     1.900     1.900 peak    45 spectrum    1 weight  0.10000E+01 volume  0.13186E-02 ppm1      8.263 ppm2      1.983 CV     1
 ASSI {   46}
   (( segid "    " and resid 69   and name HN  ))
   (( segid "    " and resid 69   and name HB2 ))
      3.500     1.500     1.500 peak    46 spectrum    1 weight  0.10000E+01 volume  0.19665E-02 ppm1      8.261 ppm2      1.649 CV     1
 ASSI {   49}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 69   and name HD1%)
      3.700     1.700     1.700 peak    49 spectrum    1 weight  0.10000E+01 volume  0.73881E-03 ppm1      8.261 ppm2      0.657 CV     1
 OR {   49}
   (( segid "    " and resid 69   and name HN  ))
   (  segid "    " and resid 69   and name HD2%)
 ASSI {   50}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      3.000     1.100     1.100 peak    50 spectrum    1 weight  0.10000E+01 volume  0.11752E-02 ppm1      8.166 ppm2      9.402 CV     1
 ASSI {   51}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 157  and name HN  ))
      4.400     2.400     1.600 peak    51 spectrum    1 weight  0.10000E+01 volume  0.31102E-03 ppm1      8.170 ppm2      9.152 CV     1
 ASSI {   54}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 106  and name HN  ))
      5.200     3.300     0.800 peak    54 spectrum    1 weight  0.10000E+01 volume  0.28025E-03 ppm1      8.166 ppm2      7.302 CV     1
 ASSI {   55}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 157  and name HA  ))
      1.900     0.500     0.500 peak    55 spectrum    1 weight  0.10000E+01 volume  0.57070E-02 ppm1      8.166 ppm2      4.923 CV     1
 ASSI {   56}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 105  and name HA  ))
      4.300     2.300     1.700 peak    56 spectrum    1 weight  0.10000E+01 volume  0.50465E-03 ppm1      8.166 ppm2      4.384 CV     1
 ASSI {   57}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 107  and name HA  ))
      3.200     1.300     1.300 peak    57 spectrum    1 weight  0.10000E+01 volume  0.26108E-02 ppm1      8.165 ppm2      3.966 CV     1
 ASSI {   58}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HE2 ))
      5.300     3.500     0.700 peak    58 spectrum    1 weight  0.10000E+01 volume  0.19315E-03 ppm1      8.165 ppm2      2.933 CV     1
 ASSI {   59}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HE1 ))
      4.700     2.800     1.300 peak    59 spectrum    1 weight  0.10000E+01 volume  0.31571E-03 ppm1      8.166 ppm2      2.808 CV     1
 ASSI {   60}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 157  and name HG1 ))
      4.300     2.300     1.700 peak    60 spectrum    1 weight  0.10000E+01 volume  0.28953E-03 ppm1      8.166 ppm2      2.157 CV     1
 ASSI {   61}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HB1 ))
      2.500     0.800     0.800 peak    61 spectrum    1 weight  0.10000E+01 volume  0.24755E-02 ppm1      8.165 ppm2      1.872 CV     1
 ASSI {   62}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HB2 ))
      2.200     0.600     0.600 peak    62 spectrum    1 weight  0.10000E+01 volume  0.55200E-02 ppm1      8.165 ppm2      1.692 CV     1
 ASSI {   63}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HG2 ))
      3.200     1.300     1.300 peak    63 spectrum    1 weight  0.10000E+01 volume  0.26020E-02 ppm1      8.165 ppm2      1.341 CV     1
 OR {   63}
   (( segid "    " and resid 158  and name HN  ))
   (( segid "    " and resid 158  and name HG1 ))
 ASSI {   66}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      4.600     2.600     1.400 peak    66 spectrum    1 weight  0.10000E+01 volume  0.36329E-03 ppm1      9.176 ppm2      9.823 CV     1
 ASSI {   71}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      4.400     2.400     1.600 peak    71 spectrum    1 weight  0.10000E+01 volume  0.38208E-03 ppm1      9.177 ppm2      5.315 CV     1
 ASSI {   73}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      4.000     2.000     2.000 peak    73 spectrum    1 weight  0.10000E+01 volume  0.47042E-03 ppm1      9.177 ppm2      4.889 CV     1
 ASSI {   74}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 85   and name HB  ))
      4.400     2.500     1.600 peak    74 spectrum    1 weight  0.10000E+01 volume  0.40454E-03 ppm1      9.177 ppm2      3.983 CV     1
 ASSI {   75}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      2.800     1.000     1.000 peak    75 spectrum    1 weight  0.10000E+01 volume  0.26481E-02 ppm1      9.177 ppm2      1.801 CV     1
 ASSI {   76}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 86   and name HG  ))
      4.600     2.600     1.400 peak    76 spectrum    1 weight  0.10000E+01 volume  0.36644E-03 ppm1      9.176 ppm2      1.642 CV     1
 ASSI {   79}
   (( segid "    " and resid 86   and name HN  ))
   (( segid "    " and resid 60   and name HD1 ))
      3.600     1.600     1.600 peak    79 spectrum    1 weight  0.10000E+01 volume  0.60653E-03 ppm1      9.177 ppm2      0.548 CV     1
 ASSI {   80}
   (( segid "    " and resid 86   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      3.200     3.200     2.800 peak    80 spectrum    1 weight  0.10000E+01 volume  0.24631E-03 ppm1      9.183 ppm2     -0.010 CV     1
 ASSI {   83}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      4.700     2.800     1.300 peak    83 spectrum    1 weight  0.10000E+01 volume  0.20009E-03 ppm1      8.819 ppm2      7.069 CV     1
 ASSI {   84}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HD22))
      4.100     2.100     1.900 peak    84 spectrum    1 weight  0.10000E+01 volume  0.13024E-02 ppm1      8.821 ppm2      6.874 CV     1
 ASSI {   85}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      2.300     0.700     0.700 peak    85 spectrum    1 weight  0.10000E+01 volume  0.46280E-02 ppm1      8.819 ppm2      4.824 CV     1
 ASSI {   88}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 102  and name HD1%)
      4.200     2.200     1.800 peak    88 spectrum    1 weight  0.10000E+01 volume  0.73709E-03 ppm1      8.818 ppm2      0.681 CV     1
 ASSI {   89}
   (( segid "    " and resid 102  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
      4.200     2.200     1.800 peak    89 spectrum    1 weight  0.10000E+01 volume  0.54695E-03 ppm1      8.818 ppm2      0.563 CV     1
 ASSI {   90}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      4.900     3.000     1.100 peak    90 spectrum    1 weight  0.10000E+01 volume  0.31511E-03 ppm1      8.819 ppm2      8.312 CV     1
 ASSI {   92}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      5.400     3.600     0.600 peak    92 spectrum    1 weight  0.10000E+01 volume  0.31113E-03 ppm1      8.814 ppm2      3.115 CV     1
 ASSI {   93}
   (( segid "    " and resid 102  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      5.000     3.100     1.000 peak    93 spectrum    1 weight  0.10000E+01 volume  0.46140E-03 ppm1      8.817 ppm2      2.546 CV     1
 ASSI {   95}
   (( segid "    " and resid 5    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      4.500     2.500     1.500 peak    95 spectrum    1 weight  0.10000E+01 volume  0.20041E-03 ppm1      8.438 ppm2      4.458 CV     1
 ASSI {   96}
   (( segid "    " and resid 5    and name HN  ))
   (  segid "    " and resid 5    and name HB% )
      4.500     2.500     1.500 peak    96 spectrum    1 weight  0.10000E+01 volume  0.24745E-03 ppm1      8.436 ppm2      1.447 CV     1
 ASSI {   99}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      4.400     2.400     1.600 peak    99 spectrum    1 weight  0.10000E+01 volume  0.47976E-03 ppm1      7.052 ppm2      9.588 CV     1
 ASSI {  100}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 101  and name HN  ))
      4.000     2.000     2.000 peak   100 spectrum    1 weight  0.10000E+01 volume  0.66170E-03 ppm1      7.056 ppm2      8.315 CV     1
 ASSI {  102}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      2.400     0.700     0.700 peak   102 spectrum    1 weight  0.10000E+01 volume  0.40903E-02 ppm1      7.049 ppm2      6.774 CV     1
 ASSI {  103}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 4    and name HB2 ))
      4.900     3.000     1.100 peak   103 spectrum    1 weight  0.10000E+01 volume  0.38810E-03 ppm1      7.055 ppm2      4.765 CV     1
 OR {  103}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  104}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HB  ))
      4.400     2.400     1.600 peak   104 spectrum    1 weight  0.10000E+01 volume  0.40660E-03 ppm1      7.055 ppm2      4.532 CV     1
 ASSI {  105}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 99   and name HA  ))
      3.100     1.200     1.200 peak   105 spectrum    1 weight  0.10000E+01 volume  0.15620E-02 ppm1      7.053 ppm2      4.310 CV     1
 ASSI {  107}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
      2.400     0.700     0.700 peak   107 spectrum    1 weight  0.10000E+01 volume  0.52693E-02 ppm1      7.052 ppm2      2.187 CV     1
 OR {  107}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI {  108}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
      3.100     3.100     2.900 peak   108 spectrum    1 weight  0.10000E+01 volume  0.63337E-02 ppm1      7.053 ppm2      1.509 CV     1
 ASSI {  109}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      4.000     2.000     2.000 peak   109 spectrum    1 weight  0.10000E+01 volume  0.17608E-02 ppm1      7.053 ppm2      0.979 CV     1
 ASSI {  110}
   (( segid "    " and resid 100  and name HN  ))
   (  segid "    " and resid 100  and name HD2%)
      3.900     1.900     1.900 peak   110 spectrum    1 weight  0.10000E+01 volume  0.17112E-02 ppm1      7.051 ppm2      0.855 CV     1
 ASSI {  113}
   (( segid "    " and resid 100  and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
      4.500     2.500     1.500 peak   113 spectrum    1 weight  0.10000E+01 volume  0.20589E-03 ppm1      7.051 ppm2      1.795 CV     1
 ASSI {  114}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      3.000     1.100     1.100 peak   114 spectrum    1 weight  0.10000E+01 volume  0.15406E-02 ppm1      9.040 ppm2      8.401 CV     1
 ASSI {  116}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 155  and name HD% )
      3.500     3.500     2.500 peak   116 spectrum    1 weight  0.10000E+01 volume  0.20692E-02 ppm1      9.040 ppm2      7.211 CV     1
 ASSI {  117}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      3.700     1.700     1.700 peak   117 spectrum    1 weight  0.10000E+01 volume  0.12815E-02 ppm1      9.041 ppm2      5.702 CV     1
 ASSI {  118}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 83   and name HA  ))
      4.800     2.900     1.200 peak   118 spectrum    1 weight  0.10000E+01 volume  0.38242E-03 ppm1      9.041 ppm2      5.504 CV     1
 ASSI {  119}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      4.700     2.800     1.300 peak   119 spectrum    1 weight  0.10000E+01 volume  0.21527E-03 ppm1      9.040 ppm2      5.310 CV     1
 ASSI {  120}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      2.100     0.500     0.500 peak   120 spectrum    1 weight  0.10000E+01 volume  0.55254E-02 ppm1      9.041 ppm2      5.118 CV     1
 ASSI {  122}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HB  ))
      4.400     2.400     1.600 peak   122 spectrum    1 weight  0.10000E+01 volume  0.41843E-03 ppm1      9.039 ppm2      3.014 CV     1
 ASSI {  123}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB2 ))
      3.600     1.600     1.600 peak   123 spectrum    1 weight  0.10000E+01 volume  0.79146E-03 ppm1      9.039 ppm2      2.875 CV     1
 ASSI {  124}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 63   and name HB1 ))
      3.500     1.500     1.500 peak   124 spectrum    1 weight  0.10000E+01 volume  0.11791E-02 ppm1      9.039 ppm2      2.629 CV     1
 ASSI {  126}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      3.200     1.300     1.300 peak   126 spectrum    1 weight  0.10000E+01 volume  0.60533E-03 ppm1      9.040 ppm2      1.761 CV     1
 ASSI {  127}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      3.900     1.900     1.900 peak   127 spectrum    1 weight  0.10000E+01 volume  0.49823E-03 ppm1      9.040 ppm2      1.504 CV     1
 ASSI {  129}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 84   and name HD1%)
      4.300     2.400     1.700 peak   129 spectrum    1 weight  0.10000E+01 volume  0.63856E-03 ppm1      9.040 ppm2      0.962 CV     1
 OR {  129}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 84   and name HD2%)
 ASSI {  130}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      2.900     1.000     1.000 peak   130 spectrum    1 weight  0.10000E+01 volume  0.25924E-02 ppm1      9.040 ppm2      0.042 CV     1
 ASSI {  131}
   (( segid "    " and resid 63   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      4.500     2.500     1.500 peak   131 spectrum    1 weight  0.10000E+01 volume  0.25746E-03 ppm1      9.040 ppm2      8.791 CV     1
 ASSI {  134}
   (( segid "    " and resid 63   and name HN  ))
   (  segid "    " and resid 61   and name HD1%)
      5.100     3.200     0.900 peak   134 spectrum    1 weight  0.10000E+01 volume  0.56812E-03 ppm1      9.038 ppm2      0.540 CV     1
 ASSI {  139}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      3.300     1.400     1.400 peak   139 spectrum    1 weight  0.10000E+01 volume  0.81111E-03 ppm1      8.674 ppm2      3.638 CV     1
 ASSI {  141}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 135  and name HB  ))
      2.800     1.000     1.000 peak   141 spectrum    1 weight  0.10000E+01 volume  0.26584E-02 ppm1      8.675 ppm2      1.702 CV     1
 ASSI {  144}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 135  and name HD1%)
      3.900     1.900     1.900 peak   144 spectrum    1 weight  0.10000E+01 volume  0.17138E-02 ppm1      8.674 ppm2      0.839 CV     1
 ASSI {  145}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 100  and name HN  ))
      4.300     2.300     1.700 peak   145 spectrum    1 weight  0.10000E+01 volume  0.21416E-03 ppm1      8.674 ppm2      7.064 CV     1
 ASSI {  146}
   (( segid "    " and resid 135  and name HN  ))
   (( segid "    " and resid 101  and name HD22))
      4.800     2.900     1.200 peak   146 spectrum    1 weight  0.10000E+01 volume  0.25353E-03 ppm1      8.668 ppm2      6.861 CV     1
 ASSI {  147}
   (( segid "    " and resid 135  and name HN  ))
   (  segid "    " and resid 135  and name HG2%)
      3.600     1.600     1.600 peak   147 spectrum    1 weight  0.10000E+01 volume  0.81532E-03 ppm1      8.674 ppm2      0.619 CV     1
 ASSI {  148}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HN  ))
      2.600     0.800     0.800 peak   148 spectrum    1 weight  0.10000E+01 volume  0.30136E-02 ppm1      8.620 ppm2      8.389 CV     1
 ASSI {  149}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      4.100     2.100     1.900 peak   149 spectrum    1 weight  0.10000E+01 volume  0.60616E-03 ppm1      8.619 ppm2      8.143 CV     1
 ASSI {  150}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HD21))
      5.100     3.300     0.900 peak   150 spectrum    1 weight  0.10000E+01 volume  0.18010E-03 ppm1      8.619 ppm2      7.499 CV     1
 ASSI {  151}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HD22))
      5.400     3.600     0.600 peak   151 spectrum    1 weight  0.10000E+01 volume  0.30735E-03 ppm1      8.619 ppm2      7.134 CV     1
 ASSI {  152}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.900     1.900     1.900 peak   152 spectrum    1 weight  0.10000E+01 volume  0.52736E-03 ppm1      8.615 ppm2      4.558 CV     1
 ASSI {  155}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      3.900     1.900     1.900 peak   155 spectrum    1 weight  0.10000E+01 volume  0.44604E-03 ppm1      8.619 ppm2      3.822 CV     1
 ASSI {  156}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 10   and name HE2 ))
      4.500     2.500     1.500 peak   156 spectrum    1 weight  0.10000E+01 volume  0.40015E-03 ppm1      8.618 ppm2      3.020 CV     1
 OR {  156}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 10   and name HE1 ))
 ASSI {  157}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
      3.200     1.300     1.300 peak   157 spectrum    1 weight  0.10000E+01 volume  0.17672E-02 ppm1      8.618 ppm2      2.825 CV     1
 OR {  157}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  159}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.900     2.900     3.100 peak   159 spectrum    1 weight  0.10000E+01 volume  0.41920E-03 ppm1      8.618 ppm2      2.140 CV     1
 OR {  159}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  160}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      4.500     2.500     1.500 peak   160 spectrum    1 weight  0.10000E+01 volume  0.62593E-03 ppm1      8.620 ppm2      1.944 CV     1
 OR {  160}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HG11))
 OR {  160}
   (( segid "    " and resid 14   and name HN  ))
   (( segid "    " and resid 15   and name HG12))
 ASSI {  162}
   (( segid "    " and resid 14   and name HN  ))
   (  segid "    " and resid 14   and name HB% )
      2.400     0.700     0.700 peak   162 spectrum    1 weight  0.10000E+01 volume  0.61527E-02 ppm1      8.619 ppm2      1.653 CV     1
 ASSI {  164}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      4.600     2.700     1.400 peak   164 spectrum    1 weight  0.10000E+01 volume  0.26225E-03 ppm1      8.165 ppm2      8.635 CV     1
 ASSI {  165}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 80   and name HN  ))
      2.400     0.700     0.700 peak   165 spectrum    1 weight  0.10000E+01 volume  0.55538E-02 ppm1      8.164 ppm2      7.325 CV     1
 ASSI {  166}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.400     1.400     1.400 peak   166 spectrum    1 weight  0.10000E+01 volume  0.10382E-02 ppm1      8.165 ppm2      4.779 CV     1
 ASSI {  168}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.200     3.200     2.800 peak   168 spectrum    1 weight  0.10000E+01 volume  0.21162E-03 ppm1      8.165 ppm2      3.167 CV     1
 ASSI {  169}
   (( segid "    " and resid 79   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      2.600     2.600     3.400 peak   169 spectrum    1 weight  0.10000E+01 volume  0.72635E-03 ppm1      8.165 ppm2      2.877 CV     1
 ASSI {  171}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 79   and name HB% )
      2.500     0.800     0.800 peak   171 spectrum    1 weight  0.10000E+01 volume  0.78963E-02 ppm1      8.165 ppm2      1.704 CV     1
 ASSI {  172}
   (( segid "    " and resid 79   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      4.500     2.600     1.500 peak   172 spectrum    1 weight  0.10000E+01 volume  0.73578E-03 ppm1      8.162 ppm2      1.285 CV     1
 ASSI {  174}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      3.000     1.100     1.100 peak   174 spectrum    1 weight  0.10000E+01 volume  0.13548E-02 ppm1      9.527 ppm2      9.823 CV     1
 ASSI {  175}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      5.900     4.300     0.100 peak   175 spectrum    1 weight  0.10000E+01 volume  0.19671E-03 ppm1      9.528 ppm2      7.905 CV     1
 ASSI {  176}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      3.900     1.900     1.900 peak   176 spectrum    1 weight  0.10000E+01 volume  0.57606E-03 ppm1      9.525 ppm2      5.597 CV     1
 ASSI {  177}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      2.100     0.500     0.500 peak   177 spectrum    1 weight  0.10000E+01 volume  0.66036E-02 ppm1      9.524 ppm2      5.265 CV     1
 ASSI {  181}
   (( segid "    " and resid 70   and name HN  ))
   (  segid "    " and resid 69   and name HD2%)
      2.500     2.500     3.500 peak   181 spectrum    1 weight  0.10000E+01 volume  0.10647E-02 ppm1      9.525 ppm2      0.634 CV     1
 ASSI {  183}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HD21))
      5.400     3.600     0.600 peak   183 spectrum    1 weight  0.10000E+01 volume  0.26939E-03 ppm1      9.527 ppm2      7.331 CV     1
 ASSI {  184}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 70   and name HD22))
      5.900     4.300     0.100 peak   184 spectrum    1 weight  0.10000E+01 volume  0.31677E-03 ppm1      9.528 ppm2      7.134 CV     1
 ASSI {  187}
   (( segid "    " and resid 70   and name HN  ))
   (( segid "    " and resid 69   and name HB1 ))
      4.100     2.100     1.900 peak   187 spectrum    1 weight  0.10000E+01 volume  0.13458E-02 ppm1      9.525 ppm2      0.971 CV     1
 ASSI {  191}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 70   and name HD21))
      3.800     1.800     1.800 peak   191 spectrum    1 weight  0.10000E+01 volume  0.60350E-03 ppm1      9.818 ppm2      7.351 CV     1
 ASSI {  193}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
      3.900     1.900     1.900 peak   193 spectrum    1 weight  0.10000E+01 volume  0.34625E-03 ppm1      9.818 ppm2      6.411 CV     1
 ASSI {  197}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HG  ))
      2.500     2.500     3.500 peak   197 spectrum    1 weight  0.10000E+01 volume  0.10134E-02 ppm1      9.819 ppm2      1.656 CV     1
 ASSI {  198}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.000     2.000     2.000 peak   198 spectrum    1 weight  0.10000E+01 volume  0.67668E-03 ppm1      9.819 ppm2      1.511 CV     1
 ASSI {  201}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HN  ))
      4.300     2.300     1.700 peak   201 spectrum    1 weight  0.10000E+01 volume  0.36888E-03 ppm1      9.819 ppm2      8.369 CV     1
 ASSI {  202}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 70   and name HD22))
      5.300     3.500     0.700 peak   202 spectrum    1 weight  0.10000E+01 volume  0.18456E-03 ppm1      9.813 ppm2      7.173 CV     1
 ASSI {  204}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 84   and name HA  ))
      2.200     0.600     0.600 peak   204 spectrum    1 weight  0.10000E+01 volume  0.61195E-02 ppm1      9.819 ppm2      5.292 CV     1
 ASSI {  206}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 70   and name HB1 ))
      3.200     1.300     1.300 peak   206 spectrum    1 weight  0.10000E+01 volume  0.73211E-03 ppm1      9.817 ppm2      2.585 CV     1
 ASSI {  207}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.700     1.700     1.700 peak   207 spectrum    1 weight  0.10000E+01 volume  0.10676E-02 ppm1      9.816 ppm2      1.085 CV     1
 ASSI {  208}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 84   and name HD2%)
      4.400     2.400     1.600 peak   208 spectrum    1 weight  0.10000E+01 volume  0.11965E-02 ppm1      9.819 ppm2      0.962 CV     1
 ASSI {  209}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 60   and name HG2 ))
      3.200     3.200     2.800 peak   209 spectrum    1 weight  0.10000E+01 volume  0.10573E-02 ppm1      9.819 ppm2      0.828 CV     1
 OR {  209}
   (( segid "    " and resid 85   and name HN  ))
   (( segid "    " and resid 60   and name HG1 ))
 ASSI {  210}
   (( segid "    " and resid 85   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      4.300     2.300     1.700 peak   210 spectrum    1 weight  0.10000E+01 volume  0.31955E-03 ppm1      9.816 ppm2      0.000 CV     1
 ASSI {  211}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      4.700     2.800     1.300 peak   211 spectrum    1 weight  0.10000E+01 volume  0.19285E-03 ppm1      9.584 ppm2      8.616 CV     1
 ASSI {  212}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      2.400     0.700     0.700 peak   212 spectrum    1 weight  0.10000E+01 volume  0.46555E-02 ppm1      9.579 ppm2      8.041 CV     1
 ASSI {  213}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      3.700     1.700     1.700 peak   213 spectrum    1 weight  0.10000E+01 volume  0.63773E-03 ppm1      9.582 ppm2      7.803 CV     1
 ASSI {  218}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      2.900     2.900     3.100 peak   218 spectrum    1 weight  0.10000E+01 volume  0.31800E-02 ppm1      9.582 ppm2      4.046 CV     1
 ASSI {  219}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      3.600     1.600     1.600 peak   219 spectrum    1 weight  0.10000E+01 volume  0.76153E-03 ppm1      9.584 ppm2      3.836 CV     1
 ASSI {  220}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      3.400     1.500     1.500 peak   220 spectrum    1 weight  0.10000E+01 volume  0.86631E-03 ppm1      9.582 ppm2      3.415 CV     1
 ASSI {  221}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      3.400     3.400     2.600 peak   221 spectrum    1 weight  0.10000E+01 volume  0.16674E-03 ppm1      9.584 ppm2      2.083 CV     1
 ASSI {  222}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.900     1.100     1.100 peak   222 spectrum    1 weight  0.10000E+01 volume  0.23431E-02 ppm1      9.580 ppm2      1.796 CV     1
 OR {  222}
   (( segid "    " and resid 98   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI {  226}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 158  and name HG1 ))
      5.500     3.700     0.500 peak   226 spectrum    1 weight  0.10000E+01 volume  0.27926E-03 ppm1      9.389 ppm2      1.324 CV     1
 OR {  226}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 158  and name HG2 ))
 ASSI {  228}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HE2 ))
      5.200     3.400     0.800 peak   228 spectrum    1 weight  0.10000E+01 volume  0.22588E-03 ppm1      9.386 ppm2      2.818 CV     1
 OR {  228}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HE1 ))
 ASSI {  229}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 157  and name HB2 ))
      4.900     3.000     1.100 peak   229 spectrum    1 weight  0.10000E+01 volume  0.35937E-03 ppm1      9.388 ppm2      1.782 CV     1
 ASSI {  232}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      5.100     3.300     0.900 peak   232 spectrum    1 weight  0.10000E+01 volume  0.21884E-03 ppm1      8.650 ppm2      7.642 CV     1
 ASSI {  233}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HN  ))
      4.100     2.100     1.900 peak   233 spectrum    1 weight  0.10000E+01 volume  0.49674E-03 ppm1      8.652 ppm2      7.446 CV     1
 ASSI {  238}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      2.500     0.800     0.800 peak   238 spectrum    1 weight  0.10000E+01 volume  0.28226E-02 ppm1      8.654 ppm2      3.018 CV     1
 ASSI {  239}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      2.700     0.900     0.900 peak   239 spectrum    1 weight  0.10000E+01 volume  0.24604E-02 ppm1      8.653 ppm2      2.477 CV     1
 ASSI {  240}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 152  and name HG1 ))
      3.200     1.300     1.300 peak   240 spectrum    1 weight  0.10000E+01 volume  0.96049E-03 ppm1      8.650 ppm2      1.233 CV     1
 OR {  240}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 152  and name HG2 ))
 ASSI {  241}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 60   and name HG1 ))
      2.900     1.000     1.000 peak   241 spectrum    1 weight  0.10000E+01 volume  0.36375E-02 ppm1      8.653 ppm2      0.774 CV     1
 OR {  241}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI {  243}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.200     1.300     1.300 peak   243 spectrum    1 weight  0.10000E+01 volume  0.75422E-03 ppm1      8.368 ppm2      3.075 CV     1
 ASSI {  244}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB2 ))
      4.400     2.400     1.600 peak   244 spectrum    1 weight  0.10000E+01 volume  0.48105E-03 ppm1      8.369 ppm2      1.234 CV     1
 ASSI {  245}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
      3.900     1.900     1.900 peak   245 spectrum    1 weight  0.10000E+01 volume  0.66903E-03 ppm1      8.370 ppm2      1.007 CV     1
 ASSI {  246}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 151  and name HD22))
      4.400     2.400     1.600 peak   246 spectrum    1 weight  0.10000E+01 volume  0.25651E-03 ppm1      8.368 ppm2      7.085 CV     1
 ASSI {  247}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      3.400     1.400     1.400 peak   247 spectrum    1 weight  0.10000E+01 volume  0.74589E-03 ppm1      8.369 ppm2      4.888 CV     1
 ASSI {  249}
   (( segid "    " and resid 90   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      3.600     1.700     1.700 peak   249 spectrum    1 weight  0.10000E+01 volume  0.13084E-02 ppm1      8.367 ppm2      2.873 CV     1
 ASSI {  250}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      2.800     1.000     1.000 peak   250 spectrum    1 weight  0.10000E+01 volume  0.21840E-02 ppm1      8.368 ppm2      0.544 CV     1
 ASSI {  251}
   (( segid "    " and resid 90   and name HN  ))
   (  segid "    " and resid 89   and name HD2%)
      3.400     1.400     1.400 peak   251 spectrum    1 weight  0.10000E+01 volume  0.10517E-02 ppm1      8.366 ppm2      0.288 CV     1
 ASSI {  253}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      4.200     2.200     1.800 peak   253 spectrum    1 weight  0.10000E+01 volume  0.35043E-03 ppm1      7.470 ppm2      8.598 CV     1
 ASSI {  254}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HN  ))
      3.200     1.200     1.200 peak   254 spectrum    1 weight  0.10000E+01 volume  0.56709E-03 ppm1      7.468 ppm2      7.801 CV     1
 ASSI {  255}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 117  and name HD22))
      5.100     3.200     0.900 peak   255 spectrum    1 weight  0.10000E+01 volume  0.21692E-03 ppm1      7.468 ppm2      6.722 CV     1
 ASSI {  257}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.900     1.000     1.000 peak   257 spectrum    1 weight  0.10000E+01 volume  0.19410E-02 ppm1      7.467 ppm2      4.698 CV     1
 ASSI {  258}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.200     2.200     3.800 peak   258 spectrum    1 weight  0.10000E+01 volume  0.96100E-02 ppm1      7.467 ppm2      4.081 CV     1
 ASSI {  259}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      3.600     1.600     1.600 peak   259 spectrum    1 weight  0.10000E+01 volume  0.66643E-03 ppm1      7.466 ppm2      3.291 CV     1
 ASSI {  260}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
      3.200     1.200     1.200 peak   260 spectrum    1 weight  0.10000E+01 volume  0.88633E-03 ppm1      7.467 ppm2      3.010 CV     1
 ASSI {  262}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 42   and name HG11))
      2.900     2.900     3.100 peak   262 spectrum    1 weight  0.10000E+01 volume  0.40918E-02 ppm1      7.467 ppm2      1.678 CV     1
 OR {  262}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 42   and name HG12))
 ASSI {  263}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      3.300     1.400     1.400 peak   263 spectrum    1 weight  0.10000E+01 volume  0.95327E-03 ppm1      7.467 ppm2      1.462 CV     1
 OR {  263}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  264}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 38   and name HG  ))
      3.300     1.400     1.400 peak   264 spectrum    1 weight  0.10000E+01 volume  0.34900E-02 ppm1      7.467 ppm2      0.959 CV     1
 ASSI {  265}
   (( segid "    " and resid 39   and name HN  ))
   (  segid "    " and resid 38   and name HD1%)
      3.500     3.500     2.500 peak   265 spectrum    1 weight  0.10000E+01 volume  0.49640E-02 ppm1      7.467 ppm2      0.781 CV     1
 ASSI {  269}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HG1 ))
      3.800     1.800     1.800 peak   269 spectrum    1 weight  0.10000E+01 volume  0.36773E-03 ppm1      9.391 ppm2      0.715 CV     1
 OR {  269}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HG2 ))
 ASSI {  273}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      4.900     3.000     1.100 peak   273 spectrum    1 weight  0.10000E+01 volume  0.23312E-03 ppm1      9.389 ppm2      2.357 CV     1
 ASSI {  274}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      2.200     0.600     0.600 peak   274 spectrum    1 weight  0.10000E+01 volume  0.31852E-02 ppm1      9.387 ppm2      1.078 CV     1
 ASSI {  277}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      2.400     2.400     3.600 peak   277 spectrum    1 weight  0.10000E+01 volume  0.11347E-02 ppm1      9.162 ppm2      8.042 CV     1
 ASSI {  278}
   (( segid "    " and resid 157  and name HN  ))
   (  segid "    " and resid 155  and name HD% )
      3.900     1.900     1.900 peak   278 spectrum    1 weight  0.10000E+01 volume  0.53472E-03 ppm1      9.163 ppm2      7.183 CV     1
 ASSI {  279}
   (( segid "    " and resid 157  and name HN  ))
   (  segid "    " and resid 156  and name HD% )
      4.500     2.500     1.500 peak   279 spectrum    1 weight  0.10000E+01 volume  0.20801E-03 ppm1      9.162 ppm2      6.813 CV     1
 ASSI {  281}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 63   and name HA  ))
      3.000     3.000     3.000 peak   281 spectrum    1 weight  0.10000E+01 volume  0.13252E-02 ppm1      9.165 ppm2      5.505 CV     1
 ASSI {  282}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HA  ))
      2.800     1.000     1.000 peak   282 spectrum    1 weight  0.10000E+01 volume  0.10733E-02 ppm1      9.166 ppm2      4.918 CV     1
 ASSI {  283}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 156  and name HA  ))
      2.400     0.700     0.700 peak   283 spectrum    1 weight  0.10000E+01 volume  0.50448E-02 ppm1      9.163 ppm2      4.191 CV     1
 ASSI {  284}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 107  and name HE1 ))
      4.600     2.600     1.400 peak   284 spectrum    1 weight  0.10000E+01 volume  0.28046E-03 ppm1      9.166 ppm2      2.768 CV     1
 OR {  284}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 107  and name HE2 ))
 ASSI {  285}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      4.900     3.000     1.100 peak   285 spectrum    1 weight  0.10000E+01 volume  0.44020E-03 ppm1      9.165 ppm2      2.354 CV     1
 ASSI {  286}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HG1 ))
      3.200     1.300     1.300 peak   286 spectrum    1 weight  0.10000E+01 volume  0.12279E-02 ppm1      9.165 ppm2      2.161 CV     1
 OR {  286}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HG2 ))
 ASSI {  287}
   (( segid "    " and resid 157  and name HN  ))
   (( segid "    " and resid 157  and name HB2 ))
      3.200     1.300     1.300 peak   287 spectrum    1 weight  0.10000E+01 volume  0.22149E-02 ppm1      9.164 ppm2      1.742 CV     1
 ASSI {  302}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 24   and name HN  ))
      4.700     2.800     1.300 peak   302 spectrum    1 weight  0.10000E+01 volume  0.26273E-03 ppm1      8.688 ppm2      8.108 CV     1
 ASSI {  304}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      2.700     0.900     0.900 peak   304 spectrum    1 weight  0.10000E+01 volume  0.31142E-02 ppm1      8.681 ppm2      8.382 CV     1
 ASSI {  305}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      4.000     2.000     2.000 peak   305 spectrum    1 weight  0.10000E+01 volume  0.52226E-03 ppm1      8.681 ppm2      7.798 CV     1
 ASSI {  310}
   (( segid "    " and resid 21   and name HN  ))
   (( segid "    " and resid 18   and name HB  ))
      2.700     2.700     3.300 peak   310 spectrum    1 weight  0.10000E+01 volume  0.56360E-03 ppm1      8.677 ppm2      2.183 CV     1
 ASSI {  311}
   (( segid "    " and resid 21   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      2.300     0.700     0.700 peak   311 spectrum    1 weight  0.10000E+01 volume  0.93253E-02 ppm1      8.681 ppm2      1.444 CV     1
 ASSI {  313}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
      3.400     3.400     2.600 peak   313 spectrum    1 weight  0.10000E+01 volume  0.16859E-03 ppm1      8.162 ppm2      2.804 CV     1
 OR {  313}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  315}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      3.900     1.900     1.900 peak   315 spectrum    1 weight  0.10000E+01 volume  0.68264E-03 ppm1      8.091 ppm2      8.632 CV     1
 ASSI {  316}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      2.500     0.800     0.800 peak   316 spectrum    1 weight  0.10000E+01 volume  0.36507E-02 ppm1      8.091 ppm2      8.390 CV     1
 ASSI {  317}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      2.400     0.700     0.700 peak   317 spectrum    1 weight  0.10000E+01 volume  0.43951E-02 ppm1      8.091 ppm2      7.799 CV     1
 ASSI {  319}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HB2 ))
      2.900     1.000     1.000 peak   319 spectrum    1 weight  0.10000E+01 volume  0.34831E-02 ppm1      8.091 ppm2      4.053 CV     1
 OR {  319}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 23   and name HB1 ))
 ASSI {  320}
   (( segid "    " and resid 24   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      5.700     4.100     0.300 peak   320 spectrum    1 weight  0.10000E+01 volume  0.18311E-03 ppm1      8.091 ppm2      3.504 CV     1
 ASSI {  322}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      2.300     2.300     3.700 peak   322 spectrum    1 weight  0.10000E+01 volume  0.10626E-01 ppm1      8.091 ppm2      1.474 CV     1
 ASSI {  324}
   (( segid "    " and resid 24   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
      4.900     3.000     1.100 peak   324 spectrum    1 weight  0.10000E+01 volume  0.35475E-03 ppm1      8.092 ppm2      0.596 CV     1
 ASSI {  326}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      2.700     0.900     0.900 peak   326 spectrum    1 weight  0.10000E+01 volume  0.24241E-02 ppm1     10.653 ppm2      8.770 CV     1
 ASSI {  328}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
      4.400     2.400     1.600 peak   328 spectrum    1 weight  0.10000E+01 volume  0.40815E-03 ppm1     10.653 ppm2      8.065 CV     1
 ASSI {  331}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      5.600     3.900     0.400 peak   331 spectrum    1 weight  0.10000E+01 volume  0.28930E-03 ppm1     10.654 ppm2      4.913 CV     1
 ASSI {  332}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      3.900     1.900     1.900 peak   332 spectrum    1 weight  0.10000E+01 volume  0.61106E-03 ppm1     10.653 ppm2      4.516 CV     1
 ASSI {  337}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HG1 ))
      3.600     1.600     1.600 peak   337 spectrum    1 weight  0.10000E+01 volume  0.16625E-02 ppm1     10.654 ppm2      1.406 CV     1
 ASSI {  338}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HB2 ))
      2.600     0.800     0.800 peak   338 spectrum    1 weight  0.10000E+01 volume  0.21864E-02 ppm1     10.653 ppm2      1.201 CV     1
 ASSI {  339}
   (( segid "    " and resid 116  and name HN  ))
   (( segid "    " and resid 116  and name HB1 ))
      3.300     1.400     1.400 peak   339 spectrum    1 weight  0.10000E+01 volume  0.17095E-02 ppm1     10.653 ppm2      0.920 CV     1
 ASSI {  340}
   (( segid "    " and resid 116  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      3.000     3.000     3.000 peak   340 spectrum    1 weight  0.10000E+01 volume  0.22064E-02 ppm1     10.652 ppm2      0.588 CV     1
 ASSI {  342}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 154  and name HN  ))
      4.700     2.800     1.300 peak   342 spectrum    1 weight  0.10000E+01 volume  0.36306E-03 ppm1      8.903 ppm2      9.481 CV     1
 ASSI {  345}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 128  and name HA  ))
      4.600     2.600     1.400 peak   345 spectrum    1 weight  0.10000E+01 volume  0.31348E-03 ppm1      8.903 ppm2      3.805 CV     1
 ASSI {  346}
   (( segid "    " and resid 111  and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      2.700     0.900     0.900 peak   346 spectrum    1 weight  0.10000E+01 volume  0.30357E-02 ppm1      8.902 ppm2      2.242 CV     1
 ASSI {  351}
   (( segid "    " and resid 111  and name HN  ))
   (  segid "    " and resid 113  and name HD1%)
      3.200     1.300     1.300 peak   351 spectrum    1 weight  0.10000E+01 volume  0.85780E-03 ppm1      8.904 ppm2      0.641 CV     1
 ASSI {  354}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HD21))
      4.500     2.600     1.500 peak   354 spectrum    1 weight  0.10000E+01 volume  0.35097E-03 ppm1      8.327 ppm2      7.782 CV     1
 ASSI {  356}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HD22))
      5.500     3.800     0.500 peak   356 spectrum    1 weight  0.10000E+01 volume  0.30159E-03 ppm1      8.323 ppm2      6.871 CV     1
 ASSI {  357}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.000     1.100     1.100 peak   357 spectrum    1 weight  0.10000E+01 volume  0.16651E-02 ppm1      8.327 ppm2      4.817 CV     1
 ASSI {  360}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      2.700     0.900     0.900 peak   360 spectrum    1 weight  0.10000E+01 volume  0.31889E-02 ppm1      8.328 ppm2      2.525 CV     1
 ASSI {  361}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB2 ))
      4.400     2.400     1.600 peak   361 spectrum    1 weight  0.10000E+01 volume  0.60313E-03 ppm1      8.328 ppm2      2.174 CV     1
 OR {  361}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HB1 ))
 ASSI {  362}
   (( segid "    " and resid 101  and name HN  ))
   (  segid "    " and resid 100  and name HD1%)
      1.900     1.900     4.100 peak   362 spectrum    1 weight  0.10000E+01 volume  0.48268E-02 ppm1      8.328 ppm2      0.955 CV     1
 ASSI {  363}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 19   and name HN  ))
      4.300     2.300     1.700 peak   363 spectrum    1 weight  0.10000E+01 volume  0.29606E-03 ppm1      8.165 ppm2      8.530 CV     1
 ASSI {  364}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 15   and name HN  ))
      4.500     2.500     1.500 peak   364 spectrum    1 weight  0.10000E+01 volume  0.23285E-03 ppm1      8.165 ppm2      8.444 CV     1
 ASSI {  365}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      4.100     2.100     1.900 peak   365 spectrum    1 weight  0.10000E+01 volume  0.33957E-03 ppm1      8.165 ppm2      4.595 CV     1
 ASSI {  366}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      3.600     1.700     1.700 peak   366 spectrum    1 weight  0.10000E+01 volume  0.70968E-03 ppm1      8.162 ppm2      4.255 CV     1
 ASSI {  372}
   (( segid "    " and resid 17   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
      4.400     2.400     1.600 peak   372 spectrum    1 weight  0.10000E+01 volume  0.41302E-03 ppm1      8.163 ppm2      0.972 CV     1
 ASSI {  374}
   (( segid "    " and resid 17   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      5.400     3.600     0.600 peak   374 spectrum    1 weight  0.10000E+01 volume  0.24342E-03 ppm1      8.155 ppm2      3.410 CV     1
 ASSI {  379}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 138  and name HN  ))
      4.300     2.300     1.700 peak   379 spectrum    1 weight  0.10000E+01 volume  0.42765E-03 ppm1      8.790 ppm2      8.287 CV     1
 ASSI {  381}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      2.500     0.800     0.800 peak   381 spectrum    1 weight  0.10000E+01 volume  0.37707E-02 ppm1      8.790 ppm2      7.547 CV     1
 ASSI {  383}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      2.800     1.000     1.000 peak   383 spectrum    1 weight  0.10000E+01 volume  0.23976E-02 ppm1      8.791 ppm2      3.698 CV     1
 ASSI {  384}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      3.600     1.600     1.600 peak   384 spectrum    1 weight  0.10000E+01 volume  0.19550E-02 ppm1      8.790 ppm2      2.386 CV     1
 ASSI {  386}
   (( segid "    " and resid 140  and name HN  ))
   (  segid "    " and resid 140  and name HB% )
      2.400     0.700     0.700 peak   386 spectrum    1 weight  0.10000E+01 volume  0.69797E-02 ppm1      8.790 ppm2      1.415 CV     1
 ASSI {  387}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      3.600     1.600     1.600 peak   387 spectrum    1 weight  0.10000E+01 volume  0.61822E-03 ppm1      8.041 ppm2      8.891 CV     1
 ASSI {  389}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      3.500     1.600     1.600 peak   389 spectrum    1 weight  0.10000E+01 volume  0.17834E-02 ppm1      8.042 ppm2      4.785 CV     1
 ASSI {  390}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.200     1.300     1.300 peak   390 spectrum    1 weight  0.10000E+01 volume  0.12616E-02 ppm1      8.042 ppm2      4.578 CV     1
 ASSI {  392}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      2.700     0.900     0.900 peak   392 spectrum    1 weight  0.10000E+01 volume  0.26763E-02 ppm1      8.041 ppm2      4.136 CV     1
 ASSI {  393}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
      4.100     2.100     1.900 peak   393 spectrum    1 weight  0.10000E+01 volume  0.58797E-03 ppm1      8.042 ppm2      3.975 CV     1
 OR {  393}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI {  395}
   (( segid "    " and resid 48   and name HN  ))
   (  segid "    " and resid 48   and name HB% )
      2.600     2.600     3.400 peak   395 spectrum    1 weight  0.10000E+01 volume  0.91042E-02 ppm1      8.042 ppm2      1.384 CV     1
 ASSI {  397}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
      5.000     3.200     1.000 peak   397 spectrum    1 weight  0.10000E+01 volume  0.20272E-03 ppm1      7.286 ppm2      8.764 CV     1
 ASSI {  400}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      4.400     2.400     1.600 peak   400 spectrum    1 weight  0.10000E+01 volume  0.62481E-03 ppm1      7.275 ppm2      9.407 CV     1
 ASSI {  402}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HN  ))
      2.400     0.700     0.700 peak   402 spectrum    1 weight  0.10000E+01 volume  0.47365E-02 ppm1      7.280 ppm2      7.996 CV     1
 ASSI {  403}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 106  and name HA  ))
      2.800     1.000     1.000 peak   403 spectrum    1 weight  0.10000E+01 volume  0.15568E-02 ppm1      7.279 ppm2      4.900 CV     1
 ASSI {  404}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      3.100     1.200     1.200 peak   404 spectrum    1 weight  0.10000E+01 volume  0.17616E-02 ppm1      7.281 ppm2      4.402 CV     1
 ASSI {  405}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 103  and name HA2 ))
      3.400     1.400     1.400 peak   405 spectrum    1 weight  0.10000E+01 volume  0.11290E-02 ppm1      7.278 ppm2      4.229 CV     1
 ASSI {  406}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB2 ))
      4.100     2.100     1.900 peak   406 spectrum    1 weight  0.10000E+01 volume  0.74454E-03 ppm1      7.279 ppm2      3.990 CV     1
 ASSI {  407}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      3.600     1.600     1.600 peak   407 spectrum    1 weight  0.10000E+01 volume  0.10235E-02 ppm1      7.279 ppm2      3.860 CV     1
 ASSI {  408}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
      3.900     1.900     1.900 peak   408 spectrum    1 weight  0.10000E+01 volume  0.85336E-03 ppm1      7.279 ppm2      1.674 CV     1
 OR {  408}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI {  409}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 158  and name HG2 ))
      4.300     2.300     1.700 peak   409 spectrum    1 weight  0.10000E+01 volume  0.33694E-03 ppm1      7.282 ppm2      1.316 CV     1
 OR {  409}
   (( segid "    " and resid 106  and name HN  ))
   (( segid "    " and resid 158  and name HG1 ))
 ASSI {  410}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      2.200     2.200     3.800 peak   410 spectrum    1 weight  0.10000E+01 volume  0.77072E-02 ppm1      7.278 ppm2      1.120 CV     1
 ASSI {  411}
   (( segid "    " and resid 106  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
      5.000     3.100     1.000 peak   411 spectrum    1 weight  0.10000E+01 volume  0.25702E-03 ppm1      7.279 ppm2      0.571 CV     1
 ASSI {  413}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 155  and name HE% )
      4.800     2.900     1.200 peak   413 spectrum    1 weight  0.10000E+01 volume  0.16625E-03 ppm1      8.811 ppm2      6.730 CV     1
 ASSI {  415}
   (( segid "    " and resid 140  and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      5.800     4.100     0.200 peak   415 spectrum    1 weight  0.10000E+01 volume  0.21204E-03 ppm1      8.797 ppm2      3.403 CV     1
 ASSI {  418}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      5.200     3.300     0.800 peak   418 spectrum    1 weight  0.10000E+01 volume  0.18056E-03 ppm1      8.322 ppm2      8.577 CV     1
 ASSI {  419}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      2.600     0.800     0.800 peak   419 spectrum    1 weight  0.10000E+01 volume  0.37690E-02 ppm1      8.325 ppm2      8.027 CV     1
 ASSI {  422}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      5.200     3.400     0.800 peak   422 spectrum    1 weight  0.10000E+01 volume  0.36415E-03 ppm1      8.326 ppm2      3.456 CV     1
 ASSI {  425}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 92   and name HB% )
      2.600     2.600     3.400 peak   425 spectrum    1 weight  0.10000E+01 volume  0.54120E-02 ppm1      8.319 ppm2      1.420 CV     1
 ASSI {  426}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      2.800     2.800     3.200 peak   426 spectrum    1 weight  0.10000E+01 volume  0.76233E-02 ppm1      8.319 ppm2      0.549 CV     1
 ASSI {  427}
   (( segid "    " and resid 93   and name HN  ))
   (  segid "    " and resid 89   and name HD2%)
      4.900     3.000     1.100 peak   427 spectrum    1 weight  0.10000E+01 volume  0.30151E-03 ppm1      8.324 ppm2      0.278 CV     1
 ASSI {  429}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      4.400     2.400     1.600 peak   429 spectrum    1 weight  0.10000E+01 volume  0.40909E-03 ppm1      8.277 ppm2      8.776 CV     1
 ASSI {  431}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.900     1.100     1.100 peak   431 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      8.277 ppm2      4.504 CV     1
 ASSI {  434}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HG12))
      5.200     3.400     0.800 peak   434 spectrum    1 weight  0.10000E+01 volume  0.22428E-03 ppm1      8.277 ppm2      1.276 CV     1
 OR {  434}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HG11))
 ASSI {  440}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      4.600     2.600     1.400 peak   440 spectrum    1 weight  0.10000E+01 volume  0.20720E-03 ppm1      7.147 ppm2      4.288 CV     1
 ASSI {  441}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 122  and name HZ  ))
      5.500     3.800     0.500 peak   441 spectrum    1 weight  0.10000E+01 volume  0.24816E-03 ppm1      7.141 ppm2      6.672 CV     1
 ASSI {  442}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      3.300     1.300     1.300 peak   442 spectrum    1 weight  0.10000E+01 volume  0.97381E-03 ppm1      7.145 ppm2      4.968 CV     1
 ASSI {  443}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 115  and name HA2 ))
      2.200     2.200     3.800 peak   443 spectrum    1 weight  0.10000E+01 volume  0.19331E-02 ppm1      7.144 ppm2      3.873 CV     1
 ASSI {  445}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB2 ))
      4.300     2.300     1.700 peak   445 spectrum    1 weight  0.10000E+01 volume  0.54970E-03 ppm1      7.144 ppm2      3.018 CV     1
 ASSI {  446}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      4.200     2.200     1.800 peak   446 spectrum    1 weight  0.10000E+01 volume  0.82302E-03 ppm1      7.145 ppm2      2.625 CV     1
 ASSI {  447}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HG12))
      3.700     1.700     1.700 peak   447 spectrum    1 weight  0.10000E+01 volume  0.28930E-02 ppm1      7.145 ppm2      1.585 CV     1
 ASSI {  448}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 116  and name HB2 ))
      3.700     3.700     2.300 peak   448 spectrum    1 weight  0.10000E+01 volume  0.17747E-02 ppm1      7.145 ppm2      1.168 CV     1
 ASSI {  449}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 119  and name HG2%)
      2.800     1.000     1.000 peak   449 spectrum    1 weight  0.10000E+01 volume  0.20099E-02 ppm1      7.144 ppm2      0.585 CV     1
 ASSI {  450}
   (( segid "    " and resid 119  and name HN  ))
   (  segid "    " and resid 119  and name HD1%)
      4.200     2.200     1.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.17087E-02 ppm1      7.144 ppm2     -0.209 CV     1
 ASSI {  451}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 32   and name HG1 ))
      4.900     3.000     1.100 peak   451 spectrum    1 weight  0.10000E+01 volume  0.21708E-03 ppm1      7.123 ppm2      2.253 CV     1
 OR {  451}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
 ASSI {  455}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 128  and name HA  ))
      2.400     0.700     0.700 peak   455 spectrum    1 weight  0.10000E+01 volume  0.45570E-02 ppm1      8.885 ppm2      3.789 CV     1
 ASSI {  456}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.600     1.700     1.700 peak   456 spectrum    1 weight  0.10000E+01 volume  0.35137E-03 ppm1      8.885 ppm2      3.485 CV     1
 ASSI {  459}
   (( segid "    " and resid 128  and name HN  ))
   (( segid "    " and resid 128  and name HB1 ))
      3.900     1.900     1.900 peak   459 spectrum    1 weight  0.10000E+01 volume  0.13198E-02 ppm1      8.883 ppm2      2.237 CV     1
 ASSI {  460}
   (( segid "    " and resid 47   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.800     1.800     1.800 peak   460 spectrum    1 weight  0.10000E+01 volume  0.14261E-02 ppm1      8.883 ppm2      1.343 CV     1
 ASSI {  461}
   (( segid "    " and resid 128  and name HN  ))
   (  segid "    " and resid 129  and name HB% )
      4.600     2.600     1.400 peak   461 spectrum    1 weight  0.10000E+01 volume  0.38747E-03 ppm1      8.884 ppm2      1.129 CV     1
 ASSI {  465}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      4.800     2.800     1.200 peak   465 spectrum    1 weight  0.10000E+01 volume  0.18912E-03 ppm1      8.809 ppm2      5.686 CV     1
 ASSI {  466}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      2.800     1.000     1.000 peak   466 spectrum    1 weight  0.10000E+01 volume  0.94737E-03 ppm1      8.811 ppm2      5.132 CV     1
 ASSI {  470}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 61   and name HD1%)
      3.500     3.500     2.500 peak   470 spectrum    1 weight  0.10000E+01 volume  0.25324E-02 ppm1      8.810 ppm2      0.541 CV     1
 ASSI {  471}
   (( segid "    " and resid 62   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      4.300     2.300     1.700 peak   471 spectrum    1 weight  0.10000E+01 volume  0.52490E-03 ppm1      8.809 ppm2      0.055 CV     1
 ASSI {  472}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
      4.900     3.000     1.100 peak   472 spectrum    1 weight  0.10000E+01 volume  0.71913E-03 ppm1      8.646 ppm2      2.075 CV     1
 OR {  472}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
 ASSI {  473}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      4.800     2.900     1.200 peak   473 spectrum    1 weight  0.10000E+01 volume  0.39849E-03 ppm1      8.463 ppm2      9.439 CV     1
 ASSI {  474}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      4.800     2.800     1.200 peak   474 spectrum    1 weight  0.10000E+01 volume  0.31279E-03 ppm1      8.416 ppm2      9.018 CV     1
 ASSI {  475}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 108  and name HN  ))
      3.200     1.300     1.300 peak   475 spectrum    1 weight  0.10000E+01 volume  0.13035E-02 ppm1      8.467 ppm2      7.503 CV     1
 ASSI {  477}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      3.300     1.300     1.300 peak   477 spectrum    1 weight  0.10000E+01 volume  0.12233E-02 ppm1      8.466 ppm2      5.508 CV     1
 ASSI {  479}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HA  ))
      3.100     1.200     1.200 peak   479 spectrum    1 weight  0.10000E+01 volume  0.12479E-02 ppm1      8.465 ppm2      4.191 CV     1
 ASSI {  480}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      4.200     2.200     1.800 peak   480 spectrum    1 weight  0.10000E+01 volume  0.32322E-03 ppm1      8.469 ppm2      0.026 CV     1
 ASSI {  481}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 157  and name HN  ))
      4.800     2.900     1.200 peak   481 spectrum    1 weight  0.10000E+01 volume  0.41012E-03 ppm1      8.464 ppm2      9.140 CV     1
 ASSI {  482}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 155  and name HD% )
      4.200     2.300     1.800 peak   482 spectrum    1 weight  0.10000E+01 volume  0.59616E-03 ppm1      8.470 ppm2      7.210 CV     1
 ASSI {  483}
   (( segid "    " and resid 156  and name HN  ))
   (  segid "    " and resid 122  and name HE% )
      3.300     1.400     1.400 peak   483 spectrum    1 weight  0.10000E+01 volume  0.18644E-03 ppm1      8.464 ppm2      6.362 CV     1
 ASSI {  485}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      2.600     0.800     0.800 peak   485 spectrum    1 weight  0.10000E+01 volume  0.17920E-02 ppm1      8.465 ppm2      2.344 CV     1
 ASSI {  486}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 156  and name HB1 ))
      4.000     2.000     2.000 peak   486 spectrum    1 weight  0.10000E+01 volume  0.10816E-02 ppm1      8.466 ppm2      1.853 CV     1
 ASSI {  488}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      2.900     1.000     1.000 peak   488 spectrum    1 weight  0.10000E+01 volume  0.25177E-02 ppm1      8.421 ppm2      6.773 CV     1
 ASSI {  489}
   (( segid "    " and resid 122  and name HN  ))
   (  segid "    " and resid 122  and name HE% )
      4.800     2.900     1.200 peak   489 spectrum    1 weight  0.10000E+01 volume  0.34149E-03 ppm1      8.426 ppm2      6.376 CV     1
 ASSI {  491}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      3.100     1.200     1.200 peak   491 spectrum    1 weight  0.10000E+01 volume  0.32623E-02 ppm1      8.421 ppm2      3.630 CV     1
 OR {  491}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI {  495}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 149  and name HN  ))
      3.300     1.300     1.300 peak   495 spectrum    1 weight  0.10000E+01 volume  0.11335E-02 ppm1      8.360 ppm2      8.784 CV     1
 ASSI {  496}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
      4.000     2.000     2.000 peak   496 spectrum    1 weight  0.10000E+01 volume  0.37154E-03 ppm1      8.363 ppm2      7.021 CV     1
 ASSI {  497}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      2.800     1.000     1.000 peak   497 spectrum    1 weight  0.10000E+01 volume  0.30322E-02 ppm1      8.359 ppm2      4.737 CV     1
 ASSI {  500}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HB2 ))
      3.100     1.200     1.200 peak   500 spectrum    1 weight  0.10000E+01 volume  0.19867E-02 ppm1      8.359 ppm2      2.912 CV     1
 ASSI {  501}
   (( segid "    " and resid 148  and name HN  ))
   (( segid "    " and resid 148  and name HB1 ))
      3.500     1.500     1.500 peak   501 spectrum    1 weight  0.10000E+01 volume  0.11573E-02 ppm1      8.360 ppm2      2.655 CV     1
 ASSI {  503}
   (( segid "    " and resid 148  and name HN  ))
   (  segid "    " and resid 147  and name HG2%)
      4.700     2.700     1.300 peak   503 spectrum    1 weight  0.10000E+01 volume  0.52659E-03 ppm1      8.361 ppm2      1.261 CV     1
 ASSI {  506}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      2.400     0.700     0.700 peak   506 spectrum    1 weight  0.10000E+01 volume  0.39065E-02 ppm1      7.952 ppm2      7.666 CV     1
 ASSI {  509}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      4.500     2.500     1.500 peak   509 spectrum    1 weight  0.10000E+01 volume  0.18917E-03 ppm1      7.952 ppm2      4.608 CV     1
 ASSI {  510}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HA  ))
      2.600     0.900     0.900 peak   510 spectrum    1 weight  0.10000E+01 volume  0.38480E-02 ppm1      7.952 ppm2      4.182 CV     1
 ASSI {  511}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HA2 ))
      3.100     1.200     1.200 peak   511 spectrum    1 weight  0.10000E+01 volume  0.20328E-02 ppm1      7.952 ppm2      3.964 CV     1
 OR {  511}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 27   and name HA1 ))
 ASSI {  512}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      3.200     1.300     1.300 peak   512 spectrum    1 weight  0.10000E+01 volume  0.12277E-02 ppm1      7.952 ppm2      3.486 CV     1
 ASSI {  513}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HB1 ))
      4.800     2.900     1.200 peak   513 spectrum    1 weight  0.10000E+01 volume  0.33138E-03 ppm1      7.952 ppm2      2.914 CV     1
 ASSI {  514}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HB2 ))
      2.400     0.700     0.700 peak   514 spectrum    1 weight  0.10000E+01 volume  0.44902E-02 ppm1      7.952 ppm2      1.922 CV     1
 ASSI {  515}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 28   and name HG  ))
      2.400     0.700     0.700 peak   515 spectrum    1 weight  0.10000E+01 volume  0.35811E-02 ppm1      7.952 ppm2      1.643 CV     1
 ASSI {  517}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 30   and name HD1%)
      4.800     2.900     1.200 peak   517 spectrum    1 weight  0.10000E+01 volume  0.31654E-03 ppm1      7.953 ppm2      0.944 CV     1
 OR {  517}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
 ASSI {  518}
   (( segid "    " and resid 28   and name HN  ))
   (  segid "    " and resid 28   and name HD1%)
      3.800     1.800     1.800 peak   518 spectrum    1 weight  0.10000E+01 volume  0.22449E-02 ppm1      7.953 ppm2      0.818 CV     1
 ASSI {  519}
   (( segid "    " and resid 28   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      4.200     2.200     1.800 peak   519 spectrum    1 weight  0.10000E+01 volume  0.46775E-03 ppm1      7.952 ppm2      8.625 CV     1
 ASSI {  522}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      2.800     0.900     0.900 peak   522 spectrum    1 weight  0.10000E+01 volume  0.22884E-02 ppm1      7.810 ppm2      9.029 CV     1
 ASSI {  524}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 29   and name HE% )
      4.500     2.600     1.500 peak   524 spectrum    1 weight  0.10000E+01 volume  0.34181E-03 ppm1      7.810 ppm2      6.689 CV     1
 ASSI {  526}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      3.300     1.400     1.400 peak   526 spectrum    1 weight  0.10000E+01 volume  0.13137E-02 ppm1      7.809 ppm2      4.310 CV     1
 ASSI {  527}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.600     2.600     3.400 peak   527 spectrum    1 weight  0.10000E+01 volume  0.37286E-02 ppm1      7.810 ppm2      4.090 CV     1
 ASSI {  528}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 37   and name HA1 ))
      3.200     1.300     1.300 peak   528 spectrum    1 weight  0.10000E+01 volume  0.13026E-02 ppm1      7.813 ppm2      3.708 CV     1
 ASSI {  529}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      4.600     2.600     1.400 peak   529 spectrum    1 weight  0.10000E+01 volume  0.39162E-03 ppm1      7.812 ppm2      2.699 CV     1
 ASSI {  530}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
      4.500     2.500     1.500 peak   530 spectrum    1 weight  0.10000E+01 volume  0.22740E-03 ppm1      7.812 ppm2      2.420 CV     1
 ASSI {  531}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.400     1.500     1.500 peak   531 spectrum    1 weight  0.10000E+01 volume  0.11974E-02 ppm1      7.812 ppm2      2.211 CV     1
 OR {  531}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI {  532}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB2 ))
      2.400     0.700     0.700 peak   532 spectrum    1 weight  0.10000E+01 volume  0.66408E-02 ppm1      7.813 ppm2      1.484 CV     1
 OR {  532}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI {  533}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 38   and name HG  ))
      2.900     1.000     1.000 peak   533 spectrum    1 weight  0.10000E+01 volume  0.10921E-02 ppm1      7.812 ppm2      0.967 CV     1
 ASSI {  534}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 38   and name HD1%)
      4.300     2.300     1.700 peak   534 spectrum    1 weight  0.10000E+01 volume  0.12022E-02 ppm1      7.812 ppm2      0.782 CV     1
 ASSI {  535}
   (( segid "    " and resid 38   and name HN  ))
   (  segid "    " and resid 38   and name HD2%)
      3.600     1.600     1.600 peak   535 spectrum    1 weight  0.10000E+01 volume  0.14305E-02 ppm1      7.812 ppm2      0.182 CV     1
 ASSI {  536}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      4.600     2.700     1.400 peak   536 spectrum    1 weight  0.10000E+01 volume  0.16223E-03 ppm1      7.120 ppm2      4.613 CV     1
 ASSI {  537}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HB2 ))
      3.700     1.700     1.700 peak   537 spectrum    1 weight  0.10000E+01 volume  0.48322E-03 ppm1      7.120 ppm2      2.897 CV     1
 ASSI {  538}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      3.600     1.600     1.600 peak   538 spectrum    1 weight  0.10000E+01 volume  0.11734E-02 ppm1      7.120 ppm2      8.936 CV     1
 ASSI {  539}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HN  ))
      2.500     0.800     0.800 peak   539 spectrum    1 weight  0.10000E+01 volume  0.44220E-02 ppm1      7.120 ppm2      7.666 CV     1
 ASSI {  540}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HA  ))
      3.000     1.200     1.200 peak   540 spectrum    1 weight  0.10000E+01 volume  0.21823E-02 ppm1      7.120 ppm2      4.251 CV     1
 ASSI {  541}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HA  ))
      2.500     0.800     0.800 peak   541 spectrum    1 weight  0.10000E+01 volume  0.40591E-02 ppm1      7.120 ppm2      4.054 CV     1
 ASSI {  542}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HB  ))
      2.500     2.500     3.500 peak   542 spectrum    1 weight  0.10000E+01 volume  0.84096E-02 ppm1      7.120 ppm2      1.993 CV     1
 ASSI {  543}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HG12))
      3.000     1.100     1.100 peak   543 spectrum    1 weight  0.10000E+01 volume  0.21198E-02 ppm1      7.120 ppm2      1.716 CV     1
 OR {  543}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 30   and name HG11))
 ASSI {  545}
   (( segid "    " and resid 30   and name HN  ))
   (  segid "    " and resid 30   and name HD1%)
      3.100     3.100     2.900 peak   545 spectrum    1 weight  0.10000E+01 volume  0.53873E-02 ppm1      7.120 ppm2      0.980 CV     1
 ASSI {  546}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HD22))
      4.600     2.600     1.400 peak   546 spectrum    1 weight  0.10000E+01 volume  0.35017E-03 ppm1      9.130 ppm2      7.059 CV     1
 ASSI {  547}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 113  and name HG11))
      5.200     3.400     0.800 peak   547 spectrum    1 weight  0.10000E+01 volume  0.25218E-03 ppm1      9.128 ppm2      1.325 CV     1
 OR {  547}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 113  and name HG12))
 ASSI {  548}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      4.800     2.900     1.200 peak   548 spectrum    1 weight  0.10000E+01 volume  0.22782E-03 ppm1      9.131 ppm2      8.872 CV     1
 ASSI {  550}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 152  and name HN  ))
      3.200     1.300     1.300 peak   550 spectrum    1 weight  0.10000E+01 volume  0.12284E-02 ppm1      9.133 ppm2      8.434 CV     1
 ASSI {  551}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      2.200     0.600     0.600 peak   551 spectrum    1 weight  0.10000E+01 volume  0.40081E-02 ppm1      9.128 ppm2      4.776 CV     1
 ASSI {  553}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.300     0.600     0.600 peak   553 spectrum    1 weight  0.10000E+01 volume  0.43771E-02 ppm1      9.128 ppm2      4.281 CV     1
 ASSI {  554}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      4.000     2.000     2.000 peak   554 spectrum    1 weight  0.10000E+01 volume  0.35687E-03 ppm1      9.129 ppm2      3.518 CV     1
 ASSI {  555}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      4.300     2.300     1.700 peak   555 spectrum    1 weight  0.10000E+01 volume  0.59273E-03 ppm1      9.129 ppm2      3.015 CV     1
 ASSI {  558}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 111  and name HB  ))
      4.600     2.700     1.400 peak   558 spectrum    1 weight  0.10000E+01 volume  0.34573E-03 ppm1      9.131 ppm2      2.242 CV     1
 ASSI {  559}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
      3.800     1.800     1.800 peak   559 spectrum    1 weight  0.10000E+01 volume  0.16652E-02 ppm1      9.130 ppm2      1.519 CV     1
 ASSI {  562}
   (( segid "    " and resid 112  and name HN  ))
   (( segid "    " and resid 112  and name HD21))
      4.300     2.300     1.700 peak   562 spectrum    1 weight  0.10000E+01 volume  0.21717E-03 ppm1      9.115 ppm2      7.604 CV     1
 ASSI {  565}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 152  and name HA  ))
      2.200     0.600     0.600 peak   565 spectrum    1 weight  0.10000E+01 volume  0.57586E-02 ppm1      8.905 ppm2      4.771 CV     1
 ASSI {  567}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 152  and name HB2 ))
      2.800     1.000     1.000 peak   567 spectrum    1 weight  0.10000E+01 volume  0.21597E-02 ppm1      8.905 ppm2      1.826 CV     1
 ASSI {  568}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 152  and name HB1 ))
      3.600     1.600     1.600 peak   568 spectrum    1 weight  0.10000E+01 volume  0.20340E-02 ppm1      8.905 ppm2      1.660 CV     1
 ASSI {  569}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      3.600     1.600     1.600 peak   569 spectrum    1 weight  0.10000E+01 volume  0.18640E-02 ppm1      8.905 ppm2      1.557 CV     1
 ASSI {  570}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 61   and name HG12))
      4.400     2.400     1.600 peak   570 spectrum    1 weight  0.10000E+01 volume  0.10845E-02 ppm1      8.904 ppm2      1.114 CV     1
 OR {  570}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 61   and name HG11))
 ASSI {  572}
   (( segid "    " and resid 153  and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      3.800     1.800     1.800 peak   572 spectrum    1 weight  0.10000E+01 volume  0.79842E-03 ppm1      8.908 ppm2      8.256 CV     1
 ASSI {  576}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      4.700     2.700     1.300 peak   576 spectrum    1 weight  0.10000E+01 volume  0.39431E-03 ppm1      8.647 ppm2      7.417 CV     1
 ASSI {  578}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.100     0.500     0.500 peak   578 spectrum    1 weight  0.10000E+01 volume  0.10744E-01 ppm1      8.648 ppm2      4.391 CV     1
 ASSI {  580}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
      2.700     0.900     0.900 peak   580 spectrum    1 weight  0.10000E+01 volume  0.43261E-02 ppm1      8.646 ppm2      2.653 CV     1
 OR {  580}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
 ASSI {  581}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB2 ))
      3.800     1.800     1.800 peak   581 spectrum    1 weight  0.10000E+01 volume  0.18909E-02 ppm1      8.646 ppm2      2.347 CV     1
 ASSI {  582}
   (( segid "    " and resid 51   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      4.300     2.300     1.700 peak   582 spectrum    1 weight  0.10000E+01 volume  0.12071E-02 ppm1      8.646 ppm2      1.811 CV     1
 ASSI {  587}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      3.700     1.700     1.700 peak   587 spectrum    1 weight  0.10000E+01 volume  0.17051E-02 ppm1      8.381 ppm2      9.029 CV     1
 ASSI {  589}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
      5.200     3.400     0.800 peak   589 spectrum    1 weight  0.10000E+01 volume  0.25982E-03 ppm1      8.383 ppm2      6.407 CV     1
 ASSI {  594}
   (( segid "    " and resid 84   and name HN  ))
   (  segid "    " and resid 62   and name HG2%)
      3.000     1.100     1.100 peak   594 spectrum    1 weight  0.10000E+01 volume  0.14456E-02 ppm1      8.378 ppm2      0.023 CV     1
 ASSI {  595}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      4.400     2.400     1.600 peak   595 spectrum    1 weight  0.10000E+01 volume  0.26681E-03 ppm1      8.375 ppm2      5.632 CV     1
 ASSI {  596}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 62   and name HA  ))
      4.000     2.000     2.000 peak   596 spectrum    1 weight  0.10000E+01 volume  0.53286E-03 ppm1      8.373 ppm2      5.080 CV     1
 ASSI {  598}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB2 ))
      2.700     0.900     0.900 peak   598 spectrum    1 weight  0.10000E+01 volume  0.16590E-02 ppm1      8.378 ppm2      1.754 CV     1
 ASSI {  599}
   (( segid "    " and resid 84   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      3.800     1.800     1.800 peak   599 spectrum    1 weight  0.10000E+01 volume  0.12126E-02 ppm1      8.378 ppm2      1.521 CV     1
 ASSI {  603}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      2.800     1.000     1.000 peak   603 spectrum    1 weight  0.10000E+01 volume  0.18612E-02 ppm1      8.175 ppm2      9.175 CV     1
 ASSI {  604}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 62   and name HN  ))
      4.200     2.200     1.800 peak   604 spectrum    1 weight  0.10000E+01 volume  0.34272E-03 ppm1      8.175 ppm2      8.829 CV     1
 ASSI {  606}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 85   and name HA  ))
      4.600     2.600     1.400 peak   606 spectrum    1 weight  0.10000E+01 volume  0.34988E-03 ppm1      8.175 ppm2      5.675 CV     1
 ASSI {  608}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      3.600     1.700     1.700 peak   608 spectrum    1 weight  0.10000E+01 volume  0.83800E-03 ppm1      8.177 ppm2      4.824 CV     1
 ASSI {  609}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      2.200     2.200     3.800 peak   609 spectrum    1 weight  0.10000E+01 volume  0.23508E-02 ppm1      8.176 ppm2      1.684 CV     1
 ASSI {  611}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HG12))
      2.700     0.900     0.900 peak   611 spectrum    1 weight  0.10000E+01 volume  0.15538E-02 ppm1      8.176 ppm2      1.091 CV     1
 OR {  611}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HG11))
 ASSI {  613}
   (( segid "    " and resid 61   and name HN  ))
   (  segid "    " and resid 61   and name HD1%)
      3.500     1.500     1.500 peak   613 spectrum    1 weight  0.10000E+01 volume  0.21850E-02 ppm1      8.177 ppm2      0.546 CV     1
 ASSI {  617}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 6    and name HB1 ))
      3.400     1.400     1.400 peak   617 spectrum    1 weight  0.10000E+01 volume  0.85496E-03 ppm1      8.148 ppm2      4.296 CV     1
 OR {  617}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI {  619}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HG1 ))
      2.800     1.000     1.000 peak   619 spectrum    1 weight  0.10000E+01 volume  0.37108E-02 ppm1      8.148 ppm2      2.484 CV     1
 OR {  619}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HG2 ))
 ASSI {  620}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.400     0.700     0.700 peak   620 spectrum    1 weight  0.10000E+01 volume  0.73368E-02 ppm1      8.148 ppm2      2.143 CV     1
 OR {  620}
   (( segid "    " and resid 12   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  624}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      2.400     0.700     0.700 peak   624 spectrum    1 weight  0.10000E+01 volume  0.49471E-02 ppm1      7.908 ppm2      7.189 CV     1
 ASSI {  626}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      3.200     1.300     1.300 peak   626 spectrum    1 weight  0.10000E+01 volume  0.12777E-02 ppm1      7.908 ppm2      3.698 CV     1
 ASSI {  628}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      4.800     2.800     1.200 peak   628 spectrum    1 weight  0.10000E+01 volume  0.21350E-03 ppm1      7.907 ppm2      2.852 CV     1
 ASSI {  629}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 139  and name HG2 ))
      4.700     2.800     1.300 peak   629 spectrum    1 weight  0.10000E+01 volume  0.17377E-03 ppm1      7.909 ppm2      2.244 CV     1
 OR {  629}
   (( segid "    " and resid 143  and name HN  ))
   (( segid "    " and resid 139  and name HG1 ))
 ASSI {  631}
   (( segid "    " and resid 143  and name HN  ))
   (  segid "    " and resid 142  and name HG2%)
      3.800     1.800     1.800 peak   631 spectrum    1 weight  0.10000E+01 volume  0.11862E-02 ppm1      7.908 ppm2      1.217 CV     1
 ASSI {  638}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 75   and name HN  ))
      4.300     2.300     1.700 peak   638 spectrum    1 weight  0.10000E+01 volume  0.54753E-03 ppm1      6.986 ppm2      8.536 CV     1
 ASSI {  639}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 82   and name HN  ))
      4.700     2.700     1.300 peak   639 spectrum    1 weight  0.10000E+01 volume  0.32368E-03 ppm1      6.990 ppm2      8.033 CV     1
 ASSI {  640}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      3.900     1.900     1.900 peak   640 spectrum    1 weight  0.10000E+01 volume  0.36518E-03 ppm1      6.984 ppm2      7.784 CV     1
 ASSI {  642}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      2.400     0.700     0.700 peak   642 spectrum    1 weight  0.10000E+01 volume  0.53971E-02 ppm1      6.989 ppm2      5.113 CV     1
 ASSI {  644}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HD1 ))
      5.000     3.100     1.000 peak   644 spectrum    1 weight  0.10000E+01 volume  0.37312E-03 ppm1      6.985 ppm2      4.047 CV     1
 OR {  644}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HD2 ))
 ASSI {  645}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.900     1.000     1.000 peak   645 spectrum    1 weight  0.10000E+01 volume  0.20771E-02 ppm1      6.988 ppm2      3.818 CV     1
 ASSI {  646}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      4.500     2.500     1.500 peak   646 spectrum    1 weight  0.10000E+01 volume  0.64792E-03 ppm1      6.990 ppm2      2.623 CV     1
 ASSI {  647}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
      2.600     0.900     0.900 peak   647 spectrum    1 weight  0.10000E+01 volume  0.29775E-02 ppm1      6.988 ppm2      2.175 CV     1
 OR {  647}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  648}
   (( segid "    " and resid 74   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
      4.400     2.400     1.600 peak   648 spectrum    1 weight  0.10000E+01 volume  0.53959E-03 ppm1      6.988 ppm2      1.827 CV     1
 ASSI {  653}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.500     2.500     3.500 peak   653 spectrum    1 weight  0.10000E+01 volume  0.52676E-02 ppm1      8.617 ppm2      4.824 CV     1
 ASSI {  654}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      3.200     1.200     1.200 peak   654 spectrum    1 weight  0.10000E+01 volume  0.15843E-02 ppm1      8.616 ppm2      3.123 CV     1
 ASSI {  655}
   (( segid "    " and resid 77   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      3.000     1.100     1.100 peak   655 spectrum    1 weight  0.10000E+01 volume  0.20496E-02 ppm1      8.616 ppm2      2.906 CV     1
 ASSI {  658}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      2.900     1.000     1.000 peak   658 spectrum    1 weight  0.10000E+01 volume  0.18553E-02 ppm1      8.602 ppm2      8.382 CV     1
 ASSI {  659}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      2.400     0.700     0.700 peak   659 spectrum    1 weight  0.10000E+01 volume  0.33929E-02 ppm1      8.603 ppm2      7.800 CV     1
 ASSI {  660}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      3.000     1.100     1.100 peak   660 spectrum    1 weight  0.10000E+01 volume  0.16506E-02 ppm1      8.603 ppm2      4.003 CV     1
 ASSI {  662}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      4.200     2.200     1.800 peak   662 spectrum    1 weight  0.10000E+01 volume  0.61604E-03 ppm1      8.604 ppm2      3.653 CV     1
 ASSI {  665}
   (( segid "    " and resid 95   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.500     0.800     0.800 peak   665 spectrum    1 weight  0.10000E+01 volume  0.45040E-02 ppm1      8.604 ppm2      2.099 CV     1
 ASSI {  667}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      2.300     2.300     3.700 peak   667 spectrum    1 weight  0.10000E+01 volume  0.69393E-02 ppm1      8.600 ppm2      0.882 CV     1
 ASSI {  668}
   (( segid "    " and resid 95   and name HN  ))
   (  segid "    " and resid 93   and name HB% )
      4.700     2.800     1.300 peak   668 spectrum    1 weight  0.10000E+01 volume  0.43808E-03 ppm1      8.598 ppm2      0.545 CV     1
 ASSI {  670}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      3.000     3.000     3.000 peak   670 spectrum    1 weight  0.10000E+01 volume  0.36192E-03 ppm1      8.452 ppm2      2.178 CV     1
 OR {  670}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  671}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      2.900     1.000     1.000 peak   671 spectrum    1 weight  0.10000E+01 volume  0.17265E-02 ppm1      8.450 ppm2      8.624 CV     1
 ASSI {  672}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 16   and name HN  ))
      2.700     0.900     0.900 peak   672 spectrum    1 weight  0.10000E+01 volume  0.25254E-02 ppm1      8.450 ppm2      8.223 CV     1
 ASSI {  673}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 12   and name HA  ))
      3.000     3.000     3.000 peak   673 spectrum    1 weight  0.10000E+01 volume  0.20852E-02 ppm1      8.450 ppm2      4.046 CV     1
 ASSI {  675}
   (( segid "    " and resid 15   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      2.200     0.600     0.600 peak   675 spectrum    1 weight  0.10000E+01 volume  0.73148E-02 ppm1      8.450 ppm2      1.983 CV     1
 ASSI {  676}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 14   and name HB% )
      2.700     0.900     0.900 peak   676 spectrum    1 weight  0.10000E+01 volume  0.26702E-02 ppm1      8.449 ppm2      1.637 CV     1
 ASSI {  677}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 15   and name HD1%)
      3.500     1.500     1.500 peak   677 spectrum    1 weight  0.10000E+01 volume  0.25700E-02 ppm1      8.449 ppm2      0.994 CV     1
 OR {  677}
   (( segid "    " and resid 15   and name HN  ))
   (  segid "    " and resid 15   and name HG2%)
 ASSI {  680}
   (( segid "    " and resid 61   and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      2.700     0.900     0.900 peak   680 spectrum    1 weight  0.10000E+01 volume  0.17110E-02 ppm1      8.176 ppm2      4.612 CV     1
 ASSI {  681}
   (( segid "    " and resid 10   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      3.200     1.300     1.300 peak   681 spectrum    1 weight  0.10000E+01 volume  0.10153E-02 ppm1      8.183 ppm2      3.814 CV     1
 ASSI {  684}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      2.500     0.800     0.800 peak   684 spectrum    1 weight  0.10000E+01 volume  0.30489E-02 ppm1      8.045 ppm2      8.781 CV     1
 ASSI {  685}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 82   and name HD% )
      3.600     1.600     1.600 peak   685 spectrum    1 weight  0.10000E+01 volume  0.56268E-03 ppm1      8.043 ppm2      6.455 CV     1
 ASSI {  686}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 82   and name HA  ))
      3.100     1.200     1.200 peak   686 spectrum    1 weight  0.10000E+01 volume  0.10776E-02 ppm1      8.042 ppm2      5.116 CV     1
 ASSI {  689}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 74   and name HB% )
      3.700     1.700     1.700 peak   689 spectrum    1 weight  0.10000E+01 volume  0.73870E-03 ppm1      8.044 ppm2      0.164 CV     1
 ASSI {  691}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      4.600     2.700     1.400 peak   691 spectrum    1 weight  0.10000E+01 volume  0.21450E-03 ppm1      7.628 ppm2      3.545 CV     1
 ASSI {  692}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      3.200     3.200     2.800 peak   692 spectrum    1 weight  0.10000E+01 volume  0.21369E-03 ppm1      7.620 ppm2      2.868 CV     1
 ASSI {  695}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 111  and name HN  ))
      2.400     2.400     3.600 peak   695 spectrum    1 weight  0.10000E+01 volume  0.62209E-02 ppm1      7.619 ppm2      8.880 CV     1
 ASSI {  696}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 130  and name HN  ))
      4.100     2.100     1.900 peak   696 spectrum    1 weight  0.10000E+01 volume  0.93588E-03 ppm1      7.618 ppm2      8.136 CV     1
 ASSI {  700}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 129  and name HA  ))
      2.600     0.900     0.900 peak   700 spectrum    1 weight  0.10000E+01 volume  0.40293E-02 ppm1      7.620 ppm2      4.045 CV     1
 ASSI {  701}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HA  ))
      2.700     0.900     0.900 peak   701 spectrum    1 weight  0.10000E+01 volume  0.33109E-02 ppm1      7.620 ppm2      3.792 CV     1
 ASSI {  702}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HG2 ))
      3.000     3.000     3.000 peak   702 spectrum    1 weight  0.10000E+01 volume  0.35507E-03 ppm1      7.620 ppm2      2.620 CV     1
 ASSI {  703}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 128  and name HG1 ))
      2.800     2.800     3.200 peak   703 spectrum    1 weight  0.10000E+01 volume  0.52312E-03 ppm1      7.618 ppm2      2.469 CV     1
 ASSI {  705}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 113  and name HG12))
      3.900     1.900     1.900 peak   705 spectrum    1 weight  0.10000E+01 volume  0.10892E-02 ppm1      7.620 ppm2      1.321 CV     1
 OR {  705}
   (( segid "    " and resid 129  and name HN  ))
   (( segid "    " and resid 113  and name HG11))
 ASSI {  706}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 129  and name HB% )
      2.700     0.900     0.900 peak   706 spectrum    1 weight  0.10000E+01 volume  0.54037E-02 ppm1      7.621 ppm2      1.120 CV     1
 ASSI {  707}
   (( segid "    " and resid 129  and name HN  ))
   (  segid "    " and resid 113  and name HD1%)
      2.800     1.000     1.000 peak   707 spectrum    1 weight  0.10000E+01 volume  0.27670E-02 ppm1      7.618 ppm2      0.617 CV     1
 ASSI {  709}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 41   and name HN  ))
      2.400     0.700     0.700 peak   709 spectrum    1 weight  0.10000E+01 volume  0.42029E-02 ppm1      7.566 ppm2      8.616 CV     1
 ASSI {  711}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      2.300     0.700     0.700 peak   711 spectrum    1 weight  0.10000E+01 volume  0.47887E-02 ppm1      7.567 ppm2      7.000 CV     1
 ASSI {  712}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      4.200     2.200     1.800 peak   712 spectrum    1 weight  0.10000E+01 volume  0.25604E-03 ppm1      7.570 ppm2      4.715 CV     1
 ASSI {  715}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.500     2.500     3.500 peak   715 spectrum    1 weight  0.10000E+01 volume  0.88919E-03 ppm1      7.568 ppm2      3.860 CV     1
 OR {  715}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
 ASSI {  716}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HB  ))
      2.300     0.600     0.600 peak   716 spectrum    1 weight  0.10000E+01 volume  0.70172E-02 ppm1      7.570 ppm2      2.223 CV     1
 ASSI {  717}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HG11))
      2.100     0.600     0.600 peak   717 spectrum    1 weight  0.10000E+01 volume  0.68573E-02 ppm1      7.569 ppm2      1.691 CV     1
 OR {  717}
   (( segid "    " and resid 42   and name HN  ))
   (( segid "    " and resid 42   and name HG12))
 ASSI {  718}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 41   and name HG2%)
      3.800     1.800     1.800 peak   718 spectrum    1 weight  0.10000E+01 volume  0.84989E-03 ppm1      7.568 ppm2      1.304 CV     1
 ASSI {  719}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HD1%)
      3.200     1.300     1.300 peak   719 spectrum    1 weight  0.10000E+01 volume  0.44341E-02 ppm1      7.568 ppm2      0.957 CV     1
 ASSI {  720}
   (( segid "    " and resid 42   and name HN  ))
   (  segid "    " and resid 42   and name HG2%)
      4.300     2.400     1.700 peak   720 spectrum    1 weight  0.10000E+01 volume  0.12420E-02 ppm1      7.568 ppm2      0.796 CV     1
 ASSI {  721}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HD21))
      5.000     3.200     1.000 peak   721 spectrum    1 weight  0.10000E+01 volume  0.41771E-03 ppm1      8.552 ppm2      7.231 CV     1
 ASSI {  722}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
      2.800     1.000     1.000 peak   722 spectrum    1 weight  0.10000E+01 volume  0.28609E-02 ppm1      8.553 ppm2      7.025 CV     1
 ASSI {  723}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
      3.400     1.400     1.400 peak   723 spectrum    1 weight  0.10000E+01 volume  0.10651E-02 ppm1      8.554 ppm2      5.506 CV     1
 ASSI {  725}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      3.300     1.300     1.300 peak   725 spectrum    1 weight  0.10000E+01 volume  0.95444E-03 ppm1      8.554 ppm2      4.557 CV     1
 ASSI {  726}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      2.400     0.700     0.700 peak   726 spectrum    1 weight  0.10000E+01 volume  0.52690E-02 ppm1      8.340 ppm2      8.060 CV     1
 ASSI {  727}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      4.000     2.000     2.000 peak   727 spectrum    1 weight  0.10000E+01 volume  0.13900E-02 ppm1      8.344 ppm2      5.026 CV     1
 ASSI {  732}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      3.800     1.800     1.800 peak   732 spectrum    1 weight  0.10000E+01 volume  0.13528E-02 ppm1      8.340 ppm2      7.651 CV     1
 ASSI {  734}
   (( segid "    " and resid 57   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.800     1.800     1.800 peak   734 spectrum    1 weight  0.10000E+01 volume  0.52599E-03 ppm1      8.344 ppm2      2.465 CV     1
 ASSI {  735}
   (( segid "    " and resid 57   and name HN  ))
   (  segid "    " and resid 57   and name HG2%)
      4.100     2.100     1.900 peak   735 spectrum    1 weight  0.10000E+01 volume  0.14897E-02 ppm1      8.344 ppm2      1.175 CV     1
 ASSI {  737}
   (( segid "    " and resid 118  and name HN  ))
   (  segid "    " and resid 156  and name HE% )
      4.000     2.000     2.000 peak   737 spectrum    1 weight  0.10000E+01 volume  0.35435E-03 ppm1      8.071 ppm2      7.614 CV     1
 ASSI {  740}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 99   and name HN  ))
      3.700     1.700     1.700 peak   740 spectrum    1 weight  0.10000E+01 volume  0.98412E-03 ppm1      8.058 ppm2      6.816 CV     1
 ASSI {  742}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      4.500     2.500     1.500 peak   742 spectrum    1 weight  0.10000E+01 volume  0.26706E-03 ppm1      8.056 ppm2      3.458 CV     1
 ASSI {  743}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.900     2.900     3.100 peak   743 spectrum    1 weight  0.10000E+01 volume  0.39586E-03 ppm1      8.056 ppm2      2.157 CV     1
 ASSI {  744}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      2.300     0.700     0.700 peak   744 spectrum    1 weight  0.10000E+01 volume  0.61518E-02 ppm1      8.056 ppm2      1.796 CV     1
 OR {  744}
   (( segid "    " and resid 97   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI {  746}
   (( segid "    " and resid 97   and name HN  ))
   (  segid "    " and resid 93   and name HB% )
      3.700     3.700     2.300 peak   746 spectrum    1 weight  0.10000E+01 volume  0.11795E-02 ppm1      8.060 ppm2      0.570 CV     1
 ASSI {  747}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 83   and name HN  ))
      4.800     2.900     1.200 peak   747 spectrum    1 weight  0.10000E+01 volume  0.27445E-03 ppm1      8.045 ppm2      8.992 CV     1
 ASSI {  748}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
      5.400     3.700     0.600 peak   748 spectrum    1 weight  0.10000E+01 volume  0.35914E-03 ppm1      8.043 ppm2      6.163 CV     1
 ASSI {  749}
   (( segid "    " and resid 82   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      4.600     2.700     1.400 peak   749 spectrum    1 weight  0.10000E+01 volume  0.55887E-03 ppm1      8.043 ppm2      4.862 CV     1
 ASSI {  760}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      2.700     0.900     0.900 peak   760 spectrum    1 weight  0.10000E+01 volume  0.28690E-02 ppm1      8.544 ppm2      8.816 CV     1
 ASSI {  761}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      2.500     0.800     0.800 peak   761 spectrum    1 weight  0.10000E+01 volume  0.30878E-02 ppm1      8.544 ppm2      8.198 CV     1
 ASSI {  762}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      3.200     1.300     1.300 peak   762 spectrum    1 weight  0.10000E+01 volume  0.16041E-02 ppm1      8.542 ppm2      4.234 CV     1
 ASSI {  763}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak   763 spectrum    1 weight  0.10000E+01 volume  0.31273E-02 ppm1      8.543 ppm2      4.086 CV     1
 ASSI {  764}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      3.500     1.500     1.500 peak   764 spectrum    1 weight  0.10000E+01 volume  0.89601E-03 ppm1      8.545 ppm2      3.398 CV     1
 ASSI {  765}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.300     0.700     0.700 peak   765 spectrum    1 weight  0.10000E+01 volume  0.68840E-02 ppm1      8.543 ppm2      2.211 CV     1
 OR {  765}
   (( segid "    " and resid 19   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI {  770}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      2.600     0.800     0.800 peak   770 spectrum    1 weight  0.10000E+01 volume  0.31440E-02 ppm1      8.364 ppm2      8.623 CV     1
 ASSI {  771}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      2.800     0.900     0.900 peak   771 spectrum    1 weight  0.10000E+01 volume  0.25378E-02 ppm1      8.361 ppm2      3.496 CV     1
 ASSI {  773}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      2.600     2.600     3.400 peak   773 spectrum    1 weight  0.10000E+01 volume  0.45842E-02 ppm1      8.365 ppm2      1.478 CV     1
 ASSI {  774}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 28   and name HD2%)
      3.900     1.900     1.900 peak   774 spectrum    1 weight  0.10000E+01 volume  0.17546E-02 ppm1      8.365 ppm2      0.818 CV     1
 OR {  774}
   (( segid "    " and resid 25   and name HN  ))
   (  segid "    " and resid 28   and name HD1%)
 ASSI {  778}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 139  and name HN  ))
      2.600     0.800     0.800 peak   778 spectrum    1 weight  0.10000E+01 volume  0.35275E-02 ppm1      8.288 ppm2      7.551 CV     1
 ASSI {  781}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      3.200     1.300     1.300 peak   781 spectrum    1 weight  0.10000E+01 volume  0.19028E-02 ppm1      8.288 ppm2      3.972 CV     1
 ASSI {  782}
   (( segid "    " and resid 138  and name HN  ))
   (( segid "    " and resid 137  and name HB2 ))
      2.900     1.100     1.100 peak   782 spectrum    1 weight  0.10000E+01 volume  0.14290E-02 ppm1      8.288 ppm2      2.400 CV     1
 ASSI {  789}
   (( segid "    " and resid 18   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      4.600     2.600     1.400 peak   789 spectrum    1 weight  0.10000E+01 volume  0.29423E-03 ppm1      8.225 ppm2      4.243 CV     1
 ASSI {  796}
   (( segid "    " and resid 18   and name HN  ))
   (  segid "    " and resid 14   and name HB% )
      3.200     3.200     2.800 peak   796 spectrum    1 weight  0.10000E+01 volume  0.24205E-03 ppm1      8.231 ppm2      1.665 CV     1
 ASSI {  805}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      2.500     0.800     0.800 peak   805 spectrum    1 weight  0.10000E+01 volume  0.42293E-02 ppm1      8.060 ppm2      7.140 CV     1
 ASSI {  806}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      3.000     1.100     1.100 peak   806 spectrum    1 weight  0.10000E+01 volume  0.21923E-02 ppm1      8.071 ppm2      4.938 CV     1
 ASSI {  808}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 118  and name HB1 ))
      2.700     0.900     0.900 peak   808 spectrum    1 weight  0.10000E+01 volume  0.50075E-02 ppm1      8.066 ppm2      2.647 CV     1
 ASSI {  809}
   (( segid "    " and resid 118  and name HN  ))
   (( segid "    " and resid 116  and name HB2 ))
      4.900     3.000     1.100 peak   809 spectrum    1 weight  0.10000E+01 volume  0.31886E-03 ppm1      8.064 ppm2      1.170 CV     1
 ASSI {  811}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 95   and name HN  ))
      4.900     3.000     1.100 peak   811 spectrum    1 weight  0.10000E+01 volume  0.22015E-03 ppm1      8.012 ppm2      8.614 CV     1
 ASSI {  814}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.600     1.700     1.700 peak   814 spectrum    1 weight  0.10000E+01 volume  0.77719E-03 ppm1      8.009 ppm2      3.641 CV     1
 ASSI {  815}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      4.400     2.400     1.600 peak   815 spectrum    1 weight  0.10000E+01 volume  0.34421E-03 ppm1      8.010 ppm2      3.099 CV     1
 ASSI {  816}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      3.800     1.900     1.900 peak   816 spectrum    1 weight  0.10000E+01 volume  0.45913E-03 ppm1      8.012 ppm2      2.878 CV     1
 ASSI {  817}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HG1 ))
      2.600     2.600     3.400 peak   817 spectrum    1 weight  0.10000E+01 volume  0.10523E-01 ppm1      8.010 ppm2      1.424 CV     1
 ASSI {  825}
   (( segid "    " and resid 35   and name HN  ))
   (  segid "    " and resid 35   and name HE% )
      4.500     2.600     1.500 peak   825 spectrum    1 weight  0.10000E+01 volume  0.37191E-03 ppm1      8.860 ppm2      6.827 CV     1
 ASSI {  830}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB1 ))
      3.100     1.200     1.200 peak   830 spectrum    1 weight  0.10000E+01 volume  0.45220E-02 ppm1      8.861 ppm2      4.001 CV     1
 OR {  830}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 34   and name HB2 ))
 ASSI {  831}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 29   and name HB2 ))
      5.100     3.300     0.900 peak   831 spectrum    1 weight  0.10000E+01 volume  0.17064E-03 ppm1      8.864 ppm2      2.872 CV     1
 ASSI {  832}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      3.200     1.300     1.300 peak   832 spectrum    1 weight  0.10000E+01 volume  0.13122E-02 ppm1      8.864 ppm2      2.673 CV     1
 ASSI {  833}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
      3.500     1.600     1.600 peak   833 spectrum    1 weight  0.10000E+01 volume  0.19588E-02 ppm1      8.860 ppm2      2.406 CV     1
 ASSI {  834}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.700     1.700     1.700 peak   834 spectrum    1 weight  0.10000E+01 volume  0.47033E-03 ppm1      8.863 ppm2      2.192 CV     1
 OR {  834}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
 OR {  834}
   (( segid "    " and resid 35   and name HN  ))
   (( segid "    " and resid 32   and name HG1 ))
 ASSI {  836}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HA2 ))
      5.400     3.700     0.600 peak   836 spectrum    1 weight  0.10000E+01 volume  0.23865E-03 ppm1      8.631 ppm2      4.745 CV     1
 ASSI {  837}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 76   and name HN  ))
      2.800     1.000     1.000 peak   837 spectrum    1 weight  0.10000E+01 volume  0.27273E-02 ppm1      8.521 ppm2      7.823 CV     1
 ASSI {  840}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HD22))
      5.000     3.100     1.000 peak   840 spectrum    1 weight  0.10000E+01 volume  0.52899E-03 ppm1      8.520 ppm2      6.722 CV     1
 ASSI {  841}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      3.800     1.800     1.800 peak   841 spectrum    1 weight  0.10000E+01 volume  0.48640E-03 ppm1      8.520 ppm2      4.973 CV     1
 ASSI {  843}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      2.900     1.100     1.100 peak   843 spectrum    1 weight  0.10000E+01 volume  0.22049E-02 ppm1      8.520 ppm2      4.624 CV     1
 ASSI {  844}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      2.300     0.700     0.700 peak   844 spectrum    1 weight  0.10000E+01 volume  0.73944E-02 ppm1      8.521 ppm2      3.811 CV     1
 ASSI {  846}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB2 ))
      2.500     0.800     0.800 peak   846 spectrum    1 weight  0.10000E+01 volume  0.57354E-02 ppm1      8.521 ppm2      2.750 CV     1
 OR {  846}
   (( segid "    " and resid 75   and name HN  ))
   (( segid "    " and resid 75   and name HB1 ))
 ASSI {  847}
   (( segid "    " and resid 75   and name HN  ))
   (  segid "    " and resid 74   and name HB% )
      2.600     2.600     3.400 peak   847 spectrum    1 weight  0.10000E+01 volume  0.30904E-02 ppm1      8.520 ppm2      0.108 CV     1
 ASSI {  848}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      2.600     0.800     0.800 peak   848 spectrum    1 weight  0.10000E+01 volume  0.44541E-02 ppm1      8.338 ppm2      7.900 CV     1
 ASSI {  849}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 142  and name HN  ))
      4.400     2.400     1.600 peak   849 spectrum    1 weight  0.10000E+01 volume  0.60817E-03 ppm1      8.337 ppm2      7.213 CV     1
 ASSI {  851}
   (( segid "    " and resid 144  and name HN  ))
   (( segid "    " and resid 140  and name HA  ))
      3.400     1.500     1.500 peak   851 spectrum    1 weight  0.10000E+01 volume  0.99486E-03 ppm1      8.337 ppm2      3.713 CV     1
 ASSI {  855}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      4.800     2.800     1.200 peak   855 spectrum    1 weight  0.10000E+01 volume  0.18710E-03 ppm1      8.137 ppm2      9.016 CV     1
 ASSI {  857}
   (( segid "    " and resid 130  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      5.300     3.600     0.700 peak   857 spectrum    1 weight  0.10000E+01 volume  0.28023E-03 ppm1      8.139 ppm2      6.786 CV     1
 ASSI {  859}
   (( segid "    " and resid 130  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      3.100     1.200     1.200 peak   859 spectrum    1 weight  0.10000E+01 volume  0.11281E-02 ppm1      8.138 ppm2      4.894 CV     1
 ASSI {  864}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 143  and name HN  ))
      5.000     3.100     1.000 peak   864 spectrum    1 weight  0.10000E+01 volume  0.16735E-03 ppm1      8.080 ppm2      7.896 CV     1
 ASSI {  865}
   (( segid "    " and resid 141  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      2.500     0.800     0.800 peak   865 spectrum    1 weight  0.10000E+01 volume  0.39113E-02 ppm1      8.059 ppm2      8.784 CV     1
 ASSI {  866}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HB1 ))
      1.800     0.400     0.400 peak   866 spectrum    1 weight  0.10000E+01 volume  0.14487E-01 ppm1      8.054 ppm2      1.435 CV     1
 ASSI {  870}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      4.300     2.300     1.700 peak   870 spectrum    1 weight  0.10000E+01 volume  0.28469E-03 ppm1      8.611 ppm2      8.787 CV     1
 ASSI {  872}
   (( segid "    " and resid 136  and name HN  ))
   (  segid "    " and resid 135  and name HD1%)
      3.400     1.400     1.400 peak   872 spectrum    1 weight  0.10000E+01 volume  0.26470E-02 ppm1      8.613 ppm2      0.833 CV     1
 ASSI {  874}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 135  and name HA  ))
      2.400     0.700     0.700 peak   874 spectrum    1 weight  0.10000E+01 volume  0.50158E-02 ppm1      8.611 ppm2      3.655 CV     1
 ASSI {  875}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 137  and name HD1 ))
      3.400     1.500     1.500 peak   875 spectrum    1 weight  0.10000E+01 volume  0.16922E-02 ppm1      8.611 ppm2      2.281 CV     1
 OR {  875}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 137  and name HD2 ))
 ASSI {  878}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HD21))
      3.300     1.400     1.400 peak   878 spectrum    1 weight  0.10000E+01 volume  0.48884E-03 ppm1      8.369 ppm2      7.484 CV     1
 ASSI {  879}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      4.900     3.000     1.100 peak   879 spectrum    1 weight  0.10000E+01 volume  0.27618E-03 ppm1      8.055 ppm2      7.210 CV     1
 ASSI {  881}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HN  ))
      2.700     0.900     0.900 peak   881 spectrum    1 weight  0.10000E+01 volume  0.41849E-02 ppm1      8.056 ppm2      8.923 CV     1
 ASSI {  882}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      3.300     1.400     1.400 peak   882 spectrum    1 weight  0.10000E+01 volume  0.95095E-03 ppm1      8.048 ppm2      4.883 CV     1
 ASSI {  883}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.900     1.000     1.000 peak   883 spectrum    1 weight  0.10000E+01 volume  0.25486E-02 ppm1      8.057 ppm2      4.685 CV     1
 ASSI {  884}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 31   and name HA2 ))
      2.800     1.000     1.000 peak   884 spectrum    1 weight  0.10000E+01 volume  0.36366E-02 ppm1      8.057 ppm2      4.091 CV     1
 ASSI {  885}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 29   and name HB2 ))
      4.000     2.000     2.000 peak   885 spectrum    1 weight  0.10000E+01 volume  0.99592E-03 ppm1      8.048 ppm2      2.880 CV     1
 ASSI {  886}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      3.300     1.400     1.400 peak   886 spectrum    1 weight  0.10000E+01 volume  0.23121E-02 ppm1      8.059 ppm2      2.515 CV     1
 ASSI {  887}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HG1 ))
      2.500     0.800     0.800 peak   887 spectrum    1 weight  0.10000E+01 volume  0.62507E-02 ppm1      8.059 ppm2      2.216 CV     1
 OR {  887}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
 OR {  887}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
 ASSI {  888}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 42   and name HN  ))
      3.900     1.900     1.900 peak   888 spectrum    1 weight  0.10000E+01 volume  0.81394E-03 ppm1      8.049 ppm2      7.551 CV     1
 ASSI {  890}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      2.400     0.700     0.700 peak   890 spectrum    1 weight  0.10000E+01 volume  0.42381E-02 ppm1      8.041 ppm2      7.010 CV     1
 ASSI {  893}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB1 ))
      3.600     1.700     1.700 peak   893 spectrum    1 weight  0.10000E+01 volume  0.41253E-03 ppm1      8.049 ppm2      2.874 CV     1
 ASSI {  894}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      2.800     1.000     1.000 peak   894 spectrum    1 weight  0.10000E+01 volume  0.44822E-02 ppm1      8.038 ppm2      1.905 CV     1
 ASSI {  895}
   (( segid "    " and resid 44   and name HN  ))
   (( segid "    " and resid 44   and name HG  ))
      2.200     0.600     0.600 peak   895 spectrum    1 weight  0.10000E+01 volume  0.46022E-02 ppm1      8.038 ppm2      1.618 CV     1
 ASSI {  896}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 44   and name HD1%)
      3.300     1.400     1.400 peak   896 spectrum    1 weight  0.10000E+01 volume  0.42043E-02 ppm1      8.041 ppm2      0.778 CV     1
 OR {  896}
   (( segid "    " and resid 44   and name HN  ))
   (  segid "    " and resid 44   and name HD2%)
 ASSI {  897}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
      3.800     1.800     1.800 peak   897 spectrum    1 weight  0.10000E+01 volume  0.75491E-03 ppm1      4.839 ppm2     -0.157 CV     1
 ASSI {  899}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 136  and name HN  ))
      3.800     1.800     1.800 peak   899 spectrum    1 weight  0.10000E+01 volume  0.69762E-03 ppm1      7.554 ppm2      8.609 CV     1
 ASSI {  901}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      3.800     3.800     2.200 peak   901 spectrum    1 weight  0.10000E+01 volume  0.44444E-03 ppm1      7.554 ppm2      4.762 CV     1
 ASSI {  903}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 138  and name HA  ))
      3.500     1.600     1.600 peak   903 spectrum    1 weight  0.10000E+01 volume  0.10766E-02 ppm1      7.554 ppm2      4.122 CV     1
 ASSI {  904}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HA  ))
      2.900     1.000     1.000 peak   904 spectrum    1 weight  0.10000E+01 volume  0.26840E-02 ppm1      7.554 ppm2      3.988 CV     1
 ASSI {  906}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB2 ))
      2.500     0.800     0.800 peak   906 spectrum    1 weight  0.10000E+01 volume  0.42450E-02 ppm1      7.554 ppm2      2.384 CV     1
 ASSI {  907}
   (( segid "    " and resid 139  and name HN  ))
   (( segid "    " and resid 139  and name HB1 ))
      2.900     1.000     1.000 peak   907 spectrum    1 weight  0.10000E+01 volume  0.20572E-02 ppm1      7.554 ppm2      1.863 CV     1
 ASSI {  908}
   (( segid "    " and resid 139  and name HN  ))
   (  segid "    " and resid 138  and name HB% )
      2.600     2.600     3.400 peak   908 spectrum    1 weight  0.10000E+01 volume  0.48228E-02 ppm1      7.554 ppm2      1.389 CV     1
 ASSI {  917}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 153  and name HA  ))
      2.100     0.500     0.500 peak   917 spectrum    1 weight  0.10000E+01 volume  0.70722E-02 ppm1      9.461 ppm2      5.191 CV     1
 ASSI {  918}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      4.700     2.700     1.300 peak   918 spectrum    1 weight  0.10000E+01 volume  0.71928E-03 ppm1      9.459 ppm2      4.963 CV     1
 ASSI {  919}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      5.100     3.300     0.900 peak   919 spectrum    1 weight  0.10000E+01 volume  0.23384E-03 ppm1      9.462 ppm2      4.769 CV     1
 ASSI {  920}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 154  and name HB  ))
      4.000     2.000     2.000 peak   920 spectrum    1 weight  0.10000E+01 volume  0.45194E-03 ppm1      9.460 ppm2      4.574 CV     1
 ASSI {  921}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      3.700     1.700     1.700 peak   921 spectrum    1 weight  0.10000E+01 volume  0.48803E-03 ppm1      9.461 ppm2      4.433 CV     1
 ASSI {  922}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      4.100     2.100     1.900 peak   922 spectrum    1 weight  0.10000E+01 volume  0.11468E-02 ppm1      9.460 ppm2      3.842 CV     1
 ASSI {  924}
   (( segid "    " and resid 154  and name HN  ))
   (( segid "    " and resid 153  and name HB  ))
      4.100     2.100     1.900 peak   924 spectrum    1 weight  0.10000E+01 volume  0.94711E-03 ppm1      9.460 ppm2      2.468 CV     1
 ASSI {  926}
   (( segid "    " and resid 154  and name HN  ))
   (  segid "    " and resid 154  and name HG2%)
      2.700     0.900     0.900 peak   926 spectrum    1 weight  0.10000E+01 volume  0.28423E-02 ppm1      9.459 ppm2      1.188 CV     1
 ASSI {  927}
   (( segid "    " and resid 154  and name HN  ))
   (  segid "    " and resid 153  and name HG2%)
      3.400     1.400     1.400 peak   927 spectrum    1 weight  0.10000E+01 volume  0.34756E-02 ppm1      9.459 ppm2      1.108 CV     1
 OR {  927}
   (( segid "    " and resid 154  and name HN  ))
   (  segid "    " and resid 153  and name HG1%)
 ASSI {  929}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      4.100     4.100     1.900 peak   929 spectrum    1 weight  0.10000E+01 volume  0.27930E-03 ppm1      9.142 ppm2      8.975 CV     1
 ASSI {  930}
   (( segid "    " and resid 132  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      4.800     2.900     1.200 peak   930 spectrum    1 weight  0.10000E+01 volume  0.31434E-03 ppm1      9.149 ppm2      6.780 CV     1
 ASSI {  931}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      3.900     1.900     1.900 peak   931 spectrum    1 weight  0.10000E+01 volume  0.47288E-03 ppm1      9.143 ppm2      5.027 CV     1
 ASSI {  932}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HA  ))
      2.200     0.600     0.600 peak   932 spectrum    1 weight  0.10000E+01 volume  0.53707E-02 ppm1      9.142 ppm2      4.577 CV     1
 ASSI {  933}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 132  and name HB1 ))
      2.700     0.900     0.900 peak   933 spectrum    1 weight  0.10000E+01 volume  0.19832E-02 ppm1      9.142 ppm2      3.829 CV     1
 ASSI {  934}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.300     1.400     1.400 peak   934 spectrum    1 weight  0.10000E+01 volume  0.52077E-03 ppm1      9.140 ppm2      2.121 CV     1
 ASSI {  937}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HA2 ))
      4.500     2.600     1.500 peak   937 spectrum    1 weight  0.10000E+01 volume  0.84820E-03 ppm1      8.617 ppm2      3.989 CV     1
 OR {  937}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HA1 ))
 ASSI {  938}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HN  ))
      2.700     0.900     0.900 peak   938 spectrum    1 weight  0.10000E+01 volume  0.18330E-02 ppm1      8.566 ppm2      9.125 CV     1
 ASSI {  939}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 114  and name HN  ))
      5.200     3.300     0.800 peak   939 spectrum    1 weight  0.10000E+01 volume  0.31998E-03 ppm1      8.566 ppm2      8.263 CV     1
 ASSI {  941}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      3.700     1.700     1.700 peak   941 spectrum    1 weight  0.10000E+01 volume  0.79891E-03 ppm1      8.568 ppm2      4.780 CV     1
 ASSI {  942}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      2.800     1.000     1.000 peak   942 spectrum    1 weight  0.10000E+01 volume  0.24986E-02 ppm1      8.564 ppm2      4.269 CV     1
 ASSI {  943}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HA  ))
      2.900     1.100     1.100 peak   943 spectrum    1 weight  0.10000E+01 volume  0.17316E-02 ppm1      8.566 ppm2      3.702 CV     1
 ASSI {  944}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      4.400     2.500     1.600 peak   944 spectrum    1 weight  0.10000E+01 volume  0.41920E-03 ppm1      8.567 ppm2      3.017 CV     1
 ASSI {  946}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
      2.300     0.600     0.600 peak   946 spectrum    1 weight  0.10000E+01 volume  0.52372E-02 ppm1      8.567 ppm2      1.529 CV     1
 ASSI {  947}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG12))
      3.500     1.500     1.500 peak   947 spectrum    1 weight  0.10000E+01 volume  0.22831E-02 ppm1      8.566 ppm2      1.290 CV     1
 OR {  947}
   (( segid "    " and resid 113  and name HN  ))
   (( segid "    " and resid 113  and name HG11))
 ASSI {  948}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 153  and name HG1%)
      5.400     3.700     0.600 peak   948 spectrum    1 weight  0.10000E+01 volume  0.26531E-03 ppm1      8.567 ppm2      1.119 CV     1
 OR {  948}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 153  and name HG2%)
 ASSI {  949}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 111  and name HG2%)
      4.800     2.900     1.200 peak   949 spectrum    1 weight  0.10000E+01 volume  0.30721E-03 ppm1      8.566 ppm2      0.961 CV     1
 ASSI {  950}
   (( segid "    " and resid 113  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      3.500     1.600     1.600 peak   950 spectrum    1 weight  0.10000E+01 volume  0.28764E-02 ppm1      8.566 ppm2      0.585 CV     1
 ASSI {  952}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HN  ))
      2.600     0.900     0.900 peak   952 spectrum    1 weight  0.10000E+01 volume  0.27709E-02 ppm1      8.374 ppm2      8.163 CV     1
 ASSI {  954}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.000     1.100     1.100 peak   954 spectrum    1 weight  0.10000E+01 volume  0.17906E-02 ppm1      8.372 ppm2      4.601 CV     1
 ASSI {  956}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      3.500     1.600     1.600 peak   956 spectrum    1 weight  0.10000E+01 volume  0.68038E-03 ppm1      8.370 ppm2      3.804 CV     1
 ASSI {  957}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
      2.800     1.000     1.000 peak   957 spectrum    1 weight  0.10000E+01 volume  0.34481E-02 ppm1      8.366 ppm2      2.821 CV     1
 OR {  957}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI {  959}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.800     1.000     1.000 peak   959 spectrum    1 weight  0.10000E+01 volume  0.24060E-02 ppm1      8.366 ppm2      2.152 CV     1
 OR {  959}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 12   and name HB1 ))
 ASSI {  961}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      2.700     2.700     3.300 peak   961 spectrum    1 weight  0.10000E+01 volume  0.69459E-03 ppm1      8.371 ppm2      1.657 CV     1
 ASSI {  962}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 90   and name HB2 ))
      3.900     1.900     1.900 peak   962 spectrum    1 weight  0.10000E+01 volume  0.12004E-02 ppm1      8.043 ppm2      3.068 CV     1
 ASSI {  965}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 125  and name HN  ))
      5.000     3.100     1.000 peak   965 spectrum    1 weight  0.10000E+01 volume  0.30348E-03 ppm1      9.149 ppm2      8.113 CV     1
 ASSI {  966}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HN  ))
      4.500     2.500     1.500 peak   966 spectrum    1 weight  0.10000E+01 volume  0.34209E-03 ppm1      9.142 ppm2      9.650 CV     1
 ASSI {  967}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 133  and name HN  ))
      2.700     0.900     0.900 peak   967 spectrum    1 weight  0.10000E+01 volume  0.22237E-02 ppm1      9.142 ppm2      7.359 CV     1
 ASSI {  969}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
      4.200     2.200     1.800 peak   969 spectrum    1 weight  0.10000E+01 volume  0.64231E-03 ppm1      9.141 ppm2      2.837 CV     1
 ASSI {  970}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      3.300     1.400     1.400 peak   970 spectrum    1 weight  0.10000E+01 volume  0.65291E-03 ppm1      9.142 ppm2      2.500 CV     1
 ASSI {  971}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.800     1.800     1.800 peak   971 spectrum    1 weight  0.10000E+01 volume  0.18913E-02 ppm1      9.141 ppm2      1.638 CV     1
 ASSI {  972}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HG2 ))
      3.400     1.400     1.400 peak   972 spectrum    1 weight  0.10000E+01 volume  0.14567E-02 ppm1      9.142 ppm2      1.484 CV     1
 OR {  972}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HG1 ))
 ASSI {  973}
   (( segid "    " and resid 132  and name HN  ))
   (( segid "    " and resid 131  and name HD2 ))
      4.900     3.100     1.100 peak   973 spectrum    1 weight  0.10000E+01 volume  0.28632E-03 ppm1      9.142 ppm2      1.262 CV     1
 ASSI {  976}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 27   and name HN  ))
      2.600     0.800     0.800 peak   976 spectrum    1 weight  0.10000E+01 volume  0.31597E-02 ppm1      8.617 ppm2      7.867 CV     1
 ASSI {  977}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HD21))
      4.600     2.600     1.400 peak   977 spectrum    1 weight  0.10000E+01 volume  0.46266E-03 ppm1      8.617 ppm2      7.721 CV     1
 ASSI {  978}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 35   and name HE% )
      5.100     3.200     0.900 peak   978 spectrum    1 weight  0.10000E+01 volume  0.22751E-03 ppm1      8.611 ppm2      6.879 CV     1
 ASSI {  979}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HD22))
      5.700     4.000     0.300 peak   979 spectrum    1 weight  0.10000E+01 volume  0.27688E-03 ppm1      8.614 ppm2      6.699 CV     1
 ASSI {  980}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      2.800     1.000     1.000 peak   980 spectrum    1 weight  0.10000E+01 volume  0.25176E-02 ppm1      8.617 ppm2      4.648 CV     1
 ASSI {  983}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      3.400     1.500     1.500 peak   983 spectrum    1 weight  0.10000E+01 volume  0.92820E-03 ppm1      8.617 ppm2      3.491 CV     1
 ASSI {  984}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
      2.400     0.700     0.700 peak   984 spectrum    1 weight  0.10000E+01 volume  0.49941E-02 ppm1      8.617 ppm2      3.131 CV     1
 ASSI {  986}
   (( segid "    " and resid 26   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
      3.200     1.300     1.300 peak   986 spectrum    1 weight  0.10000E+01 volume  0.33576E-02 ppm1      8.621 ppm2      1.777 CV     1
 ASSI {  987}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      2.700     2.700     3.300 peak   987 spectrum    1 weight  0.10000E+01 volume  0.65746E-03 ppm1      8.621 ppm2      1.412 CV     1
 ASSI {  988}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
      3.400     1.400     1.400 peak   988 spectrum    1 weight  0.10000E+01 volume  0.76107E-03 ppm1      8.622 ppm2      0.566 CV     1
 ASSI {  989}
   (( segid "    " and resid 26   and name HN  ))
   (  segid "    " and resid 25   and name HD1%)
      4.000     2.000     2.000 peak   989 spectrum    1 weight  0.10000E+01 volume  0.16501E-02 ppm1      8.621 ppm2      0.151 CV     1
 ASSI {  992}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 112  and name HD21))
      4.200     2.300     1.800 peak   992 spectrum    1 weight  0.10000E+01 volume  0.37764E-03 ppm1      8.444 ppm2      7.577 CV     1
 ASSI {  995}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HN  ))
      4.600     2.700     1.400 peak   995 spectrum    1 weight  0.10000E+01 volume  0.42003E-03 ppm1      7.831 ppm2      7.344 CV     1
 ASSI {  996}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 135  and name HN  ))
      3.700     1.700     1.700 peak   996 spectrum    1 weight  0.10000E+01 volume  0.57987E-03 ppm1      7.829 ppm2      8.646 CV     1
 ASSI {  998}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 101  and name HD22))
      3.700     1.700     1.700 peak   998 spectrum    1 weight  0.10000E+01 volume  0.97956E-03 ppm1      7.825 ppm2      6.868 CV     1
 ASSI {  999}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 133  and name HA  ))
      2.400     0.700     0.700 peak   999 spectrum    1 weight  0.10000E+01 volume  0.53338E-02 ppm1      7.826 ppm2      4.659 CV     1
 ASSI { 1002}
   (( segid "    " and resid 134  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.800     2.900     1.200 peak  1002 spectrum    1 weight  0.10000E+01 volume  0.19024E-03 ppm1      7.828 ppm2      3.079 CV     1
 ASSI { 1003}
   (( segid "    " and resid 134  and name HN  ))
   (  segid "    " and resid 133  and name HG2%)
      3.500     1.600     1.600 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.32098E-02 ppm1      7.826 ppm2      1.234 CV     1
 ASSI { 1004}
   (( segid "    " and resid 134  and name HN  ))
   (  segid "    " and resid 134  and name HB% )
      2.300     2.300     3.700 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.10603E-01 ppm1      7.828 ppm2      1.064 CV     1
 ASSI { 1007}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 151  and name HB1 ))
      4.100     2.100     1.900 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.52530E-03 ppm1      7.672 ppm2      2.707 CV     1
 OR { 1007}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 151  and name HB2 ))
 ASSI { 1010}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HA  ))
      3.300     1.400     1.400 peak  1010 spectrum    1 weight  0.10000E+01 volume  0.90887E-03 ppm1      7.466 ppm2      4.938 CV     1
 ASSI { 1011}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HA  ))
      2.800     1.000     1.000 peak  1011 spectrum    1 weight  0.10000E+01 volume  0.17863E-02 ppm1      7.466 ppm2      4.403 CV     1
 ASSI { 1012}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.500     1.600     1.600 peak  1012 spectrum    1 weight  0.10000E+01 volume  0.11134E-02 ppm1      7.467 ppm2      4.139 CV     1
 ASSI { 1013}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      4.000     2.000     2.000 peak  1013 spectrum    1 weight  0.10000E+01 volume  0.38486E-03 ppm1      7.465 ppm2      3.831 CV     1
 ASSI { 1014}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HE2 ))
      5.000     3.100     1.000 peak  1014 spectrum    1 weight  0.10000E+01 volume  0.30646E-03 ppm1      7.468 ppm2      3.157 CV     1
 OR { 1014}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HE1 ))
 ASSI { 1016}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      4.200     2.200     1.800 peak  1016 spectrum    1 weight  0.10000E+01 volume  0.68911E-03 ppm1      7.466 ppm2      2.423 CV     1
 ASSI { 1017}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.100     1.200     1.200 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.30168E-02 ppm1      7.468 ppm2      2.152 CV     1
 ASSI { 1019}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 54   and name HB1 ))
      3.200     1.200     1.200 peak  1019 spectrum    1 weight  0.10000E+01 volume  0.19110E-02 ppm1      7.467 ppm2      1.507 CV     1
 ASSI { 1020}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 152  and name HG1 ))
      5.100     3.300     0.900 peak  1020 spectrum    1 weight  0.10000E+01 volume  0.26163E-03 ppm1      7.468 ppm2      1.294 CV     1
 OR { 1020}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 152  and name HG2 ))
 ASSI { 1023}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 60   and name HG1 ))
      3.300     1.400     1.400 peak  1023 spectrum    1 weight  0.10000E+01 volume  0.92087E-03 ppm1      7.466 ppm2      0.781 CV     1
 OR { 1023}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 1024}
   (( segid "    " and resid 54   and name HN  ))
   (( segid "    " and resid 52   and name HN  ))
      4.500     2.500     1.500 peak  1024 spectrum    1 weight  0.10000E+01 volume  0.42957E-03 ppm1      7.460 ppm2      8.296 CV     1
 ASSI { 1028}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 156  and name HE% )
      4.200     2.200     1.800 peak  1028 spectrum    1 weight  0.10000E+01 volume  0.43444E-03 ppm1      9.003 ppm2      7.653 CV     1
 ASSI { 1029}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 156  and name HZ  ))
      4.700     2.800     1.300 peak  1029 spectrum    1 weight  0.10000E+01 volume  0.31451E-03 ppm1      9.006 ppm2      7.172 CV     1
 ASSI { 1030}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 74   and name HN  ))
      4.500     2.500     1.500 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.54767E-03 ppm1      9.004 ppm2      6.960 CV     1
 ASSI { 1031}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 83   and name HD% )
      3.000     1.100     1.100 peak  1031 spectrum    1 weight  0.10000E+01 volume  0.17818E-02 ppm1      9.003 ppm2      6.769 CV     1
 ASSI { 1032}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 72   and name HN  ))
      2.900     1.100     1.100 peak  1032 spectrum    1 weight  0.10000E+01 volume  0.19443E-02 ppm1      9.004 ppm2      6.668 CV     1
 ASSI { 1035}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 73   and name HA  ))
      3.700     1.700     1.700 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.71905E-03 ppm1      9.005 ppm2      4.861 CV     1
 ASSI { 1036}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.900     1.000     1.000 peak  1036 spectrum    1 weight  0.10000E+01 volume  0.20815E-02 ppm1      9.004 ppm2      2.600 CV     1
 ASSI { 1038}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 82   and name HB1 ))
      4.000     2.000     2.000 peak  1038 spectrum    1 weight  0.10000E+01 volume  0.13413E-02 ppm1      9.004 ppm2      1.833 CV     1
 ASSI { 1041}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 74   and name HB% )
      3.800     1.800     1.800 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.87516E-03 ppm1      9.004 ppm2      0.179 CV     1
 ASSI { 1042}
   (( segid "    " and resid 83   and name HN  ))
   (  segid "    " and resid 83   and name HE% )
      4.100     2.100     1.900 peak  1042 spectrum    1 weight  0.10000E+01 volume  0.79538E-03 ppm1      9.004 ppm2      6.433 CV     1
 ASSI { 1044}
   (( segid "    " and resid 83   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      4.300     2.300     1.700 peak  1044 spectrum    1 weight  0.10000E+01 volume  0.64792E-03 ppm1      9.004 ppm2      2.322 CV     1
 ASSI { 1046}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 22   and name HN  ))
      4.700     2.800     1.300 peak  1046 spectrum    1 weight  0.10000E+01 volume  0.34499E-03 ppm1      8.811 ppm2      8.382 CV     1
 ASSI { 1047}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 18   and name HN  ))
      4.100     2.100     1.900 peak  1047 spectrum    1 weight  0.10000E+01 volume  0.57929E-03 ppm1      8.812 ppm2      8.222 CV     1
 ASSI { 1048}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      2.700     2.700     3.300 peak  1048 spectrum    1 weight  0.10000E+01 volume  0.37990E-02 ppm1      8.808 ppm2      4.234 CV     1
 ASSI { 1049}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB2 ))
      2.600     0.800     0.800 peak  1049 spectrum    1 weight  0.10000E+01 volume  0.52249E-02 ppm1      8.808 ppm2      4.031 CV     1
 OR { 1049}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 20   and name HB1 ))
 ASSI { 1050}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      4.400     2.500     1.600 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.31379E-03 ppm1      8.809 ppm2      3.387 CV     1
 ASSI { 1051}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HG2 ))
      4.000     2.000     2.000 peak  1051 spectrum    1 weight  0.10000E+01 volume  0.58342E-03 ppm1      8.811 ppm2      2.769 CV     1
 ASSI { 1052}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HG1 ))
      4.400     2.400     1.600 peak  1052 spectrum    1 weight  0.10000E+01 volume  0.54698E-03 ppm1      8.812 ppm2      2.670 CV     1
 ASSI { 1053}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.700     0.900     0.900 peak  1053 spectrum    1 weight  0.10000E+01 volume  0.32897E-02 ppm1      8.807 ppm2      2.230 CV     1
 OR { 1053}
   (( segid "    " and resid 20   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1054}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 21   and name HB% )
      4.400     2.400     1.600 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.91643E-03 ppm1      8.806 ppm2      1.429 CV     1
 ASSI { 1056}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
      2.900     2.900     3.100 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.40013E-03 ppm1      8.808 ppm2      0.874 CV     1
 OR { 1056}
   (( segid "    " and resid 20   and name HN  ))
   (  segid "    " and resid 18   and name HG1%)
 ASSI { 1060}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 112  and name HB1 ))
      5.000     3.100     1.000 peak  1060 spectrum    1 weight  0.10000E+01 volume  0.21124E-03 ppm1      8.446 ppm2      3.037 CV     1
 ASSI { 1061}
   (( segid "    " and resid 4    and name HN  ))
   (( segid "    " and resid 3    and name HA  ))
      4.000     2.000     2.000 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.33066E-03 ppm1      8.471 ppm2      3.798 CV     1
 ASSI { 1062}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.000     3.000     3.000 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.32726E-03 ppm1      8.467 ppm2      3.478 CV     1
 ASSI { 1063}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 152  and name HG2 ))
      4.400     2.400     1.600 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.16598E-03 ppm1      8.457 ppm2      1.245 CV     1
 OR { 1063}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 152  and name HG1 ))
 ASSI { 1065}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 112  and name HD22))
      3.800     1.800     1.800 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.36149E-03 ppm1      8.447 ppm2      7.073 CV     1
 ASSI { 1067}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 151  and name HA  ))
      2.500     0.800     0.800 peak  1067 spectrum    1 weight  0.10000E+01 volume  0.53598E-02 ppm1      8.443 ppm2      5.500 CV     1
 ASSI { 1069}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 112  and name HA  ))
      3.700     1.700     1.700 peak  1069 spectrum    1 weight  0.10000E+01 volume  0.89375E-03 ppm1      8.444 ppm2      4.275 CV     1
 ASSI { 1070}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 151  and name HB1 ))
      3.400     1.400     1.400 peak  1070 spectrum    1 weight  0.10000E+01 volume  0.19130E-02 ppm1      8.443 ppm2      2.671 CV     1
 OR { 1070}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 151  and name HB2 ))
 ASSI { 1071}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 152  and name HD1 ))
      2.900     2.900     3.100 peak  1071 spectrum    1 weight  0.10000E+01 volume  0.18362E-02 ppm1      8.443 ppm2      1.565 CV     1
 OR { 1071}
   (( segid "    " and resid 152  and name HN  ))
   (( segid "    " and resid 152  and name HD2 ))
 ASSI { 1072}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 69   and name HA  ))
      4.600     2.600     1.400 peak  1072 spectrum    1 weight  0.10000E+01 volume  0.32138E-03 ppm1      8.232 ppm2      5.229 CV     1
 ASSI { 1073}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 87   and name HN  ))
      3.100     1.200     1.200 peak  1073 spectrum    1 weight  0.10000E+01 volume  0.12306E-02 ppm1      8.228 ppm2      7.900 CV     1
 ASSI { 1074}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      4.100     2.100     1.900 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.48866E-03 ppm1      8.230 ppm2      7.257 CV     1
 ASSI { 1075}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 88   and name HH11))
      4.400     2.400     1.600 peak  1075 spectrum    1 weight  0.10000E+01 volume  0.53856E-03 ppm1      8.229 ppm2      6.633 CV     1
 OR { 1075}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 88   and name HH12))
 ASSI { 1077}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      4.500     2.600     1.500 peak  1077 spectrum    1 weight  0.10000E+01 volume  0.36160E-03 ppm1      8.227 ppm2      5.595 CV     1
 ASSI { 1078}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HA  ))
      3.300     1.300     1.300 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.87229E-03 ppm1      8.233 ppm2      4.928 CV     1
 ASSI { 1080}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA2 ))
      3.700     1.700     1.700 peak  1080 spectrum    1 weight  0.10000E+01 volume  0.20389E-02 ppm1      8.232 ppm2      4.396 CV     1
 ASSI { 1081}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 67   and name HA1 ))
      2.400     0.700     0.700 peak  1081 spectrum    1 weight  0.10000E+01 volume  0.24325E-02 ppm1      8.227 ppm2      3.911 CV     1
 ASSI { 1082}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HG1 ))
      3.800     1.800     1.800 peak  1082 spectrum    1 weight  0.10000E+01 volume  0.63403E-03 ppm1      8.229 ppm2      2.328 CV     1
 ASSI { 1084}
   (( segid "    " and resid 68   and name HN  ))
   (( segid "    " and resid 68   and name HB1 ))
      3.700     1.700     1.700 peak  1084 spectrum    1 weight  0.10000E+01 volume  0.16616E-02 ppm1      8.232 ppm2      1.985 CV     1
 ASSI { 1085}
   (( segid "    " and resid 68   and name HN  ))
   (  segid "    " and resid 86   and name HD1%)
      3.300     1.400     1.400 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.92182E-03 ppm1      8.228 ppm2      1.096 CV     1
 ASSI { 1090}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 20   and name HN  ))
      4.800     2.900     1.200 peak  1090 spectrum    1 weight  0.10000E+01 volume  0.18806E-03 ppm1      7.799 ppm2      8.819 CV     1
 ASSI { 1094}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB1 ))
      2.400     0.700     0.700 peak  1094 spectrum    1 weight  0.10000E+01 volume  0.73028E-02 ppm1      7.799 ppm2      4.064 CV     1
 OR { 1094}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 23   and name HB2 ))
 ASSI { 1095}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
      5.100     3.200     0.900 peak  1095 spectrum    1 weight  0.10000E+01 volume  0.20318E-03 ppm1      7.799 ppm2      3.115 CV     1
 ASSI { 1097}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 60   and name HN  ))
      2.600     0.800     0.800 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.38672E-02 ppm1      7.670 ppm2      8.263 CV     1
 ASSI { 1098}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      2.300     0.700     0.700 peak  1098 spectrum    1 weight  0.10000E+01 volume  0.47864E-02 ppm1      7.670 ppm2      8.063 CV     1
 ASSI { 1100}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.000     2.000     4.000 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.91279E-02 ppm1      7.671 ppm2      3.735 CV     1
 ASSI { 1101}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB2 ))
      3.500     1.500     1.500 peak  1101 spectrum    1 weight  0.10000E+01 volume  0.11289E-02 ppm1      7.673 ppm2      2.187 CV     1
 ASSI { 1102}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HB1 ))
      3.000     1.100     1.100 peak  1102 spectrum    1 weight  0.10000E+01 volume  0.23251E-02 ppm1      7.669 ppm2      1.632 CV     1
 ASSI { 1103}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG1 ))
      2.800     1.000     1.000 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.27746E-02 ppm1      7.669 ppm2      1.303 CV     1
 OR { 1103}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HG2 ))
 ASSI { 1107}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      3.400     1.500     1.500 peak  1107 spectrum    1 weight  0.10000E+01 volume  0.84995E-03 ppm1      7.410 ppm2      6.838 CV     1
 ASSI { 1108}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 53   and name HE% )
      5.100     3.300     0.900 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.19847E-03 ppm1      7.406 ppm2      6.553 CV     1
 ASSI { 1111}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      3.800     1.800     1.800 peak  1111 spectrum    1 weight  0.10000E+01 volume  0.12670E-02 ppm1      7.412 ppm2      4.368 CV     1
 ASSI { 1112}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 51   and name HA  ))
      3.500     1.500     1.500 peak  1112 spectrum    1 weight  0.10000E+01 volume  0.71286E-03 ppm1      7.412 ppm2      4.151 CV     1
 ASSI { 1113}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.800     1.000     1.000 peak  1113 spectrum    1 weight  0.10000E+01 volume  0.15442E-02 ppm1      7.410 ppm2      3.839 CV     1
 ASSI { 1114}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 53   and name HB1 ))
      3.400     1.500     1.500 peak  1114 spectrum    1 weight  0.10000E+01 volume  0.31929E-02 ppm1      7.409 ppm2      2.430 CV     1
 ASSI { 1116}
   (( segid "    " and resid 53   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      4.200     2.200     1.800 peak  1116 spectrum    1 weight  0.10000E+01 volume  0.76943E-03 ppm1      7.409 ppm2      1.812 CV     1
 ASSI { 1118}
   (( segid "    " and resid 53   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      3.400     3.400     2.600 peak  1118 spectrum    1 weight  0.10000E+01 volume  0.13406E-02 ppm1      7.409 ppm2      1.125 CV     1
 ASSI { 1123}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 45   and name HN  ))
      3.800     1.800     1.800 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.52175E-03 ppm1      7.008 ppm2      7.354 CV     1
 ASSI { 1125}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 40   and name HA  ))
      3.100     3.100     2.900 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.17793E-02 ppm1      7.007 ppm2      4.024 CV     1
 ASSI { 1126}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 40   and name HB2 ))
      2.600     2.600     3.400 peak  1126 spectrum    1 weight  0.10000E+01 volume  0.75628E-03 ppm1      7.009 ppm2      3.837 CV     1
 OR { 1126}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 40   and name HB1 ))
 ASSI { 1127}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 42   and name HB  ))
      2.700     0.900     0.900 peak  1127 spectrum    1 weight  0.10000E+01 volume  0.24323E-02 ppm1      7.008 ppm2      2.226 CV     1
 ASSI { 1128}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 43   and name HB2 ))
      2.500     0.800     0.800 peak  1128 spectrum    1 weight  0.10000E+01 volume  0.37002E-02 ppm1      7.007 ppm2      2.010 CV     1
 ASSI { 1131}
   (( segid "    " and resid 43   and name HN  ))
   (  segid "    " and resid 43   and name HD1%)
      3.700     1.700     1.700 peak  1131 spectrum    1 weight  0.10000E+01 volume  0.26017E-02 ppm1      7.008 ppm2      0.931 CV     1
 ASSI { 1137}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 155  and name HD% )
      5.500     3.800     0.500 peak  1137 spectrum    1 weight  0.10000E+01 volume  0.24230E-03 ppm1      8.768 ppm2      7.208 CV     1
 ASSI { 1138}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 132  and name HA  ))
      4.000     2.000     2.000 peak  1138 spectrum    1 weight  0.10000E+01 volume  0.36613E-03 ppm1      8.767 ppm2      4.646 CV     1
 ASSI { 1139}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 108  and name HA2 ))
      2.500     0.800     0.800 peak  1139 spectrum    1 weight  0.10000E+01 volume  0.25901E-02 ppm1      8.767 ppm2      4.222 CV     1
 ASSI { 1141}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HN  ))
      4.900     3.000     1.100 peak  1141 spectrum    1 weight  0.10000E+01 volume  0.24988E-03 ppm1      8.767 ppm2      9.458 CV     1
 ASSI { 1142}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 109  and name HD% )
      3.500     1.500     1.500 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.15176E-02 ppm1      8.768 ppm2      7.059 CV     1
 ASSI { 1144}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 110  and name HA2 ))
      4.600     2.700     1.400 peak  1144 spectrum    1 weight  0.10000E+01 volume  0.17299E-03 ppm1      8.764 ppm2      5.146 CV     1
 ASSI { 1147}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 92   and name HN  ))
      4.200     2.200     1.800 peak  1147 spectrum    1 weight  0.10000E+01 volume  0.54693E-03 ppm1      8.394 ppm2      8.011 CV     1
 ASSI { 1148}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 151  and name HD21))
      5.400     3.700     0.600 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.19191E-03 ppm1      8.396 ppm2      7.219 CV     1
 ASSI { 1149}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HA  ))
      2.900     1.100     1.100 peak  1149 spectrum    1 weight  0.10000E+01 volume  0.23403E-02 ppm1      8.395 ppm2      3.820 CV     1
 ASSI { 1150}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HA  ))
      3.300     1.400     1.400 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.10346E-02 ppm1      8.393 ppm2      3.637 CV     1
 ASSI { 1151}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.800     1.000     1.000 peak  1151 spectrum    1 weight  0.10000E+01 volume  0.29566E-02 ppm1      8.393 ppm2      3.448 CV     1
 ASSI { 1154}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      4.200     2.200     1.800 peak  1154 spectrum    1 weight  0.10000E+01 volume  0.26826E-03 ppm1      8.395 ppm2      1.808 CV     1
 ASSI { 1158}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      2.800     2.800     3.200 peak  1158 spectrum    1 weight  0.10000E+01 volume  0.35811E-02 ppm1      8.393 ppm2      0.553 CV     1
 ASSI { 1159}
   (( segid "    " and resid 94   and name HN  ))
   (  segid "    " and resid 89   and name HD2%)
      4.100     2.100     1.900 peak  1159 spectrum    1 weight  0.10000E+01 volume  0.39778E-03 ppm1      8.393 ppm2      0.266 CV     1
 ASSI { 1161}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 7    and name HB1 ))
      3.400     1.400     1.400 peak  1161 spectrum    1 weight  0.10000E+01 volume  0.96206E-03 ppm1      8.380 ppm2      2.797 CV     1
 ASSI { 1162}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HD1 ))
      4.800     2.900     1.200 peak  1162 spectrum    1 weight  0.10000E+01 volume  0.26820E-03 ppm1      8.391 ppm2      1.597 CV     1
 OR { 1162}
   (( segid "    " and resid 94   and name HN  ))
   (( segid "    " and resid 91   and name HD2 ))
 ASSI { 1165}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 5    and name HA  ))
      2.600     2.600     3.400 peak  1165 spectrum    1 weight  0.10000E+01 volume  0.75296E-03 ppm1      8.370 ppm2      4.412 CV     1
 ASSI { 1166}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HB2 ))
      3.400     1.400     1.400 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.10872E-02 ppm1      8.372 ppm2      3.961 CV     1
 OR { 1166}
   (( segid "    " and resid 8    and name HN  ))
   (( segid "    " and resid 8    and name HB1 ))
 ASSI { 1168}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 152  and name HG1 ))
      3.600     1.600     1.600 peak  1168 spectrum    1 weight  0.10000E+01 volume  0.29391E-02 ppm1      8.255 ppm2      1.279 CV     1
 OR { 1168}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 152  and name HG2 ))
 ASSI { 1169}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 55   and name HN  ))
      3.800     1.800     1.800 peak  1169 spectrum    1 weight  0.10000E+01 volume  0.11678E-02 ppm1      8.258 ppm2      8.653 CV     1
 ASSI { 1171}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HA  ))
      2.100     0.600     0.600 peak  1171 spectrum    1 weight  0.10000E+01 volume  0.61387E-02 ppm1      8.255 ppm2      3.738 CV     1
 ASSI { 1172}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HE2 ))
      3.300     3.300     2.700 peak  1172 spectrum    1 weight  0.10000E+01 volume  0.28713E-02 ppm1      8.255 ppm2      3.017 CV     1
 OR { 1172}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 59   and name HE1 ))
 ASSI { 1173}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.200     1.300     1.300 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.18820E-02 ppm1      8.255 ppm2      2.479 CV     1
 ASSI { 1174}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 152  and name HB2 ))
      3.400     1.400     1.400 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.13009E-02 ppm1      8.255 ppm2      1.830 CV     1
 ASSI { 1181}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HD21))
      3.900     1.900     1.900 peak  1181 spectrum    1 weight  0.10000E+01 volume  0.70074E-03 ppm1      8.069 ppm2      7.053 CV     1
 ASSI { 1182}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      5.500     3.700     0.500 peak  1182 spectrum    1 weight  0.10000E+01 volume  0.20160E-03 ppm1      8.073 ppm2      5.017 CV     1
 ASSI { 1183}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      2.900     1.000     1.000 peak  1183 spectrum    1 weight  0.10000E+01 volume  0.18242E-02 ppm1      8.073 ppm2      4.769 CV     1
 ASSI { 1186}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 151  and name HB1 ))
      3.700     1.700     1.700 peak  1186 spectrum    1 weight  0.10000E+01 volume  0.16018E-02 ppm1      8.068 ppm2      2.744 CV     1
 OR { 1186}
   (( segid "    " and resid 58   and name HN  ))
   (( segid "    " and resid 151  and name HB2 ))
 ASSI { 1190}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 154  and name HN  ))
      4.600     2.600     1.400 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.39617E-03 ppm1      8.007 ppm2      9.458 CV     1
 ASSI { 1192}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 63   and name HD22))
      4.500     2.600     1.500 peak  1192 spectrum    1 weight  0.10000E+01 volume  0.30941E-03 ppm1      8.008 ppm2      6.635 CV     1
 OR { 1192}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 63   and name HD21))
 ASSI { 1194}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
      2.100     0.600     0.600 peak  1194 spectrum    1 weight  0.10000E+01 volume  0.51800E-02 ppm1      8.008 ppm2      5.216 CV     1
 ASSI { 1196}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 61   and name HA  ))
      3.300     1.400     1.400 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.62756E-02 ppm1      8.006 ppm2      4.568 CV     1
 ASSI { 1199}
   (( segid "    " and resid 155  and name HN  ))
   (( segid "    " and resid 64   and name HD1 ))
      3.600     1.600     1.600 peak  1199 spectrum    1 weight  0.10000E+01 volume  0.72022E-03 ppm1      8.008 ppm2      3.018 CV     1
 ASSI { 1205}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      2.900     1.100     1.100 peak  1205 spectrum    1 weight  0.10000E+01 volume  0.19272E-02 ppm1      7.824 ppm2      4.848 CV     1
 ASSI { 1206}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 74   and name HA  ))
      4.700     2.700     1.300 peak  1206 spectrum    1 weight  0.10000E+01 volume  0.47423E-03 ppm1      7.823 ppm2      3.827 CV     1
 ASSI { 1207}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 76   and name HB2 ))
      3.000     1.100     1.100 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.27477E-02 ppm1      7.824 ppm2      2.820 CV     1
 ASSI { 1210}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.300     3.300     2.700 peak  1210 spectrum    1 weight  0.10000E+01 volume  0.17420E-03 ppm1      7.799 ppm2      2.198 CV     1
 OR { 1210}
   (( segid "    " and resid 23   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1212}
   (( segid "    " and resid 23   and name HN  ))
   (  segid "    " and resid 25   and name HG2%)
      4.700     2.800     1.300 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.28446E-03 ppm1      7.799 ppm2      0.555 CV     1
 ASSI { 1214}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 128  and name HN  ))
      4.000     2.000     2.000 peak  1214 spectrum    1 weight  0.10000E+01 volume  0.65910E-03 ppm1      7.652 ppm2      8.893 CV     1
 ASSI { 1216}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HA  ))
      2.700     0.900     0.900 peak  1216 spectrum    1 weight  0.10000E+01 volume  0.14334E-02 ppm1      7.651 ppm2      4.784 CV     1
 ASSI { 1218}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HB2 ))
      2.600     0.900     0.900 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.49849E-02 ppm1      7.653 ppm2      2.863 CV     1
 ASSI { 1219}
   (( segid "    " and resid 127  and name HN  ))
   (( segid "    " and resid 127  and name HB1 ))
      2.700     0.900     0.900 peak  1219 spectrum    1 weight  0.10000E+01 volume  0.45022E-02 ppm1      7.652 ppm2      2.420 CV     1
 ASSI { 1222}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      4.600     2.700     1.400 peak  1222 spectrum    1 weight  0.10000E+01 volume  0.32388E-03 ppm1      8.767 ppm2      4.893 CV     1
 ASSI { 1224}
   (( segid "    " and resid 109  and name HN  ))
   (( segid "    " and resid 132  and name HB1 ))
      5.500     3.700     0.500 peak  1224 spectrum    1 weight  0.10000E+01 volume  0.19326E-03 ppm1      8.770 ppm2      3.819 CV     1
 ASSI { 1227}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 122  and name HE% )
      4.600     2.700     1.400 peak  1227 spectrum    1 weight  0.10000E+01 volume  0.27334E-03 ppm1      8.768 ppm2      6.375 CV     1
 ASSI { 1233}
   (( segid "    " and resid 109  and name HN  ))
   (  segid "    " and resid 130  and name HB% )
      3.800     3.800     2.200 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.59685E-03 ppm1      8.768 ppm2      0.571 CV     1
 ASSI { 1237}
   (( segid "    " and resid 76   and name HN  ))
   (( segid "    " and resid 75   and name HA  ))
      3.500     1.600     1.600 peak  1237 spectrum    1 weight  0.10000E+01 volume  0.12889E-02 ppm1      7.825 ppm2      4.600 CV     1
 ASSI { 1239}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 26   and name HN  ))
      5.000     3.100     1.000 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.21404E-03 ppm1      7.668 ppm2      8.618 CV     1
 ASSI { 1241}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HD% )
      2.800     1.000     1.000 peak  1241 spectrum    1 weight  0.10000E+01 volume  0.20044E-02 ppm1      7.668 ppm2      7.293 CV     1
 ASSI { 1243}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 35   and name HE% )
      4.300     2.300     1.700 peak  1243 spectrum    1 weight  0.10000E+01 volume  0.40047E-03 ppm1      7.668 ppm2      6.851 CV     1
 ASSI { 1244}
   (( segid "    " and resid 29   and name HN  ))
   (  segid "    " and resid 29   and name HE% )
      5.300     3.500     0.700 peak  1244 spectrum    1 weight  0.10000E+01 volume  0.37698E-03 ppm1      7.668 ppm2      6.667 CV     1
 ASSI { 1245}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      3.700     1.700     1.700 peak  1245 spectrum    1 weight  0.10000E+01 volume  0.51682E-03 ppm1      7.668 ppm2      4.605 CV     1
 ASSI { 1248}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      4.100     2.100     1.900 peak  1248 spectrum    1 weight  0.10000E+01 volume  0.61447E-03 ppm1      7.668 ppm2      3.520 CV     1
 ASSI { 1249}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 29   and name HB1 ))
      3.500     1.600     1.600 peak  1249 spectrum    1 weight  0.10000E+01 volume  0.27416E-02 ppm1      7.670 ppm2      2.651 CV     1
 ASSI { 1251}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HB2 ))
      2.900     1.000     1.000 peak  1251 spectrum    1 weight  0.10000E+01 volume  0.14931E-02 ppm1      7.670 ppm2      1.934 CV     1
 ASSI { 1259}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB2 ))
      2.800     1.000     1.000 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.31875E-02 ppm1      7.235 ppm2      3.659 CV     1
 OR { 1259}
   (( segid "    " and resid 121  and name HN  ))
   (( segid "    " and resid 121  and name HB1 ))
 ASSI { 1262}
   (( segid "    " and resid 121  and name HN  ))
   (  segid "    " and resid 120  and name HG2%)
      4.000     2.000     2.000 peak  1262 spectrum    1 weight  0.10000E+01 volume  0.99228E-03 ppm1      7.235 ppm2      1.173 CV     1
 ASSI { 1265}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      3.800     1.800     1.800 peak  1265 spectrum    1 weight  0.10000E+01 volume  0.84849E-03 ppm1      9.025 ppm2      2.188 CV     1
 OR { 1265}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 1270}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.500     2.500     3.500 peak  1270 spectrum    1 weight  0.10000E+01 volume  0.61089E-02 ppm1      9.021 ppm2      4.082 CV     1
 ASSI { 1271}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.300     1.400     1.400 peak  1271 spectrum    1 weight  0.10000E+01 volume  0.16286E-02 ppm1      9.025 ppm2      3.867 CV     1
 OR { 1271}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1272}
   (( segid "    " and resid 37   and name HN  ))
   (( segid "    " and resid 37   and name HA1 ))
      2.700     0.900     0.900 peak  1272 spectrum    1 weight  0.10000E+01 volume  0.33370E-02 ppm1      9.025 ppm2      3.706 CV     1
 ASSI { 1275}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 40   and name HN  ))
      2.800     1.000     1.000 peak  1275 spectrum    1 weight  0.10000E+01 volume  0.24544E-02 ppm1      8.610 ppm2      8.909 CV     1
 ASSI { 1277}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 43   and name HN  ))
      3.900     1.900     1.900 peak  1277 spectrum    1 weight  0.10000E+01 volume  0.55054E-03 ppm1      8.606 ppm2      7.020 CV     1
 ASSI { 1279}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 41   and name HB  ))
      2.900     1.100     1.100 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.28142E-02 ppm1      8.608 ppm2      4.320 CV     1
 ASSI { 1282}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      4.400     2.400     1.600 peak  1282 spectrum    1 weight  0.10000E+01 volume  0.84789E-03 ppm1      8.608 ppm2      3.284 CV     1
 ASSI { 1283}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
      4.400     2.400     1.600 peak  1283 spectrum    1 weight  0.10000E+01 volume  0.58350E-03 ppm1      8.605 ppm2      2.999 CV     1
 ASSI { 1284}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HB  ))
      4.800     2.800     1.200 peak  1284 spectrum    1 weight  0.10000E+01 volume  0.48087E-03 ppm1      8.607 ppm2      2.205 CV     1
 ASSI { 1285}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HG11))
      4.300     2.300     1.700 peak  1285 spectrum    1 weight  0.10000E+01 volume  0.79893E-03 ppm1      8.606 ppm2      1.669 CV     1
 OR { 1285}
   (( segid "    " and resid 41   and name HN  ))
   (( segid "    " and resid 42   and name HG12))
 ASSI { 1286}
   (( segid "    " and resid 41   and name HN  ))
   (  segid "    " and resid 41   and name HG2%)
      2.600     2.600     3.400 peak  1286 spectrum    1 weight  0.10000E+01 volume  0.59631E-02 ppm1      8.605 ppm2      1.320 CV     1
 ASSI { 1289}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      2.900     1.100     1.100 peak  1289 spectrum    1 weight  0.10000E+01 volume  0.23859E-02 ppm1      8.240 ppm2      8.881 CV     1
 ASSI { 1292}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      4.600     2.700     1.400 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.41912E-03 ppm1      8.240 ppm2      5.326 CV     1
 ASSI { 1295}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HA  ))
      2.900     1.100     1.100 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.15073E-02 ppm1      8.240 ppm2      4.180 CV     1
 ASSI { 1296}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HA  ))
      2.500     0.800     0.800 peak  1296 spectrum    1 weight  0.10000E+01 volume  0.28413E-02 ppm1      8.240 ppm2      3.934 CV     1
 ASSI { 1298}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
      4.800     2.900     1.200 peak  1298 spectrum    1 weight  0.10000E+01 volume  0.38417E-03 ppm1      8.240 ppm2      2.083 CV     1
 ASSI { 1299}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HG  ))
      3.200     3.200     2.800 peak  1299 spectrum    1 weight  0.10000E+01 volume  0.38277E-02 ppm1      8.238 ppm2      1.301 CV     1
 ASSI { 1300}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 89   and name HB1 ))
      3.000     1.100     1.100 peak  1300 spectrum    1 weight  0.10000E+01 volume  0.15985E-02 ppm1      8.239 ppm2      1.001 CV     1
 ASSI { 1301}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HD1%)
      3.800     1.800     1.800 peak  1301 spectrum    1 weight  0.10000E+01 volume  0.14763E-02 ppm1      8.239 ppm2      0.559 CV     1
 ASSI { 1302}
   (( segid "    " and resid 89   and name HN  ))
   (  segid "    " and resid 89   and name HD2%)
      3.800     3.800     2.200 peak  1302 spectrum    1 weight  0.10000E+01 volume  0.13609E-02 ppm1      8.240 ppm2      0.298 CV     1
 ASSI { 1318}
   (( segid "    " and resid 29   and name HN  ))
   (( segid "    " and resid 28   and name HG  ))
      4.300     2.300     1.700 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.49766E-03 ppm1      7.671 ppm2      1.650 CV     1
 ASSI { 1320}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HA  ))
      3.300     1.400     1.400 peak  1320 spectrum    1 weight  0.10000E+01 volume  0.18097E-02 ppm1      6.927 ppm2      4.559 CV     1
 ASSI { 1321}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HB2 ))
      4.000     2.000     2.000 peak  1321 spectrum    1 weight  0.10000E+01 volume  0.43352E-03 ppm1      6.930 ppm2      3.958 CV     1
 OR { 1321}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 47   and name HB1 ))
 ASSI { 1322}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HD2 ))
      4.400     2.500     1.600 peak  1322 spectrum    1 weight  0.10000E+01 volume  0.38706E-03 ppm1      6.931 ppm2      3.702 CV     1
 OR { 1322}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 50   and name HD1 ))
 ASSI { 1324}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HN  ))
      2.700     0.900     0.900 peak  1324 spectrum    1 weight  0.10000E+01 volume  0.33150E-02 ppm1      6.927 ppm2      8.044 CV     1
 ASSI { 1325}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 48   and name HA  ))
      3.300     1.300     1.300 peak  1325 spectrum    1 weight  0.10000E+01 volume  0.14684E-02 ppm1      6.927 ppm2      4.129 CV     1
 ASSI { 1326}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HB  ))
      2.500     0.800     0.800 peak  1326 spectrum    1 weight  0.10000E+01 volume  0.51957E-02 ppm1      6.927 ppm2      1.987 CV     1
 ASSI { 1327}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HG11))
      2.400     0.700     0.700 peak  1327 spectrum    1 weight  0.10000E+01 volume  0.86513E-02 ppm1      6.926 ppm2      1.404 CV     1
 OR { 1327}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 49   and name HG12))
 ASSI { 1328}
   (( segid "    " and resid 49   and name HN  ))
   (  segid "    " and resid 49   and name HD1%)
      3.900     1.900     1.900 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.17454E-02 ppm1      6.926 ppm2      1.121 CV     1
 ASSI { 1332}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 30   and name HB  ))
      3.900     1.900     1.900 peak  1332 spectrum    1 weight  0.10000E+01 volume  0.76324E-03 ppm1      8.919 ppm2      2.002 CV     1
 ASSI { 1333}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
      3.800     1.800     1.800 peak  1333 spectrum    1 weight  0.10000E+01 volume  0.42886E-03 ppm1      8.877 ppm2      2.091 CV     1
 ASSI { 1336}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      4.200     2.200     1.800 peak  1336 spectrum    1 weight  0.10000E+01 volume  0.49113E-03 ppm1      8.727 ppm2      4.420 CV     1
 ASSI { 1337}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA2 ))
      3.300     1.400     1.400 peak  1337 spectrum    1 weight  0.10000E+01 volume  0.19614E-02 ppm1      8.726 ppm2      4.221 CV     1
 ASSI { 1338}
   (( segid "    " and resid 104  and name HN  ))
   (( segid "    " and resid 103  and name HA1 ))
      3.400     1.400     1.400 peak  1338 spectrum    1 weight  0.10000E+01 volume  0.83013E-03 ppm1      8.728 ppm2      3.920 CV     1
 ASSI { 1339}
   (( segid "    " and resid 104  and name HN  ))
   (  segid "    " and resid 104  and name HG2%)
      3.400     1.400     1.400 peak  1339 spectrum    1 weight  0.10000E+01 volume  0.12804E-02 ppm1      8.726 ppm2      1.354 CV     1
 ASSI { 1341}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HN  ))
      1.700     0.400     0.500 peak  1341 spectrum    1 weight  0.10000E+01 volume  0.36403E-01 ppm1      8.471 ppm2      8.332 CV     1
 ASSI { 1342}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 58   and name HN  ))
      4.700     2.800     1.300 peak  1342 spectrum    1 weight  0.10000E+01 volume  0.35120E-03 ppm1      8.470 ppm2      8.070 CV     1
 ASSI { 1343}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 59   and name HN  ))
      5.300     3.500     0.700 peak  1343 spectrum    1 weight  0.10000E+01 volume  0.22302E-03 ppm1      8.470 ppm2      7.669 CV     1
 ASSI { 1344}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      2.100     0.600     0.600 peak  1344 spectrum    1 weight  0.10000E+01 volume  0.10804E-01 ppm1      8.470 ppm2      5.029 CV     1
 ASSI { 1347}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 57   and name HB  ))
      5.400     3.600     0.600 peak  1347 spectrum    1 weight  0.10000E+01 volume  0.30609E-03 ppm1      8.470 ppm2      4.191 CV     1
 ASSI { 1349}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB2 ))
      4.100     2.100     1.900 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.61401E-03 ppm1      8.471 ppm2      3.031 CV     1
 ASSI { 1350}
   (( segid "    " and resid 56   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.400     1.400     1.400 peak  1350 spectrum    1 weight  0.10000E+01 volume  0.10768E-02 ppm1      8.470 ppm2      2.490 CV     1
 ASSI { 1353}
   (( segid "    " and resid 56   and name HN  ))
   (  segid "    " and resid 56   and name HG2%)
      2.500     0.800     0.800 peak  1353 spectrum    1 weight  0.10000E+01 volume  0.54681E-02 ppm1      8.470 ppm2      1.320 CV     1
 ASSI { 1358}
   (( segid "    " and resid 31   and name HN  ))
   (( segid "    " and resid 31   and name HA2 ))
      2.300     0.600     0.600 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.95845E-02 ppm1      8.922 ppm2      4.111 CV     1
 ASSI { 1363}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 60   and name HA  ))
      3.700     1.700     1.700 peak  1363 spectrum    1 weight  0.10000E+01 volume  0.31276E-03 ppm1      8.878 ppm2      5.319 CV     1
 ASSI { 1364}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      2.500     0.800     0.800 peak  1364 spectrum    1 weight  0.10000E+01 volume  0.21663E-02 ppm1      8.878 ppm2      4.855 CV     1
 ASSI { 1367}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      3.100     1.200     1.200 peak  1367 spectrum    1 weight  0.10000E+01 volume  0.13943E-02 ppm1      8.878 ppm2      1.748 CV     1
 ASSI { 1369}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HD1 ))
      5.600     3.900     0.400 peak  1369 spectrum    1 weight  0.10000E+01 volume  0.24781E-03 ppm1      8.876 ppm2      3.201 CV     1
 OR { 1369}
   (( segid "    " and resid 88   and name HN  ))
   (( segid "    " and resid 88   and name HD2 ))
 ASSI { 1374}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 114  and name HA  ))
      2.100     0.600     0.600 peak  1374 spectrum    1 weight  0.10000E+01 volume  0.64434E-02 ppm1      8.777 ppm2      4.510 CV     1
 ASSI { 1375}
   (( segid "    " and resid 115  and name HN  ))
   (( segid "    " and resid 115  and name HA2 ))
      2.300     0.700     0.700 peak  1375 spectrum    1 weight  0.10000E+01 volume  0.37469E-02 ppm1      8.777 ppm2      3.894 CV     1
 ASSI { 1378}
   (( segid "    " and resid 115  and name HN  ))
   (  segid "    " and resid 113  and name HG2%)
      3.800     1.800     1.800 peak  1378 spectrum    1 weight  0.10000E+01 volume  0.72025E-03 ppm1      8.777 ppm2      0.585 CV     1
 ASSI { 1380}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 6    and name HB1 ))
      3.200     1.300     1.300 peak  1380 spectrum    1 weight  0.10000E+01 volume  0.28609E-02 ppm1      8.389 ppm2      4.321 CV     1
 OR { 1380}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 6    and name HB2 ))
 ASSI { 1381}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 11   and name HA  ))
      2.600     0.900     0.900 peak  1381 spectrum    1 weight  0.10000E+01 volume  0.34739E-02 ppm1      8.388 ppm2      4.088 CV     1
 ASSI { 1382}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 9    and name HB2 ))
      4.300     2.300     1.700 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.48274E-03 ppm1      8.389 ppm2      2.877 CV     1
 ASSI { 1383}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HG1 ))
      4.700     2.800     1.300 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.36226E-03 ppm1      8.384 ppm2      2.481 CV     1
 OR { 1383}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 12   and name HG2 ))
 ASSI { 1385}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HB2 ))
      3.500     1.500     1.500 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.22725E-02 ppm1      8.389 ppm2      1.691 CV     1
 ASSI { 1386}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      3.100     1.200     1.200 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.11930E-02 ppm1      8.389 ppm2      0.935 CV     1
 ASSI { 1388}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 104  and name HN  ))
      3.200     1.200     1.200 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.10971E-02 ppm1      7.988 ppm2      8.735 CV     1
 ASSI { 1391}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.900     2.900     3.100 peak  1391 spectrum    1 weight  0.10000E+01 volume  0.36134E-02 ppm1      7.988 ppm2      4.381 CV     1
 ASSI { 1392}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 103  and name HA2 ))
      3.700     1.700     1.700 peak  1392 spectrum    1 weight  0.10000E+01 volume  0.17332E-02 ppm1      7.990 ppm2      4.211 CV     1
 ASSI { 1394}
   (( segid "    " and resid 105  and name HN  ))
   (( segid "    " and resid 105  and name HB1 ))
      2.700     0.900     0.900 peak  1394 spectrum    1 weight  0.10000E+01 volume  0.32786E-02 ppm1      7.986 ppm2      3.856 CV     1
 ASSI { 1396}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 104  and name HG2%)
      4.000     2.000     2.000 peak  1396 spectrum    1 weight  0.10000E+01 volume  0.70218E-03 ppm1      7.989 ppm2      1.336 CV     1
 ASSI { 1397}
   (( segid "    " and resid 105  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      4.300     2.300     1.700 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.72586E-03 ppm1      7.984 ppm2      1.129 CV     1
 ASSI { 1401}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 94   and name HN  ))
      3.900     1.900     1.900 peak  1401 spectrum    1 weight  0.10000E+01 volume  0.47162E-03 ppm1      7.799 ppm2      8.380 CV     1
 ASSI { 1402}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HN  ))
      2.600     0.800     0.800 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.33379E-02 ppm1      7.802 ppm2      8.069 CV     1
 ASSI { 1403}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HA  ))
      5.300     3.500     0.700 peak  1403 spectrum    1 weight  0.10000E+01 volume  0.24383E-03 ppm1      7.800 ppm2      4.363 CV     1
 ASSI { 1404}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 92   and name HA  ))
      2.600     2.600     3.400 peak  1404 spectrum    1 weight  0.10000E+01 volume  0.61576E-02 ppm1      7.800 ppm2      4.035 CV     1
 ASSI { 1405}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 93   and name HA  ))
      3.000     1.100     1.100 peak  1405 spectrum    1 weight  0.10000E+01 volume  0.26381E-02 ppm1      7.801 ppm2      3.767 CV     1
 ASSI { 1406}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 94   and name HB2 ))
      2.400     2.400     3.600 peak  1406 spectrum    1 weight  0.10000E+01 volume  0.11514E-02 ppm1      7.803 ppm2      3.426 CV     1
 ASSI { 1407}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      5.300     3.500     0.700 peak  1407 spectrum    1 weight  0.10000E+01 volume  0.19653E-03 ppm1      7.804 ppm2      2.524 CV     1
 ASSI { 1408}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 95   and name HB  ))
      2.700     0.900     0.900 peak  1408 spectrum    1 weight  0.10000E+01 volume  0.31720E-02 ppm1      7.800 ppm2      2.107 CV     1
 ASSI { 1409}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HB2 ))
      4.600     2.600     1.400 peak  1409 spectrum    1 weight  0.10000E+01 volume  0.58247E-03 ppm1      7.800 ppm2      1.801 CV     1
 OR { 1409}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HG  ))
 OR { 1409}
   (( segid "    " and resid 96   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1411}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 95   and name HG2%)
      3.500     1.500     1.500 peak  1411 spectrum    1 weight  0.10000E+01 volume  0.34905E-02 ppm1      7.798 ppm2      0.878 CV     1
 OR { 1411}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
 ASSI { 1412}
   (( segid "    " and resid 96   and name HN  ))
   (  segid "    " and resid 93   and name HB% )
      4.700     2.800     1.300 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.46280E-03 ppm1      7.799 ppm2      0.537 CV     1
 ASSI { 1414}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HN  ))
      2.400     0.700     0.700 peak  1414 spectrum    1 weight  0.10000E+01 volume  0.43811E-02 ppm1      7.360 ppm2      8.041 CV     1
 ASSI { 1415}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 46   and name HN  ))
      2.800     1.000     1.000 peak  1415 spectrum    1 weight  0.10000E+01 volume  0.25454E-02 ppm1      7.360 ppm2      7.225 CV     1
 ASSI { 1418}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      3.600     1.600     1.600 peak  1418 spectrum    1 weight  0.10000E+01 volume  0.60015E-03 ppm1      7.361 ppm2      4.250 CV     1
 ASSI { 1421}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.700     0.900     0.900 peak  1421 spectrum    1 weight  0.10000E+01 volume  0.30342E-02 ppm1      7.361 ppm2      3.062 CV     1
 ASSI { 1422}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.500     0.800     0.800 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.56663E-02 ppm1      7.358 ppm2      2.758 CV     1
 ASSI { 1423}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HB2 ))
      3.100     1.200     1.200 peak  1423 spectrum    1 weight  0.10000E+01 volume  0.18471E-02 ppm1      7.360 ppm2      1.914 CV     1
 ASSI { 1424}
   (( segid "    " and resid 45   and name HN  ))
   (( segid "    " and resid 44   and name HB1 ))
      3.600     1.600     1.600 peak  1424 spectrum    1 weight  0.10000E+01 volume  0.14051E-02 ppm1      7.360 ppm2      1.546 CV     1
 ASSI { 1427}
   (( segid "    " and resid 45   and name HN  ))
   (  segid "    " and resid 44   and name HD1%)
      3.300     1.300     1.300 peak  1427 spectrum    1 weight  0.10000E+01 volume  0.14532E-02 ppm1      7.362 ppm2      0.778 CV     1
 ASSI { 1429}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 124  and name HN  ))
      3.900     1.900     1.900 peak  1429 spectrum    1 weight  0.10000E+01 volume  0.37432E-03 ppm1      9.020 ppm2      8.632 CV     1
 ASSI { 1432}
   (( segid "    " and resid 123  and name HN  ))
   (  segid "    " and resid 122  and name HD% )
      4.400     2.400     1.600 peak  1432 spectrum    1 weight  0.10000E+01 volume  0.66654E-03 ppm1      9.020 ppm2      6.762 CV     1
 ASSI { 1433}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HA2 ))
      2.800     1.000     1.000 peak  1433 spectrum    1 weight  0.10000E+01 volume  0.24439E-02 ppm1      9.020 ppm2      4.705 CV     1
 ASSI { 1434}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      2.000     0.500     0.500 peak  1434 spectrum    1 weight  0.10000E+01 volume  0.97733E-02 ppm1      9.020 ppm2      4.562 CV     1
 ASSI { 1435}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 132  and name HB2 ))
      5.200     3.300     0.800 peak  1435 spectrum    1 weight  0.10000E+01 volume  0.26511E-03 ppm1      9.019 ppm2      4.276 CV     1
 ASSI { 1437}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 123  and name HA1 ))
      2.500     0.800     0.800 peak  1437 spectrum    1 weight  0.10000E+01 volume  0.29377E-02 ppm1      9.021 ppm2      3.780 CV     1
 ASSI { 1438}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
      4.000     2.000     2.000 peak  1438 spectrum    1 weight  0.10000E+01 volume  0.86900E-03 ppm1      9.021 ppm2      2.822 CV     1
 ASSI { 1439}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 122  and name HB1 ))
      3.100     1.200     1.200 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.11901E-02 ppm1      9.020 ppm2      2.504 CV     1
 ASSI { 1440}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
      5.400     3.600     0.600 peak  1440 spectrum    1 weight  0.10000E+01 volume  0.18332E-03 ppm1      9.021 ppm2      2.130 CV     1
 ASSI { 1441}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      5.400     3.600     0.600 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.31354E-03 ppm1      9.021 ppm2      1.591 CV     1
 ASSI { 1442}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 131  and name HG2 ))
      6.000     4.500     0.000 peak  1442 spectrum    1 weight  0.10000E+01 volume  0.27181E-03 ppm1      9.021 ppm2      1.459 CV     1
 OR { 1442}
   (( segid "    " and resid 123  and name HN  ))
   (( segid "    " and resid 131  and name HG1 ))
 ASSI { 1444}
   (( segid "    " and resid 123  and name HN  ))
   (  segid "    " and resid 130  and name HB% )
      3.900     1.900     1.900 peak  1444 spectrum    1 weight  0.10000E+01 volume  0.10095E-02 ppm1      9.020 ppm2      0.557 CV     1
 ASSI { 1445}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HB1 ))
      3.100     3.100     2.900 peak  1445 spectrum    1 weight  0.10000E+01 volume  0.25579E-03 ppm1      8.231 ppm2      2.776 CV     1
 OR { 1445}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HB2 ))
 ASSI { 1447}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 13   and name HA  ))
      3.200     1.300     1.300 peak  1447 spectrum    1 weight  0.10000E+01 volume  0.12553E-02 ppm1      8.231 ppm2      4.571 CV     1
 ASSI { 1448}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HA  ))
      2.700     0.900     0.900 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.36174E-02 ppm1      8.231 ppm2      4.239 CV     1
 ASSI { 1449}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HB1 ))
      2.300     0.700     0.700 peak  1449 spectrum    1 weight  0.10000E+01 volume  0.82076E-02 ppm1      8.231 ppm2      4.059 CV     1
 OR { 1449}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 16   and name HB2 ))
 ASSI { 1450}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HA  ))
      3.600     1.600     1.600 peak  1450 spectrum    1 weight  0.10000E+01 volume  0.90701E-03 ppm1      8.230 ppm2      3.482 CV     1
 ASSI { 1452}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 12   and name HB2 ))
      2.600     2.600     3.400 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.72034E-03 ppm1      8.230 ppm2      2.180 CV     1
 ASSI { 1453}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 15   and name HB  ))
      2.400     0.700     0.700 peak  1453 spectrum    1 weight  0.10000E+01 volume  0.48259E-02 ppm1      8.230 ppm2      1.971 CV     1
 ASSI { 1454}
   (( segid "    " and resid 16   and name HN  ))
   (  segid "    " and resid 14   and name HB% )
      2.900     2.900     3.100 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.39474E-03 ppm1      8.230 ppm2      1.659 CV     1
 ASSI { 1460}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HN  ))
      2.900     2.900     3.100 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.40182E-03 ppm1      7.664 ppm2      8.066 CV     1
 ASSI { 1461}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 34   and name HA  ))
      2.600     0.800     0.800 peak  1461 spectrum    1 weight  0.10000E+01 volume  0.46947E-02 ppm1      7.664 ppm2      4.677 CV     1
 ASSI { 1465}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      3.000     1.100     1.100 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.34865E-02 ppm1      7.665 ppm2      2.524 CV     1
 ASSI { 1466}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.100     1.200     1.200 peak  1466 spectrum    1 weight  0.10000E+01 volume  0.25276E-02 ppm1      7.664 ppm2      2.225 CV     1
 OR { 1466}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 32   and name HG1 ))
 ASSI { 1467}
   (( segid "    " and resid 34   and name HN  ))
   (  segid "    " and resid 33   and name HG2%)
      3.800     1.800     1.800 peak  1467 spectrum    1 weight  0.10000E+01 volume  0.77539E-03 ppm1      7.664 ppm2      1.246 CV     1
 ASSI { 1475}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HB  ))
      5.100     3.200     0.900 peak  1475 spectrum    1 weight  0.10000E+01 volume  0.37604E-03 ppm1      8.416 ppm2      1.964 CV     1
 ASSI { 1476}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 121  and name HN  ))
      2.900     2.900     3.100 peak  1476 spectrum    1 weight  0.10000E+01 volume  0.67133E-02 ppm1      8.413 ppm2      7.229 CV     1
 ASSI { 1479}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 116  and name HA  ))
      2.800     2.800     3.200 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.48801E-03 ppm1      8.413 ppm2      3.641 CV     1
 ASSI { 1481}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 119  and name HG2%)
      3.700     1.700     1.700 peak  1481 spectrum    1 weight  0.10000E+01 volume  0.19441E-02 ppm1      8.411 ppm2      0.588 CV     1
 ASSI { 1482}
   (( segid "    " and resid 120  and name HN  ))
   (  segid "    " and resid 119  and name HD1%)
      3.100     1.200     1.200 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.26519E-02 ppm1      8.413 ppm2     -0.202 CV     1
 ASSI { 1485}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      4.900     3.000     1.100 peak  1485 spectrum    1 weight  0.10000E+01 volume  0.18875E-03 ppm1      8.182 ppm2      9.823 CV     1
 ASSI { 1486}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HN  ))
      4.300     2.300     1.700 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.53762E-03 ppm1      8.184 ppm2      9.552 CV     1
 ASSI { 1488}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 70   and name HA  ))
      2.000     0.500     0.500 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.99380E-02 ppm1      8.185 ppm2      5.363 CV     1
 ASSI { 1492}
   (( segid "    " and resid 71   and name HN  ))
   (( segid "    " and resid 71   and name HB  ))
      4.200     2.200     1.800 peak  1492 spectrum    1 weight  0.10000E+01 volume  0.80939E-03 ppm1      8.182 ppm2      1.750 CV     1
 ASSI { 1493}
   (( segid "    " and resid 71   and name HN  ))
   (  segid "    " and resid 71   and name HG2%)
      2.800     1.000     1.000 peak  1493 spectrum    1 weight  0.10000E+01 volume  0.18013E-02 ppm1      8.182 ppm2      0.819 CV     1
 ASSI { 1496}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 123  and name HN  ))
      4.300     2.300     1.700 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.45839E-03 ppm1      8.118 ppm2      9.029 CV     1
 ASSI { 1497}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HN  ))
      2.600     0.900     0.900 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.22990E-02 ppm1      8.118 ppm2      8.633 CV     1
 ASSI { 1500}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 122  and name HA  ))
      4.400     2.400     1.600 peak  1500 spectrum    1 weight  0.10000E+01 volume  0.10238E-02 ppm1      8.118 ppm2      4.576 CV     1
 ASSI { 1502}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 125  and name HB1 ))
      2.900     1.000     1.000 peak  1502 spectrum    1 weight  0.10000E+01 volume  0.34141E-02 ppm1      8.118 ppm2      3.527 CV     1
 ASSI { 1503}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB2 ))
      4.200     2.200     1.800 peak  1503 spectrum    1 weight  0.10000E+01 volume  0.70243E-03 ppm1      8.118 ppm2      2.918 CV     1
 ASSI { 1504}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 124  and name HB1 ))
      4.500     2.600     1.500 peak  1504 spectrum    1 weight  0.10000E+01 volume  0.61822E-03 ppm1      8.118 ppm2      2.823 CV     1
 ASSI { 1505}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 131  and name HE1 ))
      5.100     3.200     0.900 peak  1505 spectrum    1 weight  0.10000E+01 volume  0.22336E-03 ppm1      8.116 ppm2      2.127 CV     1
 OR { 1505}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 131  and name HE2 ))
 ASSI { 1506}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.300     1.400     1.400 peak  1506 spectrum    1 weight  0.10000E+01 volume  0.62607E-03 ppm1      8.117 ppm2      1.598 CV     1
 ASSI { 1507}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 131  and name HG1 ))
      4.400     2.500     1.600 peak  1507 spectrum    1 weight  0.10000E+01 volume  0.72031E-03 ppm1      8.117 ppm2      1.447 CV     1
 OR { 1507}
   (( segid "    " and resid 125  and name HN  ))
   (( segid "    " and resid 131  and name HG2 ))
 ASSI { 1508}
   (( segid "    " and resid 125  and name HN  ))
   (  segid "    " and resid 129  and name HB% )
      3.700     1.800     1.800 peak  1508 spectrum    1 weight  0.10000E+01 volume  0.60814E-03 ppm1      8.118 ppm2      1.113 CV     1
 ASSI { 1510}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      4.900     3.000     1.100 peak  1510 spectrum    1 weight  0.10000E+01 volume  0.38460E-03 ppm1      8.780 ppm2      4.526 CV     1
 ASSI { 1513}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 150  and name HN  ))
      3.700     1.700     1.700 peak  1513 spectrum    1 weight  0.10000E+01 volume  0.47540E-03 ppm1      8.780 ppm2      7.010 CV     1
 ASSI { 1514}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      3.700     1.700     1.700 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.11033E-02 ppm1      8.780 ppm2      4.724 CV     1
 ASSI { 1515}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      3.200     1.300     1.300 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.13728E-02 ppm1      8.780 ppm2      4.036 CV     1
 ASSI { 1517}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HB2 ))
      3.500     3.500     2.500 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.90171E-03 ppm1      8.779 ppm2      2.914 CV     1
 ASSI { 1518}
   (( segid "    " and resid 149  and name HN  ))
   (( segid "    " and resid 148  and name HB1 ))
      3.600     1.600     1.600 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.62349E-03 ppm1      8.779 ppm2      2.677 CV     1
 ASSI { 1519}
   (( segid "    " and resid 149  and name HN  ))
   (  segid "    " and resid 150  and name HG2%)
      4.900     3.100     1.100 peak  1519 spectrum    1 weight  0.10000E+01 volume  0.25089E-03 ppm1      8.778 ppm2      1.028 CV     1
 ASSI { 1520}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HN  ))
      2.700     0.900     0.900 peak  1520 spectrum    1 weight  0.10000E+01 volume  0.30354E-02 ppm1      8.313 ppm2      8.642 CV     1
 ASSI { 1521}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HN  ))
      2.500     0.800     0.800 peak  1521 spectrum    1 weight  0.10000E+01 volume  0.45097E-02 ppm1      8.311 ppm2      7.414 CV     1
 ASSI { 1522}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HD21))
      3.900     1.900     1.900 peak  1522 spectrum    1 weight  0.10000E+01 volume  0.41451E-03 ppm1      8.310 ppm2      7.194 CV     1
 ASSI { 1523}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 53   and name HD% )
      4.900     3.000     1.100 peak  1523 spectrum    1 weight  0.10000E+01 volume  0.21214E-03 ppm1      8.311 ppm2      6.823 CV     1
 ASSI { 1524}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HD22))
      4.300     2.300     1.700 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.38855E-03 ppm1      8.315 ppm2      5.970 CV     1
 ASSI { 1529}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HA  ))
      2.700     0.900     0.900 peak  1529 spectrum    1 weight  0.10000E+01 volume  0.48612E-02 ppm1      8.310 ppm2      4.378 CV     1
 ASSI { 1531}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 53   and name HB2 ))
      5.300     3.500     0.700 peak  1531 spectrum    1 weight  0.10000E+01 volume  0.23409E-03 ppm1      8.313 ppm2      3.850 CV     1
 ASSI { 1532}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB1 ))
      3.300     1.400     1.400 peak  1532 spectrum    1 weight  0.10000E+01 volume  0.20620E-02 ppm1      8.310 ppm2      2.661 CV     1
 OR { 1532}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 51   and name HB2 ))
 ASSI { 1533}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HB1 ))
      2.600     0.900     0.900 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.47976E-02 ppm1      8.312 ppm2      2.347 CV     1
 OR { 1533}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 52   and name HB2 ))
 ASSI { 1534}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HG2 ))
      5.000     3.100     1.000 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.44501E-03 ppm1      8.312 ppm2      2.105 CV     1
 OR { 1534}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI { 1535}
   (( segid "    " and resid 52   and name HN  ))
   (( segid "    " and resid 50   and name HB1 ))
      3.500     1.500     1.500 peak  1535 spectrum    1 weight  0.10000E+01 volume  0.14483E-02 ppm1      8.311 ppm2      1.824 CV     1
 ASSI { 1536}
   (( segid "    " and resid 52   and name HN  ))
   (  segid "    " and resid 85   and name HG2%)
      4.700     2.800     1.300 peak  1536 spectrum    1 weight  0.10000E+01 volume  0.31308E-03 ppm1      8.313 ppm2      1.101 CV     1
 ASSI { 1541}
   (( segid "    " and resid 65   and name HN  ))
   (  segid "    " and resid 65   and name HD% )
      2.900     1.000     1.000 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.19849E-02 ppm1      8.062 ppm2      7.086 CV     1
 ASSI { 1543}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HA  ))
      3.000     1.200     1.200 peak  1543 spectrum    1 weight  0.10000E+01 volume  0.13343E-02 ppm1      8.061 ppm2      4.645 CV     1
 ASSI { 1545}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HD2 ))
      4.000     2.000     2.000 peak  1545 spectrum    1 weight  0.10000E+01 volume  0.10534E-02 ppm1      8.060 ppm2      3.030 CV     1
 OR { 1545}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HD1 ))
 ASSI { 1546}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      3.100     1.200     1.200 peak  1546 spectrum    1 weight  0.10000E+01 volume  0.19794E-02 ppm1      8.060 ppm2      2.790 CV     1
 ASSI { 1547}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB2 ))
      3.300     1.300     1.300 peak  1547 spectrum    1 weight  0.10000E+01 volume  0.35089E-03 ppm1      8.061 ppm2      2.524 CV     1
 ASSI { 1548}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      5.100     3.200     0.900 peak  1548 spectrum    1 weight  0.10000E+01 volume  0.26732E-03 ppm1      8.061 ppm2      1.832 CV     1
 ASSI { 1550}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 64   and name HB1 ))
      3.600     1.700     1.700 peak  1550 spectrum    1 weight  0.10000E+01 volume  0.79209E-03 ppm1      8.059 ppm2      0.998 CV     1
 ASSI { 1553}
   (( segid "    " and resid 65   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      3.400     1.400     1.400 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.13118E-02 ppm1      8.061 ppm2      3.758 CV     1
 ASSI { 1555}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 37   and name HN  ))
      3.500     1.500     1.500 peak  1555 spectrum    1 weight  0.10000E+01 volume  0.85112E-03 ppm1      7.759 ppm2      9.032 CV     1
 ASSI { 1556}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HN  ))
      2.500     0.800     0.800 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.42127E-02 ppm1      7.757 ppm2      8.878 CV     1
 ASSI { 1559}
   (( segid "    " and resid 36   and name HN  ))
   (  segid "    " and resid 35   and name HD% )
      4.600     2.600     1.400 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.42129E-03 ppm1      7.756 ppm2      6.175 CV     1
 ASSI { 1560}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.600     2.600     3.400 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.85092E-03 ppm1      7.759 ppm2      4.676 CV     1
 ASSI { 1561}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.500     0.800     0.800 peak  1561 spectrum    1 weight  0.10000E+01 volume  0.52115E-02 ppm1      7.757 ppm2      4.046 CV     1
 ASSI { 1562}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.300     0.700     0.700 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.10585E-01 ppm1      7.757 ppm2      3.876 CV     1
 OR { 1562}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 1563}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB2 ))
      3.800     1.800     1.800 peak  1563 spectrum    1 weight  0.10000E+01 volume  0.52524E-03 ppm1      7.760 ppm2      2.694 CV     1
 ASSI { 1564}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.700     1.700     1.700 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.62209E-03 ppm1      7.756 ppm2      2.195 CV     1
 ASSI { 1565}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HA  ))
      2.800     1.000     1.000 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.27128E-02 ppm1      7.758 ppm2      4.269 CV     1
 ASSI { 1567}
   (( segid "    " and resid 36   and name HN  ))
   (( segid "    " and resid 35   and name HB1 ))
      4.200     2.200     1.800 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.59364E-03 ppm1      7.757 ppm2      2.392 CV     1
 ASSI { 1572}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HN  ))
      3.600     1.600     1.600 peak  1572 spectrum    1 weight  0.10000E+01 volume  0.47343E-03 ppm1      8.911 ppm2      7.480 CV     1
 ASSI { 1574}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      2.700     0.900     0.900 peak  1574 spectrum    1 weight  0.10000E+01 volume  0.46598E-02 ppm1      8.910 ppm2      4.706 CV     1
 ASSI { 1575}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 36   and name HA  ))
      2.700     2.700     3.300 peak  1575 spectrum    1 weight  0.10000E+01 volume  0.57053E-02 ppm1      8.911 ppm2      4.085 CV     1
 ASSI { 1576}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      3.100     3.100     2.900 peak  1576 spectrum    1 weight  0.10000E+01 volume  0.25354E-03 ppm1      8.913 ppm2      3.853 CV     1
 OR { 1576}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1577}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB2 ))
      2.900     1.100     1.100 peak  1577 spectrum    1 weight  0.10000E+01 volume  0.59316E-02 ppm1      8.910 ppm2      3.304 CV     1
 ASSI { 1578}
   (( segid "    " and resid 40   and name HN  ))
   (( segid "    " and resid 39   and name HB1 ))
      2.600     0.800     0.800 peak  1578 spectrum    1 weight  0.10000E+01 volume  0.35321E-02 ppm1      8.911 ppm2      3.011 CV     1
 ASSI { 1583}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HN  ))
      2.600     0.800     0.800 peak  1583 spectrum    1 weight  0.10000E+01 volume  0.30362E-02 ppm1      8.350 ppm2     10.651 CV     1
 ASSI { 1584}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 118  and name HN  ))
      2.600     0.800     0.800 peak  1584 spectrum    1 weight  0.10000E+01 volume  0.42361E-02 ppm1      8.350 ppm2      8.058 CV     1
 ASSI { 1586}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 119  and name HN  ))
      4.200     2.200     1.800 peak  1586 spectrum    1 weight  0.10000E+01 volume  0.55483E-03 ppm1      8.350 ppm2      7.155 CV     1
 ASSI { 1588}
   (( segid "    " and resid 117  and name HN  ))
   (  segid "    " and resid 83   and name HE% )
      3.900     1.900     1.900 peak  1588 spectrum    1 weight  0.10000E+01 volume  0.65150E-03 ppm1      8.352 ppm2      6.427 CV     1
 ASSI { 1589}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HA  ))
      2.800     1.000     1.000 peak  1589 spectrum    1 weight  0.10000E+01 volume  0.27311E-02 ppm1      8.348 ppm2      4.292 CV     1
 ASSI { 1590}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 115  and name HA2 ))
      3.300     1.400     1.400 peak  1590 spectrum    1 weight  0.10000E+01 volume  0.76903E-03 ppm1      8.350 ppm2      3.879 CV     1
 ASSI { 1592}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB2 ))
      2.700     0.900     0.900 peak  1592 spectrum    1 weight  0.10000E+01 volume  0.22181E-02 ppm1      8.350 ppm2      3.044 CV     1
 ASSI { 1593}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 117  and name HB1 ))
      3.100     1.200     1.200 peak  1593 spectrum    1 weight  0.10000E+01 volume  0.30543E-02 ppm1      8.351 ppm2      2.866 CV     1
 ASSI { 1594}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HG1 ))
      3.600     1.700     1.700 peak  1594 spectrum    1 weight  0.10000E+01 volume  0.13126E-02 ppm1      8.350 ppm2      1.379 CV     1
 ASSI { 1595}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HB2 ))
      3.500     1.600     1.600 peak  1595 spectrum    1 weight  0.10000E+01 volume  0.99197E-03 ppm1      8.350 ppm2      1.208 CV     1
 ASSI { 1596}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 116  and name HB1 ))
      3.200     1.300     1.300 peak  1596 spectrum    1 weight  0.10000E+01 volume  0.12243E-02 ppm1      8.350 ppm2      0.920 CV     1
 ASSI { 1601}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 115  and name HN  ))
      5.400     3.600     0.600 peak  1601 spectrum    1 weight  0.10000E+01 volume  0.16411E-03 ppm1      8.352 ppm2      8.770 CV     1
 ASSI { 1602}
   (( segid "    " and resid 117  and name HN  ))
   (( segid "    " and resid 118  and name HA  ))
      5.100     3.300     0.900 peak  1602 spectrum    1 weight  0.10000E+01 volume  0.28134E-03 ppm1      8.348 ppm2      4.942 CV     1
 ASSI { 1605}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 124  and name HA  ))
      4.500     2.600     1.500 peak  1605 spectrum    1 weight  0.10000E+01 volume  0.29386E-03 ppm1      7.362 ppm2      5.017 CV     1
 ASSI { 1607}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 47   and name HN  ))
      5.100     3.200     0.900 peak  1607 spectrum    1 weight  0.10000E+01 volume  0.17681E-03 ppm1      7.225 ppm2      8.873 CV     1
 ASSI { 1610}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 43   and name HA  ))
      2.900     2.900     3.100 peak  1610 spectrum    1 weight  0.10000E+01 volume  0.21638E-02 ppm1      7.226 ppm2      4.221 CV     1
 ASSI { 1611}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 42   and name HA  ))
      3.200     3.200     2.800 peak  1611 spectrum    1 weight  0.10000E+01 volume  0.23722E-03 ppm1      7.227 ppm2      4.009 CV     1
 ASSI { 1612}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 44   and name HA  ))
      3.900     1.900     1.900 peak  1612 spectrum    1 weight  0.10000E+01 volume  0.50167E-03 ppm1      7.226 ppm2      3.806 CV     1
 ASSI { 1613}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB2 ))
      4.700     2.800     1.300 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.68937E-03 ppm1      7.226 ppm2      3.072 CV     1
 ASSI { 1614}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 45   and name HB1 ))
      3.300     1.300     1.300 peak  1614 spectrum    1 weight  0.10000E+01 volume  0.73079E-03 ppm1      7.224 ppm2      2.745 CV     1
 ASSI { 1618}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB2 ))
      3.500     1.500     1.500 peak  1618 spectrum    1 weight  0.10000E+01 volume  0.11733E-02 ppm1      8.805 ppm2      2.215 CV     1
 OR { 1618}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HG2 ))
 ASSI { 1620}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 34   and name HN  ))
      2.700     0.900     0.900 peak  1620 spectrum    1 weight  0.10000E+01 volume  0.34550E-02 ppm1      8.808 ppm2      7.652 CV     1
 ASSI { 1621}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HA  ))
      2.600     0.800     0.800 peak  1621 spectrum    1 weight  0.10000E+01 volume  0.47062E-02 ppm1      8.806 ppm2      4.712 CV     1
 ASSI { 1623}
   (( segid "    " and resid 33   and name HN  ))
   (( segid "    " and resid 32   and name HB1 ))
      3.100     1.200     1.200 peak  1623 spectrum    1 weight  0.10000E+01 volume  0.16303E-02 ppm1      8.805 ppm2      2.485 CV     1
 ASSI { 1624}
   (( segid "    " and resid 33   and name HN  ))
   (  segid "    " and resid 33   and name HG2%)
      3.300     1.300     1.300 peak  1624 spectrum    1 weight  0.10000E+01 volume  0.18479E-02 ppm1      8.806 ppm2      1.225 CV     1
 ASSI { 1627}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HN  ))
      3.100     3.100     2.900 peak  1627 spectrum    1 weight  0.10000E+01 volume  0.26734E-03 ppm1      7.363 ppm2      9.630 CV     1
 ASSI { 1629}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      4.600     2.600     1.400 peak  1629 spectrum    1 weight  0.10000E+01 volume  0.17318E-03 ppm1      7.363 ppm2      8.781 CV     1
 ASSI { 1632}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 133  and name HB  ))
      4.100     2.100     1.900 peak  1632 spectrum    1 weight  0.10000E+01 volume  0.60439E-03 ppm1      7.362 ppm2      4.352 CV     1
 ASSI { 1633}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 132  and name HB1 ))
      4.100     2.100     1.900 peak  1633 spectrum    1 weight  0.10000E+01 volume  0.36031E-03 ppm1      7.363 ppm2      3.804 CV     1
 ASSI { 1636}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HB2 ))
      3.300     1.400     1.400 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.93749E-03 ppm1      7.363 ppm2      2.117 CV     1
 ASSI { 1637}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.500     1.500     1.500 peak  1637 spectrum    1 weight  0.10000E+01 volume  0.46208E-02 ppm1      7.363 ppm2      1.636 CV     1
 ASSI { 1638}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HG2 ))
      2.600     0.900     0.900 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.24988E-02 ppm1      7.363 ppm2      1.482 CV     1
 OR { 1638}
   (( segid "    " and resid 133  and name HN  ))
   (( segid "    " and resid 131  and name HG1 ))
 ASSI { 1640}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.800     1.000     1.000 peak  1640 spectrum    1 weight  0.10000E+01 volume  0.25506E-02 ppm1      7.227 ppm2      4.822 CV     1
 ASSI { 1641}
   (( segid "    " and resid 46   and name HN  ))
   (( segid "    " and resid 43   and name HG  ))
      4.500     2.500     1.500 peak  1641 spectrum    1 weight  0.10000E+01 volume  0.26431E-03 ppm1      7.228 ppm2      1.607 CV     1
 ASSI { 1645}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 140  and name HN  ))
      4.500     2.500     1.500 peak  1645 spectrum    1 weight  0.10000E+01 volume  0.39755E-03 ppm1      7.206 ppm2      8.777 CV     1
 ASSI { 1647}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 141  and name HN  ))
      2.700     0.900     0.900 peak  1647 spectrum    1 weight  0.10000E+01 volume  0.26655E-02 ppm1      7.206 ppm2      8.055 CV     1
 ASSI { 1652}
   (( segid "    " and resid 142  and name HN  ))
   (  segid "    " and resid 141  and name HB% )
      2.700     0.900     0.900 peak  1652 spectrum    1 weight  0.10000E+01 volume  0.38079E-02 ppm1      7.206 ppm2      1.430 CV     1
 ASSI { 1654}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HN  ))
      3.000     1.100     1.100 peak  1654 spectrum    1 weight  0.10000E+01 volume  0.15799E-02 ppm1      8.112 ppm2      8.610 CV     1
 ASSI { 1656}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      2.800     1.000     1.000 peak  1656 spectrum    1 weight  0.10000E+01 volume  0.32061E-02 ppm1      8.114 ppm2      4.788 CV     1
 ASSI { 1658}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HB2 ))
      4.100     2.100     1.900 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.69622E-03 ppm1      8.114 ppm2      3.134 CV     1
 ASSI { 1659}
   (( segid "    " and resid 78   and name HN  ))
   (( segid "    " and resid 77   and name HB1 ))
      3.500     1.500     1.500 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.76748E-03 ppm1      8.114 ppm2      2.885 CV     1
 ASSI { 1661}
   (( segid "    " and resid 78   and name HN  ))
   (  segid "    " and resid 78   and name HG2%)
      2.700     0.900     0.900 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.37532E-02 ppm1      8.114 ppm2      1.290 CV     1
 ASSI { 1663}
   (( segid "    " and resid 142  and name HN  ))
   (( segid "    " and resid 125  and name HA  ))
      5.200     3.400     0.800 peak  1663 spectrum    1 weight  0.10000E+01 volume  0.20891E-03 ppm1      7.207 ppm2      4.770 CV     1
 ASSI { 1664}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 81   and name HN  ))
      4.300     2.300     1.700 peak  1664 spectrum    1 weight  0.10000E+01 volume  0.62126E-03 ppm1      7.334 ppm2      8.763 CV     1
 ASSI { 1666}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HD% )
      4.100     2.200     1.900 peak  1666 spectrum    1 weight  0.10000E+01 volume  0.21995E-03 ppm1      7.332 ppm2      6.138 CV     1
 ASSI { 1667}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 77   and name HA  ))
      3.300     1.300     1.300 peak  1667 spectrum    1 weight  0.10000E+01 volume  0.14032E-02 ppm1      7.333 ppm2      4.755 CV     1
 ASSI { 1668}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HA  ))
      2.600     0.900     0.900 peak  1668 spectrum    1 weight  0.10000E+01 volume  0.31586E-02 ppm1      7.333 ppm2      4.560 CV     1
 ASSI { 1669}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 79   and name HA  ))
      3.400     1.500     1.500 peak  1669 spectrum    1 weight  0.10000E+01 volume  0.17636E-02 ppm1      7.332 ppm2      4.414 CV     1
 ASSI { 1671}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB2 ))
      3.000     1.100     1.100 peak  1671 spectrum    1 weight  0.10000E+01 volume  0.88088E-03 ppm1      7.336 ppm2      3.537 CV     1
 ASSI { 1672}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      3.800     1.800     1.800 peak  1672 spectrum    1 weight  0.10000E+01 volume  0.87433E-03 ppm1      7.335 ppm2      2.770 CV     1
 ASSI { 1673}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 79   and name HB% )
      2.500     0.800     0.800 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.56715E-02 ppm1      7.333 ppm2      1.681 CV     1
 ASSI { 1678}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HN  ))
      2.700     0.900     0.900 peak  1678 spectrum    1 weight  0.10000E+01 volume  0.34768E-02 ppm1      8.631 ppm2      8.819 CV     1
 ASSI { 1679}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HD21))
      4.600     2.700     1.400 peak  1679 spectrum    1 weight  0.10000E+01 volume  0.22154E-03 ppm1      8.628 ppm2      7.759 CV     1
 ASSI { 1680}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HD22))
      3.700     1.700     1.700 peak  1680 spectrum    1 weight  0.10000E+01 volume  0.66176E-03 ppm1      8.629 ppm2      6.864 CV     1
 ASSI { 1681}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.600     1.600     1.600 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.15630E-02 ppm1      8.629 ppm2      4.814 CV     1
 ASSI { 1682}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HA  ))
      2.900     1.100     1.100 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.18487E-02 ppm1      8.629 ppm2      4.422 CV     1
 ASSI { 1684}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 103  and name HA1 ))
      2.500     0.800     0.800 peak  1684 spectrum    1 weight  0.10000E+01 volume  0.60516E-02 ppm1      8.630 ppm2      3.907 CV     1
 ASSI { 1685}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HB2 ))
      4.700     2.700     1.300 peak  1685 spectrum    1 weight  0.10000E+01 volume  0.32754E-03 ppm1      8.629 ppm2      3.126 CV     1
 ASSI { 1686}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 101  and name HB1 ))
      4.500     2.600     1.500 peak  1686 spectrum    1 weight  0.10000E+01 volume  0.25673E-03 ppm1      8.632 ppm2      2.531 CV     1
 ASSI { 1687}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB2 ))
      3.700     1.700     1.700 peak  1687 spectrum    1 weight  0.10000E+01 volume  0.90437E-03 ppm1      8.632 ppm2      1.649 CV     1
 OR { 1687}
   (( segid "    " and resid 103  and name HN  ))
   (( segid "    " and resid 102  and name HB1 ))
 ASSI { 1688}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 106  and name HB% )
      3.700     1.700     1.700 peak  1688 spectrum    1 weight  0.10000E+01 volume  0.72873E-03 ppm1      8.629 ppm2      1.108 CV     1
 ASSI { 1689}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 102  and name HD1%)
      4.700     2.800     1.300 peak  1689 spectrum    1 weight  0.10000E+01 volume  0.44123E-03 ppm1      8.630 ppm2      0.660 CV     1
 ASSI { 1690}
   (( segid "    " and resid 103  and name HN  ))
   (  segid "    " and resid 102  and name HD2%)
      5.400     3.700     0.600 peak  1690 spectrum    1 weight  0.10000E+01 volume  0.21321E-03 ppm1      8.634 ppm2      0.526 CV     1
 ASSI { 1694}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HN  ))
      4.700     2.800     1.300 peak  1694 spectrum    1 weight  0.10000E+01 volume  0.27241E-03 ppm1      7.898 ppm2      9.183 CV     1
 ASSI { 1695}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HN  ))
      5.300     3.500     0.700 peak  1695 spectrum    1 weight  0.10000E+01 volume  0.16391E-03 ppm1      7.898 ppm2      8.889 CV     1
 ASSI { 1698}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HH11))
      4.000     2.000     2.000 peak  1698 spectrum    1 weight  0.10000E+01 volume  0.16597E-02 ppm1      7.898 ppm2      6.645 CV     1
 OR { 1698}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 88   and name HH12))
 ASSI { 1699}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HA  ))
      2.300     0.600     0.600 peak  1699 spectrum    1 weight  0.10000E+01 volume  0.48102E-02 ppm1      7.898 ppm2      5.620 CV     1
 ASSI { 1701}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HA  ))
      3.000     1.100     1.100 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.86003E-03 ppm1      7.898 ppm2      4.887 CV     1
 ASSI { 1702}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 87   and name HB  ))
      4.400     2.500     1.600 peak  1702 spectrum    1 weight  0.10000E+01 volume  0.31706E-03 ppm1      7.898 ppm2      4.585 CV     1
 ASSI { 1704}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 68   and name HB2 ))
      3.400     1.400     1.400 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.46271E-03 ppm1      7.898 ppm2      2.076 CV     1
 ASSI { 1705}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB2 ))
      4.100     2.100     1.900 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.83219E-03 ppm1      7.898 ppm2      1.797 CV     1
 ASSI { 1706}
   (( segid "    " and resid 87   and name HN  ))
   (( segid "    " and resid 86   and name HB1 ))
      4.000     2.000     2.000 peak  1706 spectrum    1 weight  0.10000E+01 volume  0.73641E-03 ppm1      7.899 ppm2      1.475 CV     1
 ASSI { 1707}
   (( segid "    " and resid 87   and name HN  ))
   (  segid "    " and resid 87   and name HG2%)
      2.700     0.900     0.900 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.30371E-02 ppm1      7.898 ppm2      1.081 CV     1
 ASSI { 1709}
   (( segid "    " and resid 80   and name HN  ))
   (  segid "    " and resid 80   and name HE% )
      5.300     3.600     0.700 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.21229E-03 ppm1      7.336 ppm2      6.387 CV     1
 ASSI { 1710}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      6.000     4.900     0.000 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.18981E-03 ppm1      7.333 ppm2      1.047 CV     1
 OR { 1710}
   (( segid "    " and resid 80   and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
 ASSI { 1712}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 155  and name HD% )
      5.800     4.200     0.200 peak  1712 spectrum    1 weight  0.10000E+01 volume  0.19852E-03 ppm1      9.483 ppm2      7.223 CV     1
 ASSI { 1713}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 111  and name HA  ))
      4.000     2.000     2.000 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.24831E-03 ppm1      9.481 ppm2      4.772 CV     1
 ASSI { 1714}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 155  and name HA  ))
      3.200     1.300     1.300 peak  1714 spectrum    1 weight  0.10000E+01 volume  0.68218E-03 ppm1      9.477 ppm2      4.551 CV     1
 ASSI { 1716}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 109  and name HD% )
      3.900     1.900     1.900 peak  1716 spectrum    1 weight  0.10000E+01 volume  0.33740E-03 ppm1      9.477 ppm2      7.067 CV     1
 ASSI { 1719}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      2.200     0.600     0.600 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.45948E-02 ppm1      9.478 ppm2      5.505 CV     1
 ASSI { 1720}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 154  and name HA  ))
      3.500     3.500     2.500 peak  1720 spectrum    1 weight  0.10000E+01 volume  0.16720E-02 ppm1      9.476 ppm2      5.192 CV     1
 ASSI { 1721}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 130  and name HA  ))
      5.100     3.200     0.900 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.34195E-03 ppm1      9.476 ppm2      4.885 CV     1
 ASSI { 1722}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 110  and name HA1 ))
      2.600     0.800     0.800 peak  1722 spectrum    1 weight  0.10000E+01 volume  0.16939E-02 ppm1      9.476 ppm2      4.113 CV     1
 ASSI { 1723}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 109  and name HB2 ))
      3.700     1.700     1.700 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.15280E-02 ppm1      9.476 ppm2      3.046 CV     1
 ASSI { 1724}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 155  and name HB2 ))
      4.100     2.100     1.900 peak  1724 spectrum    1 weight  0.10000E+01 volume  0.58551E-03 ppm1      9.476 ppm2      2.805 CV     1
 ASSI { 1727}
   (( segid "    " and resid 110  and name HN  ))
   (( segid "    " and resid 131  and name HD1 ))
      4.300     2.300     1.700 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.47142E-03 ppm1      9.476 ppm2      1.388 CV     1
 ASSI { 1728}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 153  and name HG2%)
      4.600     2.600     1.400 peak  1728 spectrum    1 weight  0.10000E+01 volume  0.20931E-03 ppm1      9.477 ppm2      1.102 CV     1
 OR { 1728}
   (( segid "    " and resid 110  and name HN  ))
   (  segid "    " and resid 153  and name HG1%)
 ASSI { 1733}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 24   and name HN  ))
      5.100     3.300     0.900 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.19606E-03 ppm1      8.386 ppm2      8.090 CV     1
 ASSI { 1734}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      2.500     0.800     0.800 peak  1734 spectrum    1 weight  0.10000E+01 volume  0.36395E-02 ppm1      8.384 ppm2      7.782 CV     1
 ASSI { 1736}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 22   and name HA  ))
      2.400     0.700     0.700 peak  1736 spectrum    1 weight  0.10000E+01 volume  0.58812E-02 ppm1      8.385 ppm2      4.340 CV     1
 ASSI { 1738}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 18   and name HA  ))
      4.300     2.300     1.700 peak  1738 spectrum    1 weight  0.10000E+01 volume  0.49127E-03 ppm1      8.385 ppm2      3.396 CV     1
 ASSI { 1739}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 19   and name HB1 ))
      3.200     3.200     2.800 peak  1739 spectrum    1 weight  0.10000E+01 volume  0.24547E-03 ppm1      8.385 ppm2      2.216 CV     1
 OR { 1739}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 19   and name HB2 ))
 ASSI { 1740}
   (( segid "    " and resid 22   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
      4.700     2.700     1.300 peak  1740 spectrum    1 weight  0.10000E+01 volume  0.35673E-03 ppm1      8.385 ppm2      1.788 CV     1
 ASSI { 1742}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 18   and name HG1%)
      2.500     2.500     3.500 peak  1742 spectrum    1 weight  0.10000E+01 volume  0.10402E-02 ppm1      8.385 ppm2      0.913 CV     1
 OR { 1742}
   (( segid "    " and resid 22   and name HN  ))
   (  segid "    " and resid 18   and name HG2%)
 ASSI { 1744}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 157  and name HN  ))
      4.700     2.800     1.300 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.23970E-03 ppm1      8.775 ppm2      9.161 CV     1
 ASSI { 1746}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 156  and name HZ  ))
      4.400     2.400     1.600 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.72824E-03 ppm1      8.775 ppm2      7.170 CV     1
 ASSI { 1748}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 35   and name HD% )
      4.600     2.600     1.400 peak  1748 spectrum    1 weight  0.10000E+01 volume  0.34819E-03 ppm1      8.783 ppm2      6.184 CV     1
 ASSI { 1750}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 81   and name HA1 ))
      2.400     0.700     0.700 peak  1750 spectrum    1 weight  0.10000E+01 volume  0.36146E-02 ppm1      8.772 ppm2      3.977 CV     1
 ASSI { 1752}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 80   and name HB1 ))
      2.400     0.700     0.700 peak  1752 spectrum    1 weight  0.10000E+01 volume  0.20537E-02 ppm1      8.776 ppm2      2.758 CV     1
 ASSI { 1756}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 107  and name HG2 ))
      5.200     3.400     0.800 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.19915E-03 ppm1      8.776 ppm2      0.717 CV     1
 OR { 1756}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 107  and name HG1 ))
 ASSI { 1757}
   (( segid "    " and resid 81   and name HN  ))
   (  segid "    " and resid 74   and name HB% )
      4.500     2.600     1.500 peak  1757 spectrum    1 weight  0.10000E+01 volume  0.24513E-03 ppm1      8.776 ppm2      0.109 CV     1
 ASSI { 1758}
   (( segid "    " and resid 81   and name HN  ))
   (( segid "    " and resid 107  and name HB1 ))
      5.200     3.400     0.800 peak  1758 spectrum    1 weight  0.10000E+01 volume  0.27535E-03 ppm1      8.776 ppm2      1.025 CV     1
 ASSI { 1759}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 67   and name HN  ))
      2.300     0.600     0.600 peak  1759 spectrum    1 weight  0.10000E+01 volume  0.39766E-02 ppm1      8.118 ppm2      7.237 CV     1
 ASSI { 1760}
   (( segid "    " and resid 66   and name HN  ))
   (  segid "    " and resid 65   and name HD% )
      4.800     2.900     1.200 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.25138E-03 ppm1      8.116 ppm2      7.070 CV     1
 ASSI { 1761}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA2 ))
      3.000     1.100     1.100 peak  1761 spectrum    1 weight  0.10000E+01 volume  0.24961E-02 ppm1      8.118 ppm2      4.521 CV     1
 ASSI { 1762}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HA  ))
      4.700     2.700     1.300 peak  1762 spectrum    1 weight  0.10000E+01 volume  0.78092E-03 ppm1      8.118 ppm2      4.376 CV     1
 ASSI { 1763}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 66   and name HA1 ))
      2.400     0.700     0.700 peak  1763 spectrum    1 weight  0.10000E+01 volume  0.37466E-02 ppm1      8.118 ppm2      3.888 CV     1
 ASSI { 1764}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      4.000     2.000     2.000 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.46561E-03 ppm1      8.118 ppm2      3.741 CV     1
 ASSI { 1765}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HD2 ))
      5.100     3.300     0.900 peak  1765 spectrum    1 weight  0.10000E+01 volume  0.29675E-03 ppm1      8.118 ppm2      3.010 CV     1
 OR { 1765}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 64   and name HD1 ))
 ASSI { 1766}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 65   and name HB1 ))
      4.300     2.300     1.700 peak  1766 spectrum    1 weight  0.10000E+01 volume  0.50711E-03 ppm1      8.118 ppm2      2.814 CV     1
 ASSI { 1767}
   (( segid "    " and resid 66   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      6.000     4.700     0.000 peak  1767 spectrum    1 weight  0.10000E+01 volume  0.16348E-03 ppm1      8.117 ppm2      1.750 CV     1
 ASSI { 1772}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 88   and name HH11))
      3.000     3.000     3.000 peak  1772 spectrum    1 weight  0.10000E+01 volume  0.52954E-03 ppm1      7.242 ppm2      6.612 CV     1
 OR { 1772}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 88   and name HH12))
 ASSI { 1773}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 67   and name HA2 ))
      2.900     1.100     1.100 peak  1773 spectrum    1 weight  0.10000E+01 volume  0.22597E-02 ppm1      7.242 ppm2      4.423 CV     1
 ASSI { 1775}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 65   and name HB2 ))
      4.100     2.100     1.900 peak  1775 spectrum    1 weight  0.10000E+01 volume  0.51204E-03 ppm1      7.242 ppm2      3.729 CV     1
 ASSI { 1776}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 88   and name HD1 ))
      4.800     2.800     1.200 peak  1776 spectrum    1 weight  0.10000E+01 volume  0.37074E-03 ppm1      7.241 ppm2      3.199 CV     1
 OR { 1776}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 88   and name HD2 ))
 ASSI { 1778}
   (( segid "    " and resid 67   and name HN  ))
   (( segid "    " and resid 88   and name HB2 ))
      4.300     2.300     1.700 peak  1778 spectrum    1 weight  0.10000E+01 volume  0.71664E-03 ppm1      7.242 ppm2      2.082 CV     1
 ASSI { 1783}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 83   and name HB2 ))
      5.100     3.200     0.900 peak  1783 spectrum    1 weight  0.10000E+01 volume  0.20006E-03 ppm1      6.654 ppm2      2.341 CV     1
 ASSI { 1784}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HB1 ))
      5.000     3.100     1.000 peak  1784 spectrum    1 weight  0.10000E+01 volume  0.25159E-03 ppm1      6.658 ppm2      2.146 CV     1
 OR { 1784}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 1785}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 85   and name HN  ))
      5.100     3.300     0.900 peak  1785 spectrum    1 weight  0.10000E+01 volume  0.21715E-03 ppm1      6.654 ppm2      9.808 CV     1
 ASSI { 1787}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HN  ))
      4.400     2.400     1.600 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.74600E-03 ppm1      6.653 ppm2      8.174 CV     1
 ASSI { 1789}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HA  ))
      2.100     0.500     0.500 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.92606E-02 ppm1      6.654 ppm2      5.264 CV     1
 ASSI { 1791}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 72   and name HA1 ))
      2.800     1.000     1.000 peak  1791 spectrum    1 weight  0.10000E+01 volume  0.21705E-02 ppm1      6.654 ppm2      3.799 CV     1
 ASSI { 1792}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 71   and name HB  ))
      2.700     0.900     0.900 peak  1792 spectrum    1 weight  0.10000E+01 volume  0.36753E-02 ppm1      6.656 ppm2      1.755 CV     1
 ASSI { 1793}
   (( segid "    " and resid 72   and name HN  ))
   (( segid "    " and resid 84   and name HB1 ))
      5.400     3.600     0.600 peak  1793 spectrum    1 weight  0.10000E+01 volume  0.31124E-03 ppm1      6.656 ppm2      1.508 CV     1
 ASSI { 1795}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 71   and name HG2%)
      3.700     1.700     1.700 peak  1795 spectrum    1 weight  0.10000E+01 volume  0.19487E-02 ppm1      6.658 ppm2      0.814 CV     1
 ASSI { 1796}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 71   and name HG1%)
      4.000     2.000     2.000 peak  1796 spectrum    1 weight  0.10000E+01 volume  0.18254E-02 ppm1      6.658 ppm2      0.572 CV     1
 ASSI { 1797}
   (( segid "    " and resid 72   and name HN  ))
   (  segid "    " and resid 38   and name HD2%)
      2.400     2.400     3.600 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.14089E-02 ppm1      6.657 ppm2      0.186 CV     1
 ASSI { 1799}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 148  and name HA  ))
      4.900     3.000     1.100 peak  1799 spectrum    1 weight  0.10000E+01 volume  0.17471E-03 ppm1      7.016 ppm2      4.774 CV     1
 ASSI { 1800}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 150  and name HA  ))
      3.700     1.700     1.700 peak  1800 spectrum    1 weight  0.10000E+01 volume  0.46034E-03 ppm1      7.017 ppm2      4.572 CV     1
 ASSI { 1803}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HB1 ))
      4.800     2.800     1.200 peak  1803 spectrum    1 weight  0.10000E+01 volume  0.19339E-03 ppm1      7.019 ppm2      3.853 CV     1
 OR { 1803}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 149  and name HB2 ))
 ASSI { 1804}
   (( segid "    " and resid 150  and name HN  ))
   (  segid "    " and resid 150  and name HG2%)
      3.800     1.800     1.800 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.60195E-03 ppm1      7.021 ppm2      1.018 CV     1
 ASSI { 1806}
   (( segid "    " and resid 150  and name HN  ))
   (( segid "    " and resid 148  and name HB2 ))
      5.600     4.000     0.400 peak  1806 spectrum    1 weight  0.10000E+01 volume  0.16378E-03 ppm1      7.014 ppm2      2.913 CV     1
 ASSI { 1808}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 25   and name HN  ))
      4.300     2.300     1.700 peak  1808 spectrum    1 weight  0.10000E+01 volume  0.40416E-03 ppm1      7.848 ppm2      8.372 CV     1
 ASSI { 1809}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HA  ))
      3.500     1.500     1.500 peak  1809 spectrum    1 weight  0.10000E+01 volume  0.90709E-03 ppm1      7.848 ppm2      4.621 CV     1
 ASSI { 1810}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 24   and name HA  ))
      3.000     1.100     1.100 peak  1810 spectrum    1 weight  0.10000E+01 volume  0.16329E-02 ppm1      7.848 ppm2      4.186 CV     1
 ASSI { 1811}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA2 ))
      2.300     0.700     0.700 peak  1811 spectrum    1 weight  0.10000E+01 volume  0.89294E-02 ppm1      7.847 ppm2      3.965 CV     1
 OR { 1811}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 27   and name HA1 ))
 ASSI { 1812}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 25   and name HA  ))
      4.100     2.100     1.900 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.33963E-03 ppm1      7.849 ppm2      3.510 CV     1
 ASSI { 1813}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HB2 ))
      3.300     1.300     1.300 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.24894E-02 ppm1      7.847 ppm2      3.119 CV     1
 ASSI { 1814}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 26   and name HB1 ))
      2.800     1.000     1.000 peak  1814 spectrum    1 weight  0.10000E+01 volume  0.24566E-02 ppm1      7.847 ppm2      2.925 CV     1
 ASSI { 1815}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HB2 ))
      4.800     2.800     1.200 peak  1815 spectrum    1 weight  0.10000E+01 volume  0.47007E-03 ppm1      7.848 ppm2      1.929 CV     1
 ASSI { 1816}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 25   and name HB  ))
      5.100     3.300     0.900 peak  1816 spectrum    1 weight  0.10000E+01 volume  0.30890E-03 ppm1      7.848 ppm2      1.740 CV     1
 ASSI { 1817}
   (( segid "    " and resid 27   and name HN  ))
   (( segid "    " and resid 28   and name HG  ))
      4.500     2.600     1.500 peak  1817 spectrum    1 weight  0.10000E+01 volume  0.34974E-03 ppm1      7.848 ppm2      1.640 CV     1
 ASSI { 1818}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 24   and name HB% )
      3.000     3.000     3.000 peak  1818 spectrum    1 weight  0.10000E+01 volume  0.35369E-03 ppm1      7.848 ppm2      1.474 CV     1
 ASSI { 1820}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 30   and name HD1%)
      5.200     3.400     0.800 peak  1820 spectrum    1 weight  0.10000E+01 volume  0.41227E-03 ppm1      7.848 ppm2      0.960 CV     1
 OR { 1820}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 30   and name HG2%)
 ASSI { 1821}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 28   and name HD1%)
      5.100     3.300     0.900 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.39984E-03 ppm1      7.849 ppm2      0.814 CV     1
 OR { 1821}
   (( segid "    " and resid 27   and name HN  ))
   (  segid "    " and resid 28   and name HD2%)
 ASSI { 1824}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 158  and name HN  ))
      6.000     4.500     0.000 peak  1824 spectrum    1 weight  0.10000E+01 volume  0.28091E-03 ppm1      7.511 ppm2      8.133 CV     1
 ASSI { 1825}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 80   and name HD% )
      5.600     3.900     0.400 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.17075E-03 ppm1      7.513 ppm2      6.139 CV     1
 ASSI { 1827}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 109  and name HA  ))
      4.200     2.200     1.800 peak  1827 spectrum    1 weight  0.10000E+01 volume  0.21527E-03 ppm1      7.511 ppm2      5.510 CV     1
 ASSI { 1829}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HG1 ))
      4.800     2.800     1.200 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.39274E-03 ppm1      7.512 ppm2      0.723 CV     1
 OR { 1829}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HG2 ))
 ASSI { 1831}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HN  ))
      1.900     0.500     0.500 peak  1831 spectrum    1 weight  0.10000E+01 volume  0.66809E-02 ppm1      7.510 ppm2      9.399 CV     1
 ASSI { 1832}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 109  and name HN  ))
      4.100     2.100     1.900 peak  1832 spectrum    1 weight  0.10000E+01 volume  0.70819E-03 ppm1      7.511 ppm2      8.770 CV     1
 ASSI { 1834}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 156  and name HD% )
      5.000     3.100     1.000 peak  1834 spectrum    1 weight  0.10000E+01 volume  0.33900E-03 ppm1      7.511 ppm2      6.789 CV     1
 ASSI { 1835}
   (( segid "    " and resid 108  and name HN  ))
   (  segid "    " and resid 80   and name HE% )
      4.200     2.200     1.800 peak  1835 spectrum    1 weight  0.10000E+01 volume  0.43536E-03 ppm1      7.513 ppm2      6.366 CV     1
 ASSI { 1836}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 157  and name HA  ))
      3.500     1.500     1.500 peak  1836 spectrum    1 weight  0.10000E+01 volume  0.15683E-02 ppm1      7.511 ppm2      4.915 CV     1
 ASSI { 1837}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 108  and name HA2 ))
      2.800     1.000     1.000 peak  1837 spectrum    1 weight  0.10000E+01 volume  0.18614E-02 ppm1      7.511 ppm2      4.221 CV     1
 ASSI { 1839}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 155  and name HB2 ))
      4.000     2.000     2.000 peak  1839 spectrum    1 weight  0.10000E+01 volume  0.33479E-03 ppm1      7.509 ppm2      2.817 CV     1
 ASSI { 1840}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 156  and name HB2 ))
      3.000     1.100     1.100 peak  1840 spectrum    1 weight  0.10000E+01 volume  0.21107E-02 ppm1      7.511 ppm2      2.360 CV     1
 ASSI { 1841}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 156  and name HB1 ))
      3.200     1.300     1.300 peak  1841 spectrum    1 weight  0.10000E+01 volume  0.13201E-02 ppm1      7.512 ppm2      1.859 CV     1
 ASSI { 1844}
   (( segid "    " and resid 108  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      2.500     0.800     0.800 peak  1844 spectrum    1 weight  0.10000E+01 volume  0.43613E-02 ppm1      7.511 ppm2      1.079 CV     1
 ASSI { 1845}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 98   and name HN  ))
      2.600     0.800     0.800 peak  1845 spectrum    1 weight  0.10000E+01 volume  0.31586E-02 ppm1      6.799 ppm2      9.583 CV     1
 ASSI { 1847}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 96   and name HN  ))
      4.700     2.700     1.300 peak  1847 spectrum    1 weight  0.10000E+01 volume  0.20328E-03 ppm1      6.802 ppm2      7.826 CV     1
 ASSI { 1852}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 96   and name HA  ))
      3.000     1.200     1.200 peak  1852 spectrum    1 weight  0.10000E+01 volume  0.15690E-02 ppm1      6.798 ppm2      4.048 CV     1
 ASSI { 1853}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 95   and name HA  ))
      4.300     2.300     1.700 peak  1853 spectrum    1 weight  0.10000E+01 volume  0.41098E-03 ppm1      6.801 ppm2      3.402 CV     1
 ASSI { 1855}
   (( segid "    " and resid 99   and name HN  ))
   (( segid "    " and resid 97   and name HB1 ))
      4.100     2.100     1.900 peak  1855 spectrum    1 weight  0.10000E+01 volume  0.33952E-03 ppm1      6.802 ppm2      1.778 CV     1
 ASSI { 1858}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 99   and name HG2%)
      2.600     2.600     3.400 peak  1858 spectrum    1 weight  0.10000E+01 volume  0.42780E-02 ppm1      6.798 ppm2      1.028 CV     1
 ASSI { 1859}
   (( segid "    " and resid 99   and name HN  ))
   (  segid "    " and resid 95   and name HG1%)
      3.400     1.500     1.500 peak  1859 spectrum    1 weight  0.10000E+01 volume  0.11911E-02 ppm1      6.801 ppm2      0.869 CV     1
 ASSI { 1861}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 13   and name HD22))
      4.000     2.000     2.000 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.12747E-02 ppm1      8.390 ppm2      7.162 CV     1
 ASSI { 1862}
   (( segid "    " and resid 11   and name HN  ))
   (( segid "    " and resid 10   and name HA  ))
      3.400     1.400     1.400 peak  1862 spectrum    1 weight  0.10000E+01 volume  0.11327E-02 ppm1      8.388 ppm2      3.853 CV     1
 ASSI { 1863}
   (( segid "    " and resid 13   and name HN  ))
   (( segid "    " and resid 10   and name HB1 ))
      4.600     2.600     1.400 peak  1863 spectrum    1 weight  0.10000E+01 volume  0.32537E-03 ppm1      8.376 ppm2      0.920 CV     1
 ASSI { 1865}
   (( segid "    " and resid 16   and name HN  ))
   (( segid "    " and resid 14   and name HN  ))
      4.200     2.200     1.800 peak  1865 spectrum    1 weight  0.10000E+01 volume  0.39766E-03 ppm1      8.230 ppm2      8.579 CV     1
 ASSI { 1874}
   (( segid "    " and resid 25   and name HN  ))
   (( segid "    " and resid 23   and name HN  ))
      5.000     3.100     1.000 peak  1874 spectrum    1 weight  0.10000E+01 volume  0.23202E-03 ppm1      8.365 ppm2      7.798 CV     1
 ASSI { 1876}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 28   and name HN  ))
      4.400     2.400     1.600 peak  1876 spectrum    1 weight  0.10000E+01 volume  0.44936E-03 ppm1      7.122 ppm2      7.913 CV     1
 ASSI { 1877}
   (( segid "    " and resid 30   and name HN  ))
   (( segid "    " and resid 29   and name HB1 ))
      3.900     1.900     1.900 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.61040E-03 ppm1      7.127 ppm2      2.653 CV     1
 ASSI { 1879}
   (( segid "    " and resid 62   and name HN  ))
   (( segid "    " and resid 61   and name HB  ))
      3.100     1.200     1.200 peak  1879 spectrum    1 weight  0.10000E+01 volume  0.58287E-03 ppm1      8.810 ppm2      1.522 CV     1
 ASSI { 1882}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 123  and name HA1 ))
      2.900     1.000     1.000 peak  1882 spectrum    1 weight  0.10000E+01 volume  0.13038E-02 ppm1      8.630 ppm2      3.758 CV     1
 ASSI { 1883}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HB2 ))
      4.000     2.000     2.000 peak  1883 spectrum    1 weight  0.10000E+01 volume  0.57451E-03 ppm1      8.631 ppm2      2.913 CV     1
 ASSI { 1884}
   (( segid "    " and resid 124  and name HN  ))
   (( segid "    " and resid 124  and name HB1 ))
      3.700     1.700     1.700 peak  1884 spectrum    1 weight  0.10000E+01 volume  0.67052E-03 ppm1      8.632 ppm2      2.831 CV     1
 ASSI { 1885}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 58   and name HA  ))
      3.300     1.400     1.400 peak  1885 spectrum    1 weight  0.10000E+01 volume  0.85210E-03 ppm1      7.672 ppm2      4.750 CV     1
 ASSI { 1886}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HE1 ))
      4.300     2.300     1.700 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.52046E-03 ppm1      7.672 ppm2      3.021 CV     1
 OR { 1886}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 59   and name HE2 ))
 ASSI { 1887}
   (( segid "    " and resid 59   and name HN  ))
   (( segid "    " and resid 55   and name HB1 ))
      3.100     1.200     1.200 peak  1887 spectrum    1 weight  0.10000E+01 volume  0.60292E-03 ppm1      7.670 ppm2      2.460 CV     1
 ASSI { 1888}
   (( segid "    " and resid 151  and name HN  ))
   (  segid "    " and resid 150  and name HG2%)
      4.800     2.900     1.200 peak  1888 spectrum    1 weight  0.10000E+01 volume  0.46403E-03 ppm1      8.549 ppm2      0.999 CV     1
 ASSI { 1890}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HB2 ))
      3.200     1.300     1.300 peak  1890 spectrum    1 weight  0.10000E+01 volume  0.12246E-02 ppm1      8.550 ppm2      2.706 CV     1
 OR { 1890}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 151  and name HB1 ))
 ASSI { 1891}
   (( segid "    " and resid 151  and name HN  ))
   (( segid "    " and resid 149  and name HA  ))
      3.900     1.900     1.900 peak  1891 spectrum    1 weight  0.10000E+01 volume  0.42742E-03 ppm1      8.551 ppm2      4.034 CV     1
 ASSI { 1893}
   (( segid "    " and resid 107  and name HN  ))
   (( segid "    " and resid 156  and name HN  ))
      5.200     3.400     0.800 peak  1893 spectrum    1 weight  0.10000E+01 volume  0.11228E-03 ppm1      9.392 ppm2      8.439 CV     1
 ASSI { 1896}
   (( segid "    " and resid 101  and name HN  ))
   (( segid "    " and resid 100  and name HG  ))
      3.400     1.400     1.400 peak  1896 spectrum    1 weight  0.10000E+01 volume  0.19808E-02 ppm1      8.325 ppm2      1.501 CV     1
 ASSI { 1897}
   (( segid "    " and resid 82   and name HN  ))
   (  segid "    " and resid 35   and name HE% )
      4.200     2.200     1.800 peak  1897 spectrum    1 weight  0.10000E+01 volume  0.51072E-03 ppm1      8.045 ppm2      6.852 CV     1
 ASSI { 1900}
   (( segid "    " and resid 60   and name HN  ))
   (( segid "    " and resid 55   and name HA  ))
      5.000     3.100     1.000 peak  1900 spectrum    1 weight  0.10000E+01 volume  0.41345E-03 ppm1      8.253 ppm2      4.986 CV     1
 ASSI { 1908}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 107  and name HB2 ))
      4.600     2.700     1.400 peak  1908 spectrum    1 weight  0.10000E+01 volume  0.58448E-03 ppm1      8.465 ppm2      1.086 CV     1
 ASSI { 1910}
   (( segid "    " and resid 156  and name HN  ))
   (( segid "    " and resid 155  and name HB1 ))
      4.800     2.900     1.200 peak  1910 spectrum    1 weight  0.10000E+01 volume  0.41090E-03 ppm1      8.463 ppm2      2.588 CV     1
 ASSI { 1911}
   (( segid "    " and resid 114  and name HN  ))
   (( segid "    " and resid 113  and name HB  ))
      4.500     2.500     1.500 peak  1911 spectrum    1 weight  0.10000E+01 volume  0.61925E-03 ppm1      8.279 ppm2      1.553 CV     1
 ASSI { 1913}
   (( segid "    " and resid 93   and name HN  ))
   (( segid "    " and resid 94   and name HB1 ))
      5.500     3.700     0.500 peak  1913 spectrum    1 weight  0.10000E+01 volume  0.25921E-03 ppm1      8.323 ppm2      2.472 CV     1
 ASSI { 1914}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.600     1.600     1.600 peak  1914 spectrum    1 weight  0.10000E+01 volume  0.44888E-03 ppm1      8.659 ppm2      2.149 CV     1
 ASSI { 1915}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HG1 ))
      4.300     2.300     1.700 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.30148E-03 ppm1      8.652 ppm2      1.843 CV     1
 ASSI { 1916}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 152  and name HB1 ))
      3.000     1.100     1.100 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.69493E-03 ppm1      8.653 ppm2      1.644 CV     1
 OR { 1916}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 152  and name HD2 ))
 ASSI { 1917}
   (( segid "    " and resid 55   and name HN  ))
   (( segid "    " and resid 54   and name HB1 ))
      3.900     1.900     1.900 peak  1917 spectrum    1 weight  0.10000E+01 volume  0.10244E-02 ppm1      8.654 ppm2      1.502 CV     1
 ASSI { 1919}
   (( segid "    " and resid 122  and name HN  ))
   (( segid "    " and resid 122  and name HB2 ))
      2.700     0.900     0.900 peak  1919 spectrum    1 weight  0.10000E+01 volume  0.27545E-02 ppm1      8.419 ppm2      2.820 CV     1
 ASSI { 1920}
   (( segid "    " and resid 120  and name HN  ))
   (( segid "    " and resid 119  and name HG12))
      4.500     4.500     1.500 peak  1920 spectrum    1 weight  0.10000E+01 volume  0.33284E-03 ppm1      8.416 ppm2      1.637 CV     1
 ASSI { 1923}
   (( segid "    " and resid 119  and name HN  ))
   (( segid "    " and resid 119  and name HB  ))
      2.600     0.800     0.800 peak  1923 spectrum    1 weight  0.10000E+01 volume  0.36870E-02 ppm1      7.145 ppm2      1.971 CV     1
 ASSI { 1925}
   (( segid "    " and resid 89   and name HN  ))
   (( segid "    " and resid 88   and name HB1 ))
      4.000     2.000     2.000 peak  1925 spectrum    1 weight  0.10000E+01 volume  0.65357E-03 ppm1      8.238 ppm2      1.747 CV     1
 ASSI { 1928}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 101  and name HA  ))
      3.100     3.100     2.900 peak  1928 spectrum    1 weight  0.10000E+01 volume  0.29738E-03 ppm1      8.612 ppm2      4.810 CV     1
 ASSI { 1929}
   (( segid "    " and resid 136  and name HN  ))
   (( segid "    " and resid 136  and name HA  ))
      3.500     1.600     1.600 peak  1929 spectrum    1 weight  0.10000E+01 volume  0.60991E-03 ppm1      8.612 ppm2      3.963 CV     1
 ASSI { 1933}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 73   and name HG2 ))
      4.300     2.300     1.700 peak  1933 spectrum    1 weight  0.10000E+01 volume  0.95785E-04 ppm1      7.472 ppm2      3.730 CV     1
 OR { 1933}
   (( segid "    " and resid 39   and name HN  ))
   (( segid "    " and resid 73   and name HG1 ))
 ASSI { 1934}
   (( segid "    " and resid 46   and name HN  ))
   (  segid "    " and resid 46   and name HG2%)
      3.200     3.200     2.800 peak  1934 spectrum    1 weight  0.10000E+01 volume  0.48193E-02 ppm1      7.226 ppm2      1.360 CV     1
 ASSI { 1937}
   (( segid "    " and resid 48   and name HN  ))
   (( segid "    " and resid 45   and name HA  ))
      3.100     3.100     2.900 peak  1937 spectrum    1 weight  0.10000E+01 volume  0.29111E-03 ppm1      8.041 ppm2      4.906 CV     1
 ASSI { 1938}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HB  ))
      4.100     2.100     1.900 peak  1938 spectrum    1 weight  0.10000E+01 volume  0.36249E-03 ppm1      6.930 ppm2      4.365 CV     1
 ASSI { 1939}
   (( segid "    " and resid 49   and name HN  ))
   (( segid "    " and resid 46   and name HA  ))
      2.900     2.900     3.100 peak  1939 spectrum    1 weight  0.10000E+01 volume  0.43676E-03 ppm1      6.929 ppm2      4.774 CV     1
 ASSI { 1940}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
      3.000     1.100     1.100 peak  1940 spectrum    1 weight  0.10000E+01 volume  0.15960E-02 ppm1      8.043 ppm2      1.886 CV     1
 OR { 1940}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
 ASSI { 1941}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HD1 ))
      3.600     1.600     1.600 peak  1941 spectrum    1 weight  0.10000E+01 volume  0.12265E-02 ppm1      8.043 ppm2      1.621 CV     1
 OR { 1941}
   (( segid "    " and resid 91   and name HN  ))
   (( segid "    " and resid 91   and name HD2 ))
 ASSI { 1942}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 90   and name HA  ))
      5.900     4.400     0.100 peak  1942 spectrum    1 weight  0.10000E+01 volume  0.11892E-03 ppm1      8.013 ppm2      4.844 CV     1
 ASSI { 1943}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB2 ))
      2.900     1.100     1.100 peak  1943 spectrum    1 weight  0.10000E+01 volume  0.19235E-02 ppm1      8.010 ppm2      1.885 CV     1
 OR { 1943}
   (( segid "    " and resid 92   and name HN  ))
   (( segid "    " and resid 91   and name HB1 ))
 ASSI { 1949}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HB2 ))
      2.900     2.900     3.100 peak  1949 spectrum    1 weight  0.10000E+01 volume  0.39806E-03 ppm1      7.812 ppm2      3.838 CV     1
 OR { 1949}
   (( segid "    " and resid 38   and name HN  ))
   (( segid "    " and resid 36   and name HB1 ))
 ASSI { 1950}
   (( segid "    " and resid 43   and name HN  ))
   (( segid "    " and resid 39   and name HA  ))
      4.700     2.700     1.300 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.13871E-03 ppm1      7.006 ppm2      4.732 CV     1
 ASSI { 1951}
   (( segid "    " and resid 32   and name HN  ))
   (( segid "    " and resid 33   and name HN  ))
      3.500     1.500     1.500 peak  1951 spectrum    1 weight  0.10000E+01 volume  0.21620E-02 ppm1      8.057 ppm2      8.785 CV     1
 ASSI { 1953}
   (( segid "    " and resid 34   and name HN  ))
   (( segid "    " and resid 76   and name HA  ))
      4.100     2.100     1.900 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.47156E-03 ppm1      7.664 ppm2      4.832 CV     1
 ASSI { 1956}
   (( segid "    " and resid 131  and name HN  ))
   (  segid "    " and resid 122  and name HE% )
      3.500     1.600     1.600 peak  1956 spectrum    1 weight  0.10000E+01 volume  0.12721E-03 ppm1      9.637 ppm2      6.365 CV     1
 ASSI {    2}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 29   and name HA  ))
      3.000     1.100     1.100 peak     2 spectrum    1 weight  0.10000E+01 volume  0.24360E-02 ppm1      7.332 ppm2      4.252 CV     1
 ASSI {    3}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 29   and name HB2 ))
      2.800     1.000     1.000 peak     3 spectrum    1 weight  0.10000E+01 volume  0.28268E-02 ppm1      7.330 ppm2      2.883 CV     1
 ASSI {    4}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 29   and name HB1 ))
      2.500     0.800     0.800 peak     4 spectrum    1 weight  0.10000E+01 volume  0.27634E-02 ppm1      7.330 ppm2      2.662 CV     1
 ASSI {    5}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 32   and name HB2 ))
      3.300     1.400     1.400 peak     5 spectrum    1 weight  0.10000E+01 volume  0.15090E-02 ppm1      7.331 ppm2      2.198 CV     1
 ASSI {    6}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 28   and name HB2 ))
      2.700     0.900     0.900 peak     6 spectrum    1 weight  0.10000E+01 volume  0.17363E-02 ppm1      7.328 ppm2      1.899 CV     1
 ASSI {    8}
   (  segid "    " and resid 109  and name HD% )
   (  segid "    " and resid 109  and name HE% )
      2.500     0.800     0.800 peak     8 spectrum    1 weight  0.10000E+01 volume  0.39148E-02 ppm1      7.063 ppm2      6.866 CV     1
 ASSI {    9}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 83   and name HB2 ))
      2.800     1.000     1.000 peak     9 spectrum    1 weight  0.10000E+01 volume  0.18010E-02 ppm1      6.776 ppm2      2.314 CV     1
 ASSI {   11}
   (  segid "    " and resid 83   and name HD% )
   (  segid "    " and resid 83   and name HE% )
      2.400     0.700     0.700 peak    11 spectrum    1 weight  0.10000E+01 volume  0.40351E-02 ppm1      6.773 ppm2      6.400 CV     1
 ASSI {   12}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 83   and name HB1 ))
      2.800     1.000     1.000 peak    12 spectrum    1 weight  0.10000E+01 volume  0.17097E-02 ppm1      6.773 ppm2      2.135 CV     1
 ASSI {   13}
   (  segid "    " and resid 83   and name HD% )
   (  segid "    " and resid 62   and name HG2%)
      3.200     1.300     1.300 peak    13 spectrum    1 weight  0.10000E+01 volume  0.13971E-02 ppm1      6.778 ppm2      0.036 CV     1
 ASSI {   18}
   (  segid "    " and resid 155  and name HD% )
   (( segid "    " and resid 155  and name HA  ))
      3.700     1.700     1.700 peak    18 spectrum    1 weight  0.10000E+01 volume  0.14073E-02 ppm1      7.203 ppm2      4.532 CV     1
 ASSI {   19}
   (  segid "    " and resid 155  and name HD% )
   (( segid "    " and resid 155  and name HB2 ))
      2.400     0.700     0.700 peak    19 spectrum    1 weight  0.10000E+01 volume  0.27178E-02 ppm1      7.202 ppm2      2.825 CV     1
 ASSI {   20}
   (  segid "    " and resid 155  and name HD% )
   (( segid "    " and resid 155  and name HB1 ))
      2.600     0.800     0.800 peak    20 spectrum    1 weight  0.10000E+01 volume  0.26349E-02 ppm1      7.202 ppm2      2.602 CV     1
 ASSI {   25}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 85   and name HA  ))
      2.200     0.600     0.600 peak    25 spectrum    1 weight  0.10000E+01 volume  0.44590E-02 ppm1      5.117 ppm2      5.665 CV     1
 ASSI {   27}
   (( segid "    " and resid 62   and name HA  ))
   (  segid "    " and resid 62   and name HG2%)
      2.700     0.900     0.900 peak    27 spectrum    1 weight  0.10000E+01 volume  0.29867E-02 ppm1      5.115 ppm2      0.015 CV     1
 ASSI {   28}
   (( segid "    " and resid 62   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      2.600     0.800     0.800 peak    28 spectrum    1 weight  0.10000E+01 volume  0.23550E-02 ppm1      5.111 ppm2      9.146 CV     1
 ASSI {   31}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 35   and name HN  ))
      2.700     0.900     0.900 peak    31 spectrum    1 weight  0.10000E+01 volume  0.29168E-02 ppm1      6.181 ppm2      8.853 CV     1
 ASSI {   32}
   (  segid "    " and resid 35   and name HD% )
   (  segid "    " and resid 35   and name HE% )
      2.300     0.600     0.600 peak    32 spectrum    1 weight  0.10000E+01 volume  0.69928E-02 ppm1      6.181 ppm2      6.831 CV     1
 ASSI {   33}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 35   and name HA  ))
      3.000     1.100     1.100 peak    33 spectrum    1 weight  0.10000E+01 volume  0.19508E-02 ppm1      6.180 ppm2      4.267 CV     1
 ASSI {   34}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 34   and name HB2 ))
      3.200     1.300     1.300 peak    34 spectrum    1 weight  0.10000E+01 volume  0.18120E-02 ppm1      6.182 ppm2      3.987 CV     1
 ASSI {   35}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 35   and name HB2 ))
      2.500     0.800     0.800 peak    35 spectrum    1 weight  0.10000E+01 volume  0.38850E-02 ppm1      6.184 ppm2      2.683 CV     1
 ASSI {   36}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 35   and name HB1 ))
      2.600     0.800     0.800 peak    36 spectrum    1 weight  0.10000E+01 volume  0.29924E-02 ppm1      6.178 ppm2      2.370 CV     1
 ASSI {   38}
   (  segid "    " and resid 35   and name HD% )
   (  segid "    " and resid 29   and name HE% )
      3.100     1.200     1.200 peak    38 spectrum    1 weight  0.10000E+01 volume  0.14168E-02 ppm1      6.176 ppm2      6.700 CV     1
 ASSI {   40}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 81   and name HA2 ))
      3.000     1.100     1.100 peak    40 spectrum    1 weight  0.10000E+01 volume  0.19848E-02 ppm1      6.178 ppm2      4.504 CV     1
 ASSI {   41}
   (  segid "    " and resid 65   and name HD% )
   (( segid "    " and resid 65   and name HB2 ))
      3.100     1.200     1.200 peak    41 spectrum    1 weight  0.10000E+01 volume  0.13076E-02 ppm1      7.080 ppm2      3.732 CV     1
 ASSI {   46}
   (  segid "    " and resid 122  and name HD% )
   (  segid "    " and resid 122  and name HE% )
      2.200     0.600     0.600 peak    46 spectrum    1 weight  0.10000E+01 volume  0.93981E-02 ppm1      6.776 ppm2      6.358 CV     1
 ASSI {   47}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 122  and name HA  ))
      2.800     1.000     1.000 peak    47 spectrum    1 weight  0.10000E+01 volume  0.26261E-02 ppm1      6.773 ppm2      4.543 CV     1
 ASSI {   48}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 108  and name HA1 ))
      3.100     1.200     1.200 peak    48 spectrum    1 weight  0.10000E+01 volume  0.18973E-02 ppm1      6.773 ppm2      4.003 CV     1
 ASSI {   49}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 122  and name HB2 ))
      2.500     0.800     0.800 peak    49 spectrum    1 weight  0.10000E+01 volume  0.38764E-02 ppm1      6.775 ppm2      2.810 CV     1
 ASSI {   50}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 122  and name HB1 ))
      2.800     1.000     1.000 peak    50 spectrum    1 weight  0.10000E+01 volume  0.23750E-02 ppm1      6.774 ppm2      2.503 CV     1
 ASSI {   53}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      2.000     0.500     0.500 peak    53 spectrum    1 weight  0.10000E+01 volume  0.71077E-02 ppm1      5.682 ppm2      9.194 CV     1
 ASSI {   55}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 85   and name HG2%)
      2.500     2.500     3.500 peak    55 spectrum    1 weight  0.10000E+01 volume  0.34668E-02 ppm1      5.683 ppm2      1.072 CV     1
 ASSI {   56}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 62   and name HG2%)
      3.200     1.300     1.300 peak    56 spectrum    1 weight  0.10000E+01 volume  0.13790E-02 ppm1      5.683 ppm2      0.007 CV     1
 ASSI {   60}
   (( segid "    " and resid 154  and name HA  ))
   (( segid "    " and resid 53   and name HA  ))
      2.900     2.900     3.100 peak    60 spectrum    1 weight  0.10000E+01 volume  0.49477E-02 ppm1      5.220 ppm2      4.931 CV     1
 ASSI {   62}
   (( segid "    " and resid 154  and name HA  ))
   (  segid "    " and resid 154  and name HG2%)
      2.400     0.700     0.700 peak    62 spectrum    1 weight  0.10000E+01 volume  0.46509E-02 ppm1      5.218 ppm2      1.215 CV     1
 ASSI {   65}
   (  segid "    " and resid 156  and name HE% )
   (  segid "    " and resid 156  and name HD% )
      3.000     1.100     1.100 peak    65 spectrum    1 weight  0.10000E+01 volume  0.12543E-02 ppm1      7.655 ppm2      6.775 CV     1
 ASSI {   67}
   (  segid "    " and resid 156  and name HD% )
   (  segid "    " and resid 119  and name HG2%)
      2.700     2.700     3.300 peak    67 spectrum    1 weight  0.10000E+01 volume  0.28950E-02 ppm1      6.805 ppm2      0.602 CV     1
 ASSI {   70}
   (  segid "    " and resid 80   and name HE% )
   (  segid "    " and resid 79   and name HB% )
      3.100     1.200     1.200 peak    70 spectrum    1 weight  0.10000E+01 volume  0.16595E-02 ppm1      6.374 ppm2      1.668 CV     1
 ASSI {   71}
   (  segid "    " and resid 122  and name HE% )
   (  segid "    " and resid 119  and name HG2%)
      3.100     3.100     2.900 peak    71 spectrum    1 weight  0.10000E+01 volume  0.27058E-02 ppm1      6.376 ppm2      0.554 CV     1
 ASSI {   72}
   (  segid "    " and resid 122  and name HE% )
   (  segid "    " and resid 119  and name HD1%)
      3.300     1.400     1.400 peak    72 spectrum    1 weight  0.10000E+01 volume  0.13272E-02 ppm1      6.376 ppm2     -0.204 CV     1
 ASSI {   74}
   (( segid "    " and resid 156  and name HZ  ))
   (( segid "    " and resid 117  and name HA  ))
      3.000     1.200     1.200 peak    74 spectrum    1 weight  0.10000E+01 volume  0.13394E-02 ppm1      7.150 ppm2      4.312 CV     1
 ASSI {   75}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HN  ))
      2.700     0.900     0.900 peak    75 spectrum    1 weight  0.10000E+01 volume  0.17372E-02 ppm1      5.255 ppm2      8.145 CV     1
 ASSI {   76}
   (( segid "    " and resid 71   and name HA  ))
   (( segid "    " and resid 71   and name HB  ))
      2.400     0.700     0.700 peak    76 spectrum    1 weight  0.10000E+01 volume  0.43510E-02 ppm1      5.254 ppm2      1.752 CV     1
 ASSI {   79}
   (( segid "    " and resid 71   and name HA  ))
   (  segid "    " and resid 71   and name HG1%)
      2.800     1.000     1.000 peak    79 spectrum    1 weight  0.10000E+01 volume  0.19760E-02 ppm1      5.252 ppm2      0.531 CV     1
 ASSI {   85}
   (( segid "    " and resid 153  and name HA  ))
   (  segid "    " and resid 154  and name HG2%)
      3.600     1.600     1.600 peak    85 spectrum    1 weight  0.10000E+01 volume  0.14052E-02 ppm1      5.178 ppm2      1.243 CV     1
 ASSI {   87}
   (( segid "    " and resid 153  and name HA  ))
   (( segid "    " and resid 153  and name HB  ))
      2.800     0.900     0.900 peak    87 spectrum    1 weight  0.10000E+01 volume  0.13522E-02 ppm1      5.181 ppm2      2.510 CV     1
 ASSI {   89}
   (( segid "    " and resid 122  and name HZ  ))
   (( segid "    " and resid 119  and name HG11))
      3.300     1.300     1.300 peak    89 spectrum    1 weight  0.10000E+01 volume  0.15818E-02 ppm1      6.661 ppm2      1.141 CV     1
 ASSI {   91}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HN  ))
      2.800     1.000     1.000 peak    91 spectrum    1 weight  0.10000E+01 volume  0.13164E-02 ppm1      5.507 ppm2      8.741 CV     1
 ASSI {   92}
   (( segid "    " and resid 109  and name HA  ))
   (  segid "    " and resid 109  and name HD% )
      3.100     1.200     1.200 peak    92 spectrum    1 weight  0.10000E+01 volume  0.12673E-02 ppm1      5.510 ppm2      7.047 CV     1
 ASSI {   93}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB2 ))
      2.300     0.700     0.700 peak    93 spectrum    1 weight  0.10000E+01 volume  0.27750E-02 ppm1      5.507 ppm2      3.073 CV     1
 ASSI {   94}
   (( segid "    " and resid 109  and name HA  ))
   (( segid "    " and resid 109  and name HB1 ))
      2.900     1.000     1.000 peak    94 spectrum    1 weight  0.10000E+01 volume  0.16538E-02 ppm1      5.507 ppm2      2.777 CV     1
 ASSI {   97}
   (  segid "    " and resid 80   and name HD% )
   (  segid "    " and resid 80   and name HE% )
      2.500     0.800     0.800 peak    97 spectrum    1 weight  0.10000E+01 volume  0.37601E-02 ppm1      6.131 ppm2      6.356 CV     1
 ASSI {  100}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB1 ))
      2.600     0.800     0.800 peak   100 spectrum    1 weight  0.10000E+01 volume  0.32780E-02 ppm1      5.119 ppm2      1.840 CV     1
 ASSI {  101}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 83   and name HN  ))
      2.400     0.700     0.700 peak   101 spectrum    1 weight  0.10000E+01 volume  0.42433E-02 ppm1      5.116 ppm2      8.982 CV     1
 ASSI {  102}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 73   and name HA  ))
      2.400     0.700     0.700 peak   102 spectrum    1 weight  0.10000E+01 volume  0.34745E-02 ppm1      5.117 ppm2      4.851 CV     1
 ASSI {  103}
   (( segid "    " and resid 82   and name HA  ))
   (( segid "    " and resid 82   and name HB2 ))
      2.400     0.700     0.700 peak   103 spectrum    1 weight  0.10000E+01 volume  0.36495E-02 ppm1      5.117 ppm2      2.636 CV     1
 ASSI {  104}
   (( segid "    " and resid 82   and name HA  ))
   (  segid "    " and resid 74   and name HB% )
      2.800     2.800     3.200 peak   104 spectrum    1 weight  0.10000E+01 volume  0.15746E-02 ppm1      5.117 ppm2      0.135 CV     1
 ASSI {  108}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 86   and name HB1 ))
      3.400     1.400     1.400 peak   108 spectrum    1 weight  0.10000E+01 volume  0.34009E-02 ppm1      5.254 ppm2      1.459 CV     1
 ASSI {  112}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HN  ))
      3.000     1.100     1.100 peak   112 spectrum    1 weight  0.10000E+01 volume  0.14105E-02 ppm1      5.498 ppm2      9.001 CV     1
 ASSI {  113}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      2.000     0.500     0.500 peak   113 spectrum    1 weight  0.10000E+01 volume  0.99812E-02 ppm1      5.500 ppm2      8.390 CV     1
 ASSI {  115}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 151  and name HB2 ))
      2.800     1.000     1.000 peak   115 spectrum    1 weight  0.10000E+01 volume  0.26502E-02 ppm1      5.500 ppm2      2.660 CV     1
 OR {  115}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 151  and name HB1 ))
 ASSI {  116}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB2 ))
      2.500     0.800     0.800 peak   116 spectrum    1 weight  0.10000E+01 volume  0.25464E-02 ppm1      5.498 ppm2      2.314 CV     1
 ASSI {  117}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 83   and name HB1 ))
      2.600     0.800     0.800 peak   117 spectrum    1 weight  0.10000E+01 volume  0.35931E-02 ppm1      5.496 ppm2      2.158 CV     1
 ASSI {  119}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 84   and name HB1 ))
      4.200     2.200     1.800 peak   119 spectrum    1 weight  0.10000E+01 volume  0.14321E-02 ppm1      5.498 ppm2      1.544 CV     1
 ASSI {  120}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 83   and name HD% )
      3.700     1.700     1.700 peak   120 spectrum    1 weight  0.10000E+01 volume  0.14569E-02 ppm1      5.493 ppm2      6.730 CV     1
 ASSI {  121}
   (( segid "    " and resid 83   and name HA  ))
   (  segid "    " and resid 62   and name HG2%)
      3.500     1.600     1.600 peak   121 spectrum    1 weight  0.10000E+01 volume  0.12696E-02 ppm1      5.494 ppm2      0.009 CV     1
 ASSI {  122}
   (( segid "    " and resid 84   and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      2.900     1.000     1.000 peak   122 spectrum    1 weight  0.10000E+01 volume  0.13402E-02 ppm1      5.287 ppm2      8.349 CV     1
 ASSI {  123}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HN  ))
      1.900     0.400     0.400 peak   123 spectrum    1 weight  0.10000E+01 volume  0.73082E-02 ppm1      5.329 ppm2      8.166 CV     1
 ASSI {  124}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 87   and name HA  ))
      2.100     0.600     0.600 peak   124 spectrum    1 weight  0.10000E+01 volume  0.24130E-02 ppm1      5.329 ppm2      4.819 CV     1
 ASSI {  125}
   (( segid "    " and resid 60   and name HA  ))
   (( segid "    " and resid 61   and name HG12))
      3.400     1.400     1.400 peak   125 spectrum    1 weight  0.10000E+01 volume  0.17564E-02 ppm1      5.326 ppm2      1.066 CV     1
 ASSI {  133}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HB2 ))
      2.400     0.700     0.700 peak   133 spectrum    1 weight  0.10000E+01 volume  0.24708E-02 ppm1      5.589 ppm2      1.795 CV     1
 ASSI {  138}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB1 ))
      3.000     1.200     1.200 peak   138 spectrum    1 weight  0.10000E+01 volume  0.24877E-02 ppm1      5.364 ppm2      2.581 CV     1
 ASSI {  139}
   (( segid "    " and resid 70   and name HA  ))
   (  segid "    " and resid 71   and name HG1%)
      3.900     1.900     1.900 peak   139 spectrum    1 weight  0.10000E+01 volume  0.12497E-02 ppm1      5.365 ppm2      0.580 CV     1
 ASSI {  140}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HN  ))
      2.900     1.000     1.000 peak   140 spectrum    1 weight  0.10000E+01 volume  0.18695E-02 ppm1      5.364 ppm2      9.511 CV     1
 ASSI {  146}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 131  and name HB1 ))
      2.900     1.100     1.100 peak   146 spectrum    1 weight  0.10000E+01 volume  0.14542E-02 ppm1      5.198 ppm2      1.605 CV     1
 ASSI {  148}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 127  and name HN  ))
      2.800     1.000     1.000 peak   148 spectrum    1 weight  0.10000E+01 volume  0.16530E-02 ppm1      5.194 ppm2      7.609 CV     1
 ASSI {  149}
   (  segid "    " and resid 35   and name HE% )
   (  segid "    " and resid 29   and name HD% )
      2.900     1.100     1.100 peak   149 spectrum    1 weight  0.10000E+01 volume  0.18427E-02 ppm1      6.845 ppm2      7.330 CV     1
 ASSI {  151}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 34   and name HA  ))
      2.800     2.800     3.200 peak   151 spectrum    1 weight  0.10000E+01 volume  0.39102E-02 ppm1      6.843 ppm2      4.721 CV     1
 ASSI {  152}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 81   and name HA2 ))
      2.800     1.000     1.000 peak   152 spectrum    1 weight  0.10000E+01 volume  0.21543E-02 ppm1      6.842 ppm2      4.491 CV     1
 ASSI {  154}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 29   and name HB2 ))
      2.700     0.900     0.900 peak   154 spectrum    1 weight  0.10000E+01 volume  0.19336E-02 ppm1      6.847 ppm2      2.876 CV     1
 ASSI {  155}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 29   and name HB1 ))
      3.400     1.500     1.500 peak   155 spectrum    1 weight  0.10000E+01 volume  0.25105E-02 ppm1      6.845 ppm2      2.652 CV     1
 ASSI {  156}
   (  segid "    " and resid 35   and name HE% )
   (  segid "    " and resid 25   and name HD1%)
      2.500     2.500     3.500 peak   156 spectrum    1 weight  0.10000E+01 volume  0.50723E-02 ppm1      6.841 ppm2      0.151 CV     1
 ASSI {  157}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 111  and name HN  ))
      2.200     0.600     0.600 peak   157 spectrum    1 weight  0.10000E+01 volume  0.36816E-02 ppm1      5.120 ppm2      8.878 CV     1
 ASSI {  159}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 110  and name HA1 ))
      1.700     0.400     0.500 peak   159 spectrum    1 weight  0.10000E+01 volume  0.77843E-02 ppm1      5.122 ppm2      4.095 CV     1
 ASSI {  160}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 131  and name HD1 ))
      3.600     1.600     1.600 peak   160 spectrum    1 weight  0.10000E+01 volume  0.19477E-02 ppm1      5.121 ppm2      1.410 CV     1
 OR {  160}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 131  and name HG2 ))
 OR {  160}
   (( segid "    " and resid 110  and name HA2 ))
   (( segid "    " and resid 131  and name HG1 ))
 ASSI {  162}
   (( segid "    " and resid 110  and name HA2 ))
   (  segid "    " and resid 113  and name HD1%)
      3.000     3.000     3.000 peak   162 spectrum    1 weight  0.10000E+01 volume  0.25732E-02 ppm1      5.114 ppm2      0.629 CV     1
 ASSI {  165}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 38   and name HG  ))
      2.500     2.500     3.500 peak   165 spectrum    1 weight  0.10000E+01 volume  0.46589E-02 ppm1      6.704 ppm2      0.922 CV     1
 ASSI {  166}
   (  segid "    " and resid 29   and name HE% )
   (  segid "    " and resid 29   and name HD% )
      2.100     0.500     0.500 peak   166 spectrum    1 weight  0.10000E+01 volume  0.11035E-01 ppm1      6.704 ppm2      7.325 CV     1
 ASSI {  168}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 29   and name HA  ))
      3.300     1.400     1.400 peak   168 spectrum    1 weight  0.10000E+01 volume  0.29311E-02 ppm1      6.704 ppm2      4.247 CV     1
 ASSI {  170}
   (  segid "    " and resid 29   and name HE% )
   (  segid "    " and resid 38   and name HD1%)
      2.500     2.500     3.500 peak   170 spectrum    1 weight  0.10000E+01 volume  0.64343E-02 ppm1      6.704 ppm2      0.782 CV     1
 ASSI {  178}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 61   and name HB  ))
      2.200     0.600     0.600 peak   178 spectrum    1 weight  0.10000E+01 volume  0.31033E-02 ppm1      6.731 ppm2      1.498 CV     1
 ASSI {  179}
   (  segid "    " and resid 155  and name HE% )
   (  segid "    " and resid 155  and name HD% )
      2.000     0.500     0.500 peak   179 spectrum    1 weight  0.10000E+01 volume  0.97759E-02 ppm1      6.724 ppm2      7.201 CV     1
 ASSI {  182}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 61   and name HG11))
      2.900     1.100     1.100 peak   182 spectrum    1 weight  0.10000E+01 volume  0.62005E-02 ppm1      6.728 ppm2      1.092 CV     1
 OR {  182}
   (  segid "    " and resid 155  and name HE% )
   (( segid "    " and resid 61   and name HG12))
 ASSI {  184}
   (  segid "    " and resid 155  and name HE% )
   (  segid "    " and resid 61   and name HD1%)
      2.800     0.900     0.900 peak   184 spectrum    1 weight  0.10000E+01 volume  0.60370E-02 ppm1      6.726 ppm2      0.529 CV     1
 ASSI {  185}
   (  segid "    " and resid 53   and name HE% )
   (  segid "    " and resid 53   and name HD% )
      1.900     0.500     0.500 peak   185 spectrum    1 weight  0.10000E+01 volume  0.14697E-01 ppm1      6.557 ppm2      6.826 CV     1
 ASSI {  186}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 52   and name HD22))
      3.500     1.500     1.500 peak   186 spectrum    1 weight  0.10000E+01 volume  0.12988E-02 ppm1      6.554 ppm2      5.982 CV     1
 ASSI {  190}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HB2 ))
      2.900     1.100     1.100 peak   190 spectrum    1 weight  0.10000E+01 volume  0.15409E-02 ppm1      6.555 ppm2      2.377 CV     1
 ASSI {  191}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HG2 ))
      2.600     0.900     0.900 peak   191 spectrum    1 weight  0.10000E+01 volume  0.29818E-02 ppm1      6.557 ppm2      2.092 CV     1
 OR {  191}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 50   and name HG1 ))
 ASSI {  198}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 62   and name HN  ))
      2.400     0.700     0.700 peak   198 spectrum    1 weight  0.10000E+01 volume  0.30403E-02 ppm1      3.020 ppm2      8.786 CV     1
 ASSI {  199}
   (( segid "    " and resid 62   and name HB  ))
   (  segid "    " and resid 83   and name HD% )
      3.400     1.400     1.400 peak   199 spectrum    1 weight  0.10000E+01 volume  0.17782E-02 ppm1      3.020 ppm2      6.809 CV     1
 ASSI {  201}
   (( segid "    " and resid 62   and name HB  ))
   (  segid "    " and resid 62   and name HG2%)
      2.300     0.600     0.600 peak   201 spectrum    1 weight  0.10000E+01 volume  0.52037E-02 ppm1      3.022 ppm2      0.012 CV     1
 ASSI {  202}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 21   and name HN  ))
      3.200     1.200     1.200 peak   202 spectrum    1 weight  0.10000E+01 volume  0.13505E-02 ppm1      3.388 ppm2      8.661 CV     1
 ASSI {  203}
   (( segid "    " and resid 18   and name HA  ))
   (( segid "    " and resid 18   and name HN  ))
      2.600     0.800     0.800 peak   203 spectrum    1 weight  0.10000E+01 volume  0.31356E-02 ppm1      3.384 ppm2      8.217 CV     1
 ASSI {  213}
   (( segid "    " and resid 25   and name HA  ))
   (( segid "    " and resid 28   and name HB1 ))
      3.800     1.900     1.900 peak   213 spectrum    1 weight  0.10000E+01 volume  0.12411E-02 ppm1      3.504 ppm2      1.321 CV     1
 ASSI {  214}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 29   and name HD% )
      3.500     1.500     1.500 peak   214 spectrum    1 weight  0.10000E+01 volume  0.13697E-02 ppm1      3.499 ppm2      7.323 CV     1
 ASSI {  216}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
      3.000     1.200     1.200 peak   216 spectrum    1 weight  0.10000E+01 volume  0.38254E-02 ppm1      3.501 ppm2      0.602 CV     1
 ASSI {  217}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HN  ))
      2.700     0.900     0.900 peak   217 spectrum    1 weight  0.10000E+01 volume  0.28947E-02 ppm1      3.485 ppm2      8.411 CV     1
 ASSI {  218}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HG12))
      2.400     0.700     0.700 peak   218 spectrum    1 weight  0.10000E+01 volume  0.58711E-02 ppm1      3.488 ppm2      1.924 CV     1
 OR {  218}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HB  ))
 OR {  218}
   (( segid "    " and resid 15   and name HA  ))
   (( segid "    " and resid 15   and name HG11))
 ASSI {  219}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 28   and name HD2%)
      2.600     0.800     0.800 peak   219 spectrum    1 weight  0.10000E+01 volume  0.53647E-02 ppm1      3.488 ppm2      0.827 CV     1
 OR {  219}
   (( segid "    " and resid 25   and name HA  ))
   (  segid "    " and resid 28   and name HD1%)
 ASSI {  223}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HG2%)
      2.400     0.700     0.700 peak   223 spectrum    1 weight  0.10000E+01 volume  0.74752E-02 ppm1      3.488 ppm2      0.974 CV     1
 OR {  223}
   (( segid "    " and resid 15   and name HA  ))
   (  segid "    " and resid 15   and name HD1%)
 ASSI {  226}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 123  and name HA2 ))
      3.900     1.900     1.900 peak   226 spectrum    1 weight  0.10000E+01 volume  0.27005E-02 ppm1      3.543 ppm2      4.729 CV     1
 ASSI {  229}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 135  and name HN  ))
      2.300     0.700     0.700 peak   229 spectrum    1 weight  0.10000E+01 volume  0.64623E-02 ppm1      3.378 ppm2      8.634 CV     1
 ASSI {  230}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 134  and name HN  ))
      2.700     0.900     0.900 peak   230 spectrum    1 weight  0.10000E+01 volume  0.27674E-02 ppm1      3.375 ppm2      7.804 CV     1
 ASSI {  232}
   (( segid "    " and resid 134  and name HA  ))
   (( segid "    " and resid 101  and name HD22))
      3.200     3.200     2.800 peak   232 spectrum    1 weight  0.10000E+01 volume  0.14312E-02 ppm1      3.378 ppm2      6.864 CV     1
 ASSI {  235}
   (( segid "    " and resid 134  and name HA  ))
   (  segid "    " and resid 134  and name HB% )
      2.300     0.700     0.700 peak   235 spectrum    1 weight  0.10000E+01 volume  0.82297E-02 ppm1      3.375 ppm2      1.068 CV     1
 ASSI {  239}
   (( segid "    " and resid 64   and name HD2 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.400     1.400     1.400 peak   239 spectrum    1 weight  0.10000E+01 volume  0.13923E-02 ppm1      3.037 ppm2      1.839 CV     1
 OR {  239}
   (( segid "    " and resid 64   and name HD1 ))
   (( segid "    " and resid 86   and name HB2 ))
 ASSI {  242}
   (( segid "    " and resid 86   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
      1.500     0.300     0.700 peak   242 spectrum    1 weight  0.10000E+01 volume  0.86103E-02 ppm1      1.820 ppm2      1.450 CV     1
 ASSI {  247}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HN  ))
      2.600     0.800     0.800 peak   247 spectrum    1 weight  0.10000E+01 volume  0.13750E-02 ppm1      1.454 ppm2      9.169 CV     1
 ASSI {  248}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 86   and name HA  ))
      2.900     1.000     1.000 peak   248 spectrum    1 weight  0.10000E+01 volume  0.21147E-02 ppm1      1.451 ppm2      5.580 CV     1
 ASSI {  250}
   (( segid "    " and resid 86   and name HB1 ))
   (( segid "    " and resid 69   and name HB1 ))
      3.400     1.400     1.400 peak   250 spectrum    1 weight  0.10000E+01 volume  0.36776E-02 ppm1      1.451 ppm2      1.003 CV     1
 ASSI {  251}
   (( segid "    " and resid 86   and name HB1 ))
   (  segid "    " and resid 61   and name HD1%)
      3.800     3.800     2.200 peak   251 spectrum    1 weight  0.10000E+01 volume  0.17610E-02 ppm1      1.449 ppm2      0.541 CV     1
 ASSI {  256}
   (( segid "    " and resid 109  and name HB2 ))
   (  segid "    " and resid 109  and name HD% )
      2.800     1.000     1.000 peak   256 spectrum    1 weight  0.10000E+01 volume  0.20318E-02 ppm1      3.078 ppm2      7.056 CV     1
 ASSI {  257}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HB1 ))
      1.900     0.400     0.400 peak   257 spectrum    1 weight  0.10000E+01 volume  0.62108E-02 ppm1      3.078 ppm2      2.785 CV     1
 ASSI {  260}
   (( segid "    " and resid 109  and name HB1 ))
   (  segid "    " and resid 109  and name HD% )
      2.800     1.000     1.000 peak   260 spectrum    1 weight  0.10000E+01 volume  0.19651E-02 ppm1      2.795 ppm2      7.061 CV     1
 ASSI {  262}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 157  and name HB2 ))
      4.100     2.100     1.900 peak   262 spectrum    1 weight  0.10000E+01 volume  0.12576E-02 ppm1      2.795 ppm2      1.728 CV     1
 ASSI {  263}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HA  ))
      3.200     1.300     1.300 peak   263 spectrum    1 weight  0.10000E+01 volume  0.14039E-02 ppm1      1.761 ppm2      5.266 CV     1
 ASSI {  264}
   (( segid "    " and resid 84   and name HB2 ))
   (( segid "    " and resid 84   and name HB1 ))
      1.700     0.400     0.500 peak   264 spectrum    1 weight  0.10000E+01 volume  0.81549E-02 ppm1      1.760 ppm2      1.511 CV     1
 ASSI {  265}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 84   and name HD1%)
      2.700     0.900     0.900 peak   265 spectrum    1 weight  0.10000E+01 volume  0.38532E-02 ppm1      1.758 ppm2      0.903 CV     1
 OR {  265}
   (( segid "    " and resid 84   and name HB2 ))
   (  segid "    " and resid 84   and name HD2%)
 ASSI {  266}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 84   and name HA  ))
      2.600     0.800     0.800 peak   266 spectrum    1 weight  0.10000E+01 volume  0.19979E-02 ppm1      1.537 ppm2      5.271 CV     1
 ASSI {  269}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 84   and name HD2%)
      2.500     0.800     0.800 peak   269 spectrum    1 weight  0.10000E+01 volume  0.39783E-02 ppm1      1.533 ppm2      0.917 CV     1
 OR {  269}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 84   and name HD1%)
 ASSI {  273}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HA  ))
      2.900     1.100     1.100 peak   273 spectrum    1 weight  0.10000E+01 volume  0.27846E-02 ppm1      1.917 ppm2      4.192 CV     1
 ASSI {  274}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 25   and name HA  ))
      3.000     1.100     1.100 peak   274 spectrum    1 weight  0.10000E+01 volume  0.15834E-02 ppm1      1.915 ppm2      3.487 CV     1
 ASSI {  275}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HG  ))
      2.700     0.900     0.900 peak   275 spectrum    1 weight  0.10000E+01 volume  0.19688E-02 ppm1      1.923 ppm2      1.635 CV     1
 ASSI {  276}
   (( segid "    " and resid 28   and name HB2 ))
   (( segid "    " and resid 28   and name HB1 ))
      1.600     0.300     0.600 peak   276 spectrum    1 weight  0.10000E+01 volume  0.13627E-01 ppm1      1.913 ppm2      1.341 CV     1
 ASSI {  280}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 64   and name HB2 ))
      3.600     3.600     2.400 peak   280 spectrum    1 weight  0.10000E+01 volume  0.14791E-02 ppm1      1.638 ppm2      2.485 CV     1
 ASSI {  281}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 86   and name HB1 ))
      3.500     1.500     1.500 peak   281 spectrum    1 weight  0.10000E+01 volume  0.36681E-02 ppm1      1.639 ppm2      1.461 CV     1
 ASSI {  282}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 86   and name HD2%)
      3.100     3.100     2.900 peak   282 spectrum    1 weight  0.10000E+01 volume  0.79048E-02 ppm1      1.637 ppm2      0.980 CV     1
 ASSI {  283}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 69   and name HD1%)
      2.700     0.900     0.900 peak   283 spectrum    1 weight  0.10000E+01 volume  0.31093E-02 ppm1      1.637 ppm2      0.661 CV     1
 OR {  283}
   (( segid "    " and resid 69   and name HB2 ))
   (  segid "    " and resid 69   and name HD2%)
 ASSI {  285}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HG  ))
      3.300     1.300     1.300 peak   285 spectrum    1 weight  0.10000E+01 volume  0.12799E-02 ppm1      1.331 ppm2      1.657 CV     1
 ASSI {  286}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 28   and name HN  ))
      3.200     1.300     1.300 peak   286 spectrum    1 weight  0.10000E+01 volume  0.23278E-02 ppm1      1.330 ppm2      7.951 CV     1
 ASSI {  287}
   (( segid "    " and resid 28   and name HB1 ))
   (  segid "    " and resid 29   and name HD% )
      3.300     1.400     1.400 peak   287 spectrum    1 weight  0.10000E+01 volume  0.13501E-02 ppm1      1.333 ppm2      7.335 CV     1
 ASSI {  290}
   (( segid "    " and resid 28   and name HB1 ))
   (  segid "    " and resid 28   and name HD2%)
      2.300     2.300     3.700 peak   290 spectrum    1 weight  0.10000E+01 volume  0.66505E-02 ppm1      1.329 ppm2      0.777 CV     1
 ASSI {  291}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HA  ))
      2.600     0.800     0.800 peak   291 spectrum    1 weight  0.10000E+01 volume  0.22165E-02 ppm1      0.998 ppm2      5.247 CV     1
 ASSI {  293}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HB2 ))
      1.700     0.400     0.500 peak   293 spectrum    1 weight  0.10000E+01 volume  0.78152E-02 ppm1      0.994 ppm2      1.628 CV     1
 ASSI {  294}
   (( segid "    " and resid 69   and name HB1 ))
   (( segid "    " and resid 69   and name HG  ))
      2.700     0.900     0.900 peak   294 spectrum    1 weight  0.10000E+01 volume  0.32199E-02 ppm1      0.998 ppm2      1.459 CV     1
 ASSI {  295}
   (( segid "    " and resid 69   and name HB1 ))
   (  segid "    " and resid 69   and name HD1%)
      3.000     1.200     1.200 peak   295 spectrum    1 weight  0.10000E+01 volume  0.35707E-02 ppm1      0.996 ppm2      0.678 CV     1
 ASSI {  296}
   (( segid "    " and resid 88   and name HD1 ))
   (( segid "    " and resid 88   and name HB1 ))
      2.600     0.800     0.800 peak   296 spectrum    1 weight  0.10000E+01 volume  0.49310E-02 ppm1      3.202 ppm2      1.752 CV     1
 OR {  296}
   (( segid "    " and resid 88   and name HD2 ))
   (( segid "    " and resid 88   and name HB1 ))
 ASSI {  297}
   (( segid "    " and resid 88   and name HD1 ))
   (( segid "    " and resid 88   and name HB2 ))
      2.900     1.000     1.000 peak   297 spectrum    1 weight  0.10000E+01 volume  0.13515E-02 ppm1      3.199 ppm2      2.069 CV     1
 OR {  297}
   (( segid "    " and resid 88   and name HD2 ))
   (( segid "    " and resid 88   and name HB2 ))
 ASSI {  298}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 155  and name HE% )
      3.000     3.000     3.000 peak   298 spectrum    1 weight  0.10000E+01 volume  0.22771E-02 ppm1      2.172 ppm2      6.730 CV     1
 OR {  298}
   (( segid "    " and resid 100  and name HB1 ))
   (  segid "    " and resid 155  and name HE% )
 ASSI {  299}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 96   and name HA  ))
      3.000     3.000     3.000 peak   299 spectrum    1 weight  0.10000E+01 volume  0.19512E-02 ppm1      2.173 ppm2      4.088 CV     1
 OR {  299}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 96   and name HA  ))
 ASSI {  300}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 100  and name HG  ))
      2.100     0.600     0.600 peak   300 spectrum    1 weight  0.10000E+01 volume  0.13807E-01 ppm1      2.171 ppm2      1.502 CV     1
 ASSI {  301}
   (( segid "    " and resid 100  and name HB2 ))
   (  segid "    " and resid 100  and name HD1%)
      2.700     0.900     0.900 peak   301 spectrum    1 weight  0.10000E+01 volume  0.26945E-02 ppm1      2.171 ppm2      0.951 CV     1
 OR {  301}
   (( segid "    " and resid 100  and name HB1 ))
   (  segid "    " and resid 100  and name HD1%)
 ASSI {  303}
   (( segid "    " and resid 100  and name HB2 ))
   (( segid "    " and resid 134  and name HN  ))
      3.000     3.000     3.000 peak   303 spectrum    1 weight  0.10000E+01 volume  0.15407E-02 ppm1      2.171 ppm2      7.840 CV     1
 OR {  303}
   (( segid "    " and resid 100  and name HB1 ))
   (( segid "    " and resid 134  and name HN  ))
 ASSI {  307}
   (( segid "    " and resid 38   and name HB2 ))
   (  segid "    " and resid 29   and name HE% )
      4.100     2.100     1.900 peak   307 spectrum    1 weight  0.10000E+01 volume  0.13775E-02 ppm1      1.515 ppm2      6.728 CV     1
 OR {  307}
   (( segid "    " and resid 38   and name HB1 ))
   (  segid "    " and resid 29   and name HE% )
 ASSI {  309}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 73   and name HB1 ))
      2.400     2.400     3.600 peak   309 spectrum    1 weight  0.10000E+01 volume  0.77694E-02 ppm1      1.518 ppm2      2.149 CV     1
 OR {  309}
   (( segid "    " and resid 38   and name HB2 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR {  309}
   (( segid "    " and resid 38   and name HB1 ))
   (( segid "    " and resid 73   and name HB1 ))
 ASSI {  322}
   (( segid "    " and resid 59   and name HE2 ))
   (( segid "    " and resid 59   and name HG2 ))
      3.000     1.100     1.100 peak   322 spectrum    1 weight  0.10000E+01 volume  0.21521E-02 ppm1      3.009 ppm2      1.312 CV     1
 OR {  322}
   (( segid "    " and resid 59   and name HE1 ))
   (( segid "    " and resid 59   and name HG2 ))
 OR {  322}
   (( segid "    " and resid 59   and name HE2 ))
   (( segid "    " and resid 59   and name HG1 ))
 OR {  322}
   (( segid "    " and resid 59   and name HE1 ))
   (( segid "    " and resid 59   and name HG1 ))
 ASSI {  329}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 123  and name HA2 ))
      2.700     2.700     3.300 peak   329 spectrum    1 weight  0.10000E+01 volume  0.37148E-02 ppm1      2.827 ppm2      4.729 CV     1
 ASSI {  330}
   (( segid "    " and resid 107  and name HE2 ))
   (( segid "    " and resid 158  and name HB2 ))
      2.700     2.700     3.300 peak   330 spectrum    1 weight  0.10000E+01 volume  0.50304E-02 ppm1      2.826 ppm2      1.703 CV     1
 OR {  330}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 158  and name HB2 ))
 ASSI {  331}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 107  and name HD2 ))
      2.300     0.600     0.600 peak   331 spectrum    1 weight  0.10000E+01 volume  0.58285E-02 ppm1      2.823 ppm2      1.556 CV     1
 OR {  331}
   (( segid "    " and resid 107  and name HE2 ))
   (( segid "    " and resid 107  and name HD1 ))
 OR {  331}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 107  and name HD1 ))
 OR {  331}
   (( segid "    " and resid 107  and name HE2 ))
   (( segid "    " and resid 107  and name HD2 ))
 ASSI {  345}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 151  and name HB1 ))
      3.800     1.800     1.800 peak   345 spectrum    1 weight  0.10000E+01 volume  0.12998E-02 ppm1      1.215 ppm2      2.706 CV     1
 OR {  345}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 151  and name HB2 ))
 ASSI {  346}
   (( segid "    " and resid 89   and name HB2 ))
   (( segid "    " and resid 89   and name HB1 ))
      1.900     0.400     0.400 peak   346 spectrum    1 weight  0.10000E+01 volume  0.38698E-02 ppm1      1.209 ppm2      0.983 CV     1
 ASSI {  347}
   (( segid "    " and resid 89   and name HB2 ))
   (  segid "    " and resid 89   and name HD1%)
      3.000     1.100     1.100 peak   347 spectrum    1 weight  0.10000E+01 volume  0.25033E-02 ppm1      1.210 ppm2      0.545 CV     1
 ASSI {  349}
   (( segid "    " and resid 89   and name HB1 ))
   (  segid "    " and resid 89   and name HD1%)
      2.600     2.600     3.400 peak   349 spectrum    1 weight  0.10000E+01 volume  0.34934E-02 ppm1      0.996 ppm2      0.557 CV     1
 ASSI {  350}
   (( segid "    " and resid 89   and name HB1 ))
   (( segid "    " and resid 89   and name HA  ))
      3.200     1.300     1.300 peak   350 spectrum    1 weight  0.10000E+01 volume  0.12261E-02 ppm1      0.989 ppm2      4.170 CV     1
 ASSI {  352}
   (( segid "    " and resid 39   and name HB2 ))
   (( segid "    " and resid 39   and name HA  ))
      2.500     0.800     0.800 peak   352 spectrum    1 weight  0.10000E+01 volume  0.33794E-02 ppm1      3.296 ppm2      4.689 CV     1
 ASSI {  361}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
      3.300     1.300     1.300 peak   361 spectrum    1 weight  0.10000E+01 volume  0.16725E-02 ppm1      3.035 ppm2      9.513 CV     1
 ASSI {  362}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HD22))
      3.800     1.800     1.800 peak   362 spectrum    1 weight  0.10000E+01 volume  0.19795E-02 ppm1      3.034 ppm2      7.121 CV     1
 ASSI {  363}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HB1 ))
      1.700     0.400     0.500 peak   363 spectrum    1 weight  0.10000E+01 volume  0.11733E-01 ppm1      3.032 ppm2      2.581 CV     1
 ASSI {  364}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 71   and name HN  ))
      3.600     1.600     1.600 peak   364 spectrum    1 weight  0.10000E+01 volume  0.19323E-02 ppm1      3.031 ppm2      8.162 CV     1
 ASSI {  366}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HA  ))
      2.600     0.800     0.800 peak   366 spectrum    1 weight  0.10000E+01 volume  0.61991E-02 ppm1      3.023 ppm2      4.727 CV     1
 ASSI {  368}
   (( segid "    " and resid 59   and name HE2 ))
   (( segid "    " and resid 59   and name HB1 ))
      2.500     2.500     3.500 peak   368 spectrum    1 weight  0.10000E+01 volume  0.13309E-01 ppm1      3.021 ppm2      1.605 CV     1
 OR {  368}
   (( segid "    " and resid 59   and name HE1 ))
   (( segid "    " and resid 59   and name HB1 ))
 ASSI {  369}
   (( segid "    " and resid 10   and name HE2 ))
   (( segid "    " and resid 10   and name HG2 ))
      2.700     0.900     0.900 peak   369 spectrum    1 weight  0.10000E+01 volume  0.34473E-02 ppm1      3.022 ppm2      1.166 CV     1
 OR {  369}
   (( segid "    " and resid 10   and name HE2 ))
   (( segid "    " and resid 10   and name HG1 ))
 OR {  369}
   (( segid "    " and resid 10   and name HE1 ))
   (( segid "    " and resid 10   and name HG1 ))
 OR {  369}
   (( segid "    " and resid 10   and name HE1 ))
   (( segid "    " and resid 10   and name HG2 ))
 ASSI {  374}
   (( segid "    " and resid 39   and name HB1 ))
   (( segid "    " and resid 39   and name HB2 ))
      1.800     0.400     0.400 peak   374 spectrum    1 weight  0.10000E+01 volume  0.98048E-02 ppm1      2.993 ppm2      3.265 CV     1
 ASSI {  376}
   (( segid "    " and resid 91   and name HE1 ))
   (( segid "    " and resid 91   and name HG2 ))
      2.700     0.900     0.900 peak   376 spectrum    1 weight  0.10000E+01 volume  0.53249E-02 ppm1      2.943 ppm2      1.263 CV     1
 OR {  376}
   (( segid "    " and resid 91   and name HE2 ))
   (( segid "    " and resid 91   and name HG2 ))
 ASSI {  378}
   (( segid "    " and resid 91   and name HE1 ))
   (( segid "    " and resid 94   and name HB1 ))
      3.000     1.100     1.100 peak   378 spectrum    1 weight  0.10000E+01 volume  0.20863E-02 ppm1      2.924 ppm2      2.484 CV     1
 OR {  378}
   (( segid "    " and resid 91   and name HE2 ))
   (( segid "    " and resid 94   and name HB1 ))
 ASSI {  380}
   (( segid "    " and resid 91   and name HE1 ))
   (( segid "    " and resid 91   and name HD1 ))
      2.200     0.600     0.600 peak   380 spectrum    1 weight  0.10000E+01 volume  0.91801E-02 ppm1      2.891 ppm2      1.654 CV     1
 OR {  380}
   (( segid "    " and resid 91   and name HE2 ))
   (( segid "    " and resid 91   and name HD2 ))
 OR {  380}
   (( segid "    " and resid 91   and name HE2 ))
   (( segid "    " and resid 91   and name HD1 ))
 OR {  380}
   (( segid "    " and resid 91   and name HE1 ))
   (( segid "    " and resid 91   and name HD2 ))
 ASSI {  381}
   (( segid "    " and resid 91   and name HE1 ))
   (( segid "    " and resid 91   and name HG1 ))
      2.600     0.900     0.900 peak   381 spectrum    1 weight  0.10000E+01 volume  0.46982E-02 ppm1      2.894 ppm2      1.410 CV     1
 OR {  381}
   (( segid "    " and resid 91   and name HE2 ))
   (( segid "    " and resid 91   and name HG1 ))
 ASSI {  383}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 4    and name HB2 ))
      2.800     0.900     0.900 peak   383 spectrum    1 weight  0.10000E+01 volume  0.40316E-02 ppm1      2.888 ppm2      4.729 CV     1
 OR {  383}
   (( segid "    " and resid 7    and name HB2 ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI {  384}
   (( segid "    " and resid 91   and name HE1 ))
   (( segid "    " and resid 91   and name HA  ))
      3.600     1.600     1.600 peak   384 spectrum    1 weight  0.10000E+01 volume  0.12689E-02 ppm1      2.870 ppm2      3.606 CV     1
 OR {  384}
   (( segid "    " and resid 91   and name HE2 ))
   (( segid "    " and resid 91   and name HA  ))
 ASSI {  388}
   (( segid "    " and resid 107  and name HE1 ))
   (( segid "    " and resid 156  and name HB2 ))
      4.100     2.100     1.900 peak   388 spectrum    1 weight  0.10000E+01 volume  0.15178E-02 ppm1      2.789 ppm2      2.337 CV     1
 OR {  388}
   (( segid "    " and resid 107  and name HE2 ))
   (( segid "    " and resid 156  and name HB2 ))
 ASSI {  391}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 70   and name HN  ))
      2.600     0.800     0.800 peak   391 spectrum    1 weight  0.10000E+01 volume  0.21222E-02 ppm1      2.589 ppm2      9.513 CV     1
 ASSI {  393}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 70   and name HD22))
      3.700     1.700     1.700 peak   393 spectrum    1 weight  0.10000E+01 volume  0.20542E-02 ppm1      2.589 ppm2      7.121 CV     1
 ASSI {  395}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 85   and name HB  ))
      2.500     0.800     0.800 peak   395 spectrum    1 weight  0.10000E+01 volume  0.29512E-02 ppm1      2.588 ppm2      3.997 CV     1
 ASSI {  397}
   (( segid "    " and resid 70   and name HB1 ))
   (  segid "    " and resid 85   and name HG2%)
      3.400     1.500     1.500 peak   397 spectrum    1 weight  0.10000E+01 volume  0.13270E-02 ppm1      2.589 ppm2      1.068 CV     1
 ASSI {  398}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      2.700     0.900     0.900 peak   398 spectrum    1 weight  0.10000E+01 volume  0.21939E-02 ppm1      2.006 ppm2      4.238 CV     1
 ASSI {  400}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HG  ))
      2.700     0.900     0.900 peak   400 spectrum    1 weight  0.10000E+01 volume  0.38678E-02 ppm1      2.005 ppm2      1.582 CV     1
 ASSI {  401}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 43   and name HB1 ))
      1.600     0.300     0.600 peak   401 spectrum    1 weight  0.10000E+01 volume  0.10802E-01 ppm1      2.003 ppm2      1.420 CV     1
 ASSI {  402}
   (( segid "    " and resid 43   and name HB2 ))
   (  segid "    " and resid 43   and name HD2%)
      2.700     0.900     0.900 peak   402 spectrum    1 weight  0.10000E+01 volume  0.53089E-02 ppm1      2.001 ppm2      0.828 CV     1
 ASSI {  403}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 44   and name HD2%)
      2.500     0.800     0.800 peak   403 spectrum    1 weight  0.10000E+01 volume  0.58425E-02 ppm1      1.911 ppm2      0.796 CV     1
 OR {  403}
   (( segid "    " and resid 44   and name HB2 ))
   (  segid "    " and resid 44   and name HD1%)
 ASSI {  404}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      3.500     3.500     2.500 peak   404 spectrum    1 weight  0.10000E+01 volume  0.28965E-02 ppm1      1.909 ppm2      8.032 CV     1
 ASSI {  405}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 41   and name HA  ))
      3.100     3.100     2.900 peak   405 spectrum    1 weight  0.10000E+01 volume  0.26753E-02 ppm1      1.905 ppm2      3.823 CV     1
 ASSI {  406}
   (( segid "    " and resid 44   and name HB2 ))
   (( segid "    " and resid 44   and name HB1 ))
      1.700     0.400     0.500 peak   406 spectrum    1 weight  0.10000E+01 volume  0.11508E-01 ppm1      1.907 ppm2      1.526 CV     1
 ASSI {  409}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 102  and name HN  ))
      3.100     1.200     1.200 peak   409 spectrum    1 weight  0.10000E+01 volume  0.12520E-02 ppm1      1.676 ppm2      8.780 CV     1
 OR {  409}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 102  and name HN  ))
 ASSI {  411}
   (( segid "    " and resid 102  and name HB1 ))
   (  segid "    " and resid 106  and name HB% )
      2.700     0.900     0.900 peak   411 spectrum    1 weight  0.10000E+01 volume  0.25167E-02 ppm1      1.674 ppm2      1.117 CV     1
 OR {  411}
   (( segid "    " and resid 102  and name HB2 ))
   (  segid "    " and resid 106  and name HB% )
 ASSI {  412}
   (( segid "    " and resid 102  and name HB1 ))
   (( segid "    " and resid 155  and name HB2 ))
      2.900     2.900     3.100 peak   412 spectrum    1 weight  0.10000E+01 volume  0.43281E-02 ppm1      1.669 ppm2      2.887 CV     1
 OR {  412}
   (( segid "    " and resid 102  and name HB2 ))
   (( segid "    " and resid 155  and name HB2 ))
 ASSI {  413}
   (( segid "    " and resid 102  and name HB2 ))
   (  segid "    " and resid 102  and name HD2%)
      3.000     1.100     1.100 peak   413 spectrum    1 weight  0.10000E+01 volume  0.22373E-02 ppm1      1.647 ppm2      0.661 CV     1
 OR {  413}
   (( segid "    " and resid 102  and name HB1 ))
   (  segid "    " and resid 102  and name HD2%)
 ASSI {  414}
   (( segid "    " and resid 102  and name HB1 ))
   (  segid "    " and resid 102  and name HD1%)
      2.800     1.000     1.000 peak   414 spectrum    1 weight  0.10000E+01 volume  0.29581E-02 ppm1      1.658 ppm2      0.558 CV     1
 OR {  414}
   (( segid "    " and resid 102  and name HB2 ))
   (  segid "    " and resid 102  and name HD1%)
 ASSI {  419}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 48   and name HN  ))
      3.800     1.900     1.900 peak   419 spectrum    1 weight  0.10000E+01 volume  0.19335E-02 ppm1      1.533 ppm2      8.004 CV     1
 ASSI {  420}
   (( segid "    " and resid 44   and name HB1 ))
   (( segid "    " and resid 41   and name HA  ))
      3.300     3.300     2.700 peak   420 spectrum    1 weight  0.10000E+01 volume  0.26724E-02 ppm1      1.533 ppm2      3.820 CV     1
 ASSI {  425}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HN  ))
      2.900     1.100     1.100 peak   425 spectrum    1 weight  0.10000E+01 volume  0.17284E-02 ppm1      1.426 ppm2      6.990 CV     1
 ASSI {  428}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 43   and name HG  ))
      2.400     0.700     0.700 peak   428 spectrum    1 weight  0.10000E+01 volume  0.38727E-02 ppm1      1.426 ppm2      1.594 CV     1
 ASSI {  429}
   (( segid "    " and resid 43   and name HB1 ))
   (  segid "    " and resid 43   and name HD2%)
      2.300     0.700     0.700 peak   429 spectrum    1 weight  0.10000E+01 volume  0.58918E-02 ppm1      1.428 ppm2      0.819 CV     1
 ASSI {  433}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HB1 ))
      1.900     0.400     0.400 peak   433 spectrum    1 weight  0.10000E+01 volume  0.56898E-02 ppm1      2.823 ppm2      2.484 CV     1
 ASSI {  437}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 122  and name HA  ))
      2.500     0.800     0.800 peak   437 spectrum    1 weight  0.10000E+01 volume  0.22385E-02 ppm1      2.516 ppm2      4.565 CV     1
 ASSI {  439}
   (( segid "    " and resid 122  and name HB1 ))
   (( segid "    " and resid 132  and name HA  ))
      2.800     1.000     1.000 peak   439 spectrum    1 weight  0.10000E+01 volume  0.14950E-02 ppm1      2.516 ppm2      4.677 CV     1
 ASSI {  443}
   (( segid "    " and resid 148  and name HB1 ))
   (( segid "    " and resid 148  and name HA  ))
      3.200     1.300     1.300 peak   443 spectrum    1 weight  0.10000E+01 volume  0.14409E-02 ppm1      2.642 ppm2      4.793 CV     1
 ASSI {  446}
   (( segid "    " and resid 82   and name HB2 ))
   (( segid "    " and resid 82   and name HB1 ))
      2.000     0.500     0.500 peak   446 spectrum    1 weight  0.10000E+01 volume  0.44243E-02 ppm1      2.633 ppm2      1.844 CV     1
 ASSI {  450}
   (( segid "    " and resid 131  and name HE1 ))
   (  segid "    " and resid 111  and name HG2%)
      3.200     3.200     2.800 peak   450 spectrum    1 weight  0.10000E+01 volume  0.20442E-02 ppm1      2.065 ppm2      0.971 CV     1
 OR {  450}
   (( segid "    " and resid 131  and name HE2 ))
   (  segid "    " and resid 111  and name HG2%)
 ASSI {  453}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 25   and name HD1%)
      3.000     3.000     3.000 peak   453 spectrum    1 weight  0.10000E+01 volume  0.20639E-02 ppm1      1.842 ppm2      0.165 CV     1
 ASSI {  455}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 60   and name HN  ))
      3.100     1.200     1.200 peak   455 spectrum    1 weight  0.10000E+01 volume  0.20456E-02 ppm1      3.022 ppm2      8.232 CV     1
 ASSI {  459}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 59   and name HD1 ))
      3.000     1.100     1.100 peak   459 spectrum    1 weight  0.10000E+01 volume  0.19564E-02 ppm1      3.025 ppm2      1.224 CV     1
 OR {  459}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 59   and name HD2 ))
 ASSI {  461}
   (( segid "    " and resid 148  and name HB2 ))
   (( segid "    " and resid 148  and name HB1 ))
      1.800     0.400     0.400 peak   461 spectrum    1 weight  0.10000E+01 volume  0.10767E-01 ppm1      2.905 ppm2      2.679 CV     1
 ASSI {  462}
   (( segid "    " and resid 148  and name HB2 ))
   (( segid "    " and resid 148  and name HA  ))
      2.900     1.100     1.100 peak   462 spectrum    1 weight  0.10000E+01 volume  0.24359E-02 ppm1      2.899 ppm2      4.729 CV     1
 ASSI {  473}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 55   and name HB2 ))
      1.600     0.300     0.600 peak   473 spectrum    1 weight  0.10000E+01 volume  0.10784E-01 ppm1      2.488 ppm2      3.018 CV     1
 ASSI {  474}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 59   and name HD1 ))
      3.000     1.100     1.100 peak   474 spectrum    1 weight  0.10000E+01 volume  0.23269E-02 ppm1      2.490 ppm2      1.246 CV     1
 OR {  474}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 59   and name HD2 ))
 ASSI {  477}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 83   and name HB1 ))
      2.000     0.500     0.500 peak   477 spectrum    1 weight  0.10000E+01 volume  0.37690E-02 ppm1      2.326 ppm2      2.149 CV     1
 ASSI {  484}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HD21))
      3.100     1.200     1.200 peak   484 spectrum    1 weight  0.10000E+01 volume  0.15753E-02 ppm1      3.025 ppm2      7.441 CV     1
 ASSI {  485}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HA  ))
      2.600     0.800     0.800 peak   485 spectrum    1 weight  0.10000E+01 volume  0.48861E-02 ppm1      3.020 ppm2      4.980 CV     1
 ASSI {  486}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 48   and name HN  ))
      3.600     3.600     2.400 peak   486 spectrum    1 weight  0.10000E+01 volume  0.29323E-02 ppm1      3.022 ppm2      8.039 CV     1
 ASSI {  487}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HB1 ))
      1.600     0.300     0.600 peak   487 spectrum    1 weight  0.10000E+01 volume  0.22649E-01 ppm1      3.025 ppm2      2.632 CV     1
 ASSI {  489}
   (( segid "    " and resid 90   and name HB1 ))
   (( segid "    " and resid 90   and name HB2 ))
      1.900     0.500     0.500 peak   489 spectrum    1 weight  0.10000E+01 volume  0.72257E-02 ppm1      2.869 ppm2      3.069 CV     1
 ASSI {  490}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HB1 ))
      1.800     0.400     0.400 peak   490 spectrum    1 weight  0.10000E+01 volume  0.93983E-02 ppm1      2.867 ppm2      2.435 CV     1
 ASSI {  496}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 118  and name HD21))
      2.800     1.000     1.000 peak   496 spectrum    1 weight  0.10000E+01 volume  0.22572E-02 ppm1      2.629 ppm2      7.463 CV     1
 ASSI {  498}
   (( segid "    " and resid 118  and name HB1 ))
   (( segid "    " and resid 118  and name HA  ))
      2.800     1.000     1.000 peak   498 spectrum    1 weight  0.10000E+01 volume  0.30025E-02 ppm1      2.630 ppm2      4.973 CV     1
 ASSI {  510}
   (( segid "    " and resid 97   and name HB1 ))
   (( segid "    " and resid 97   and name HA  ))
      2.700     0.900     0.900 peak   510 spectrum    1 weight  0.10000E+01 volume  0.20983E-02 ppm1      1.780 ppm2      4.339 CV     1
 OR {  510}
   (( segid "    " and resid 97   and name HB2 ))
   (( segid "    " and resid 97   and name HA  ))
 ASSI {  512}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HD21))
      3.000     1.100     1.100 peak   512 spectrum    1 weight  0.10000E+01 volume  0.12339E-02 ppm1      3.062 ppm2      7.560 CV     1
 ASSI {  514}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HA  ))
      2.400     0.700     0.700 peak   514 spectrum    1 weight  0.10000E+01 volume  0.51419E-02 ppm1      3.060 ppm2      4.921 CV     1
 ASSI {  515}
   (( segid "    " and resid 45   and name HB2 ))
   (( segid "    " and resid 45   and name HB1 ))
      1.500     0.300     0.700 peak   515 spectrum    1 weight  0.10000E+01 volume  0.21797E-01 ppm1      3.063 ppm2      2.731 CV     1
 ASSI {  520}
   (( segid "    " and resid 127  and name HB2 ))
   (( segid "    " and resid 127  and name HA  ))
      2.500     0.800     0.800 peak   520 spectrum    1 weight  0.10000E+01 volume  0.26566E-02 ppm1      2.859 ppm2      4.827 CV     1
 ASSI {  522}
   (( segid "    " and resid 124  and name HB1 ))
   (( segid "    " and resid 124  and name HA  ))
      2.600     0.900     0.900 peak   522 spectrum    1 weight  0.10000E+01 volume  0.30042E-02 ppm1      2.802 ppm2      5.022 CV     1
 ASSI {  529}
   (( segid "    " and resid 156  and name HB2 ))
   (( segid "    " and resid 156  and name HB1 ))
      1.800     0.400     0.400 peak   529 spectrum    1 weight  0.10000E+01 volume  0.45105E-02 ppm1      2.360 ppm2      1.862 CV     1
 ASSI {  531}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 156  and name HA  ))
      2.900     1.000     1.000 peak   531 spectrum    1 weight  0.10000E+01 volume  0.14506E-02 ppm1      1.876 ppm2      4.181 CV     1
 ASSI {  533}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HB1 ))
      1.800     0.400     0.400 peak   533 spectrum    1 weight  0.10000E+01 volume  0.10707E-01 ppm1      3.131 ppm2      2.533 CV     1
 ASSI {  534}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HN  ))
      2.600     0.800     0.800 peak   534 spectrum    1 weight  0.10000E+01 volume  0.48454E-02 ppm1      3.127 ppm2      8.292 CV     1
 ASSI {  535}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HD21))
      2.700     0.900     0.900 peak   535 spectrum    1 weight  0.10000E+01 volume  0.21667E-02 ppm1      3.125 ppm2      7.769 CV     1
 ASSI {  536}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HD22))
      3.800     1.800     1.800 peak   536 spectrum    1 weight  0.10000E+01 volume  0.13530E-02 ppm1      3.127 ppm2      6.907 CV     1
 ASSI {  537}
   (( segid "    " and resid 101  and name HB2 ))
   (( segid "    " and resid 101  and name HA  ))
      2.300     0.700     0.700 peak   537 spectrum    1 weight  0.10000E+01 volume  0.53856E-02 ppm1      3.126 ppm2      4.797 CV     1
 ASSI {  540}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HB1 ))
      1.500     0.300     0.700 peak   540 spectrum    1 weight  0.10000E+01 volume  0.33531E-01 ppm1      3.118 ppm2      2.923 CV     1
 ASSI {  542}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 9    and name HA  ))
      2.500     0.800     0.800 peak   542 spectrum    1 weight  0.10000E+01 volume  0.50680E-02 ppm1      2.912 ppm2      4.698 CV     1
 OR {  542}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI {  543}
   (( segid "    " and resid 9    and name HB1 ))
   (( segid "    " and resid 12   and name HN  ))
      3.500     3.500     2.500 peak   543 spectrum    1 weight  0.10000E+01 volume  0.18435E-02 ppm1      2.903 ppm2      8.136 CV     1
 OR {  543}
   (( segid "    " and resid 9    and name HB2 ))
   (( segid "    " and resid 12   and name HN  ))
 ASSI {  544}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HN  ))
      2.400     0.700     0.700 peak   544 spectrum    1 weight  0.10000E+01 volume  0.30222E-02 ppm1      2.903 ppm2      7.656 CV     1
 ASSI {  545}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 29   and name HA  ))
      3.000     1.100     1.100 peak   545 spectrum    1 weight  0.10000E+01 volume  0.26297E-02 ppm1      2.894 ppm2      4.245 CV     1
 ASSI {  550}
   (( segid "    " and resid 127  and name HB2 ))
   (  segid "    " and resid 142  and name HG2%)
      3.400     3.400     2.600 peak   550 spectrum    1 weight  0.10000E+01 volume  0.21236E-02 ppm1      2.850 ppm2      1.166 CV     1
 ASSI {  553}
   (( segid "    " and resid 76   and name HB2 ))
   (( segid "    " and resid 75   and name HD21))
      2.800     1.000     1.000 peak   553 spectrum    1 weight  0.10000E+01 volume  0.21424E-02 ppm1      2.810 ppm2      7.560 CV     1
 ASSI {  555}
   (( segid "    " and resid 65   and name HB1 ))
   (  segid "    " and resid 65   and name HD% )
      2.700     0.900     0.900 peak   555 spectrum    1 weight  0.10000E+01 volume  0.30268E-02 ppm1      2.795 ppm2      7.084 CV     1
 ASSI {  571}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HD21))
      3.200     1.300     1.300 peak   571 spectrum    1 weight  0.10000E+01 volume  0.21084E-02 ppm1      2.533 ppm2      7.755 CV     1
 ASSI {  572}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HD22))
      3.900     1.900     1.900 peak   572 spectrum    1 weight  0.10000E+01 volume  0.15039E-02 ppm1      2.533 ppm2      6.877 CV     1
 ASSI {  573}
   (( segid "    " and resid 101  and name HB1 ))
   (( segid "    " and resid 101  and name HA  ))
      3.100     1.200     1.200 peak   573 spectrum    1 weight  0.10000E+01 volume  0.18288E-02 ppm1      2.530 ppm2      4.833 CV     1
 ASSI {  577}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HN  ))
      3.500     1.500     1.500 peak   577 spectrum    1 weight  0.10000E+01 volume  0.16179E-02 ppm1      2.462 ppm2      8.048 CV     1
 ASSI {  578}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HD21))
      3.400     1.400     1.400 peak   578 spectrum    1 weight  0.10000E+01 volume  0.14605E-02 ppm1      2.461 ppm2      7.023 CV     1
 OR {  578}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HD22))
 ASSI {  579}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 58   and name HA  ))
      2.700     0.900     0.900 peak   579 spectrum    1 weight  0.10000E+01 volume  0.22815E-02 ppm1      2.461 ppm2      4.729 CV     1
 ASSI {  580}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 151  and name HB1 ))
      2.400     0.700     0.700 peak   580 spectrum    1 weight  0.10000E+01 volume  0.84476E-02 ppm1      2.463 ppm2      2.679 CV     1
 OR {  580}
   (( segid "    " and resid 58   and name HB1 ))
   (( segid "    " and resid 151  and name HB2 ))
 ASSI {  583}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 18   and name HN  ))
      3.400     3.400     2.600 peak   583 spectrum    1 weight  0.10000E+01 volume  0.24818E-02 ppm1      1.977 ppm2      8.207 CV     1
 ASSI {  584}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
      3.400     1.500     1.500 peak   584 spectrum    1 weight  0.10000E+01 volume  0.14022E-02 ppm1      1.533 ppm2      4.729 CV     1
 ASSI {  586}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 113  and name HG11))
      2.700     0.900     0.900 peak   586 spectrum    1 weight  0.10000E+01 volume  0.22359E-02 ppm1      1.524 ppm2      1.293 CV     1
 OR {  586}
   (( segid "    " and resid 113  and name HB  ))
   (( segid "    " and resid 113  and name HG12))
 ASSI {  589}
   (( segid "    " and resid 26   and name HB2 ))
   (( segid "    " and resid 26   and name HA  ))
      2.700     0.900     0.900 peak   589 spectrum    1 weight  0.10000E+01 volume  0.25819E-02 ppm1      3.115 ppm2      4.602 CV     1
 ASSI {  591}
   (( segid "    " and resid 26   and name HB1 ))
   (( segid "    " and resid 26   and name HN  ))
      2.700     0.900     0.900 peak   591 spectrum    1 weight  0.10000E+01 volume  0.40528E-02 ppm1      2.928 ppm2      8.592 CV     1
 ASSI {  596}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HA  ))
      2.800     1.000     1.000 peak   596 spectrum    1 weight  0.10000E+01 volume  0.14292E-02 ppm1      2.435 ppm2      4.940 CV     1
 ASSI {  597}
   (( segid "    " and resid 53   and name HB1 ))
   (  segid "    " and resid 85   and name HG2%)
      3.300     3.300     2.700 peak   597 spectrum    1 weight  0.10000E+01 volume  0.33035E-02 ppm1      2.436 ppm2      1.081 CV     1
 ASSI {  599}
   (( segid "    " and resid 53   and name HB1 ))
   (  segid "    " and resid 53   and name HD% )
      3.000     1.100     1.100 peak   599 spectrum    1 weight  0.10000E+01 volume  0.17160E-02 ppm1      2.435 ppm2      6.827 CV     1
 ASSI {  600}
   (( segid "    " and resid 53   and name HB1 ))
   (( segid "    " and resid 53   and name HB2 ))
      1.800     0.400     0.400 peak   600 spectrum    1 weight  0.10000E+01 volume  0.67602E-02 ppm1      2.438 ppm2      3.831 CV     1
 ASSI {  603}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 49   and name HG11))
      2.300     0.700     0.700 peak   603 spectrum    1 weight  0.10000E+01 volume  0.75709E-02 ppm1      1.996 ppm2      1.400 CV     1
 OR {  603}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 49   and name HG12))
 ASSI {  606}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 11   and name HA  ))
      2.600     2.600     3.400 peak   606 spectrum    1 weight  0.10000E+01 volume  0.73099E-02 ppm1      1.980 ppm2      4.058 CV     1
 ASSI {  608}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 22   and name HA  ))
      3.200     3.200     2.800 peak   608 spectrum    1 weight  0.10000E+01 volume  0.19247E-02 ppm1      1.765 ppm2      4.320 CV     1
 ASSI {  610}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HN  ))
      2.400     0.700     0.700 peak   610 spectrum    1 weight  0.10000E+01 volume  0.41591E-02 ppm1      1.757 ppm2      8.348 CV     1
 ASSI {  612}
   (( segid "    " and resid 25   and name HB  ))
   (  segid "    " and resid 25   and name HD1%)
      2.600     2.600     3.400 peak   612 spectrum    1 weight  0.10000E+01 volume  0.47807E-02 ppm1      1.757 ppm2      0.152 CV     1
 ASSI {  614}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 80   and name HB1 ))
      1.800     0.400     0.400 peak   614 spectrum    1 weight  0.10000E+01 volume  0.42152E-02 ppm1      3.549 ppm2      2.751 CV     1
 ASSI {  615}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 156  and name HZ  ))
      3.500     1.600     1.600 peak   615 spectrum    1 weight  0.10000E+01 volume  0.13167E-02 ppm1      3.545 ppm2      7.181 CV     1
 ASSI {  616}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 107  and name HB1 ))
      4.400     2.500     1.600 peak   616 spectrum    1 weight  0.10000E+01 volume  0.12639E-02 ppm1      3.541 ppm2      0.992 CV     1
 ASSI {  619}
   (( segid "    " and resid 80   and name HB1 ))
   (( segid "    " and resid 80   and name HA  ))
      2.300     0.700     0.700 peak   619 spectrum    1 weight  0.10000E+01 volume  0.32634E-02 ppm1      2.770 ppm2      4.556 CV     1
 ASSI {  620}
   (( segid "    " and resid 80   and name HB2 ))
   (( segid "    " and resid 81   and name HN  ))
      3.000     1.100     1.100 peak   620 spectrum    1 weight  0.10000E+01 volume  0.17953E-02 ppm1      3.553 ppm2      8.775 CV     1
 ASSI {  624}
   (( segid "    " and resid 52   and name HB1 ))
   (( segid "    " and resid 53   and name HA  ))
      3.200     1.300     1.300 peak   624 spectrum    1 weight  0.10000E+01 volume  0.17715E-02 ppm1      2.321 ppm2      4.930 CV     1
 OR {  624}
   (( segid "    " and resid 52   and name HB2 ))
   (( segid "    " and resid 53   and name HA  ))
 ASSI {  632}
   (( segid "    " and resid 135  and name HB  ))
   (  segid "    " and resid 135  and name HD1%)
      2.500     0.800     0.800 peak   632 spectrum    1 weight  0.10000E+01 volume  0.72910E-02 ppm1      1.680 ppm2      0.829 CV     1
 ASSI {  633}
   (( segid "    " and resid 135  and name HB  ))
   (  segid "    " and resid 135  and name HG2%)
      3.100     1.200     1.200 peak   633 spectrum    1 weight  0.10000E+01 volume  0.12488E-02 ppm1      1.678 ppm2      0.625 CV     1
 ASSI {  639}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 139  and name HB1 ))
      2.800     1.000     1.000 peak   639 spectrum    1 weight  0.10000E+01 volume  0.23506E-02 ppm1      2.246 ppm2      1.849 CV     1
 OR {  639}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 139  and name HB1 ))
 ASSI {  640}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 39   and name HA  ))
      2.300     2.300     3.700 peak   640 spectrum    1 weight  0.10000E+01 volume  0.45326E-02 ppm1      2.235 ppm2      4.719 CV     1
 ASSI {  643}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name HG12))
      2.200     0.600     0.600 peak   643 spectrum    1 weight  0.10000E+01 volume  0.62381E-02 ppm1      2.216 ppm2      1.686 CV     1
 OR {  643}
   (( segid "    " and resid 42   and name HB  ))
   (( segid "    " and resid 42   and name HG11))
 ASSI {  644}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HD1%)
      3.000     1.100     1.100 peak   644 spectrum    1 weight  0.10000E+01 volume  0.67058E-02 ppm1      2.218 ppm2      0.935 CV     1
 ASSI {  645}
   (( segid "    " and resid 42   and name HB  ))
   (  segid "    " and resid 42   and name HG2%)
      2.500     0.800     0.800 peak   645 spectrum    1 weight  0.10000E+01 volume  0.36953E-02 ppm1      2.217 ppm2      0.781 CV     1
 ASSI {  647}
   (( segid "    " and resid 152  and name HB2 ))
   (( segid "    " and resid 152  and name HA  ))
      2.400     0.700     0.700 peak   647 spectrum    1 weight  0.10000E+01 volume  0.30996E-02 ppm1      1.825 ppm2      4.778 CV     1
 ASSI {  649}
   (( segid "    " and resid 152  and name HB2 ))
   (( segid "    " and resid 152  and name HG1 ))
      2.300     0.600     0.600 peak   649 spectrum    1 weight  0.10000E+01 volume  0.39314E-02 ppm1      1.825 ppm2      1.253 CV     1
 OR {  649}
   (( segid "    " and resid 152  and name HB2 ))
   (( segid "    " and resid 152  and name HG2 ))
 ASSI {  653}
   (( segid "    " and resid 60   and name HB2 ))
   (( segid "    " and resid 61   and name HN  ))
      3.600     1.600     1.600 peak   653 spectrum    1 weight  0.10000E+01 volume  0.15191E-02 ppm1      1.695 ppm2      8.184 CV     1
 OR {  653}
   (( segid "    " and resid 60   and name HB1 ))
   (( segid "    " and resid 61   and name HN  ))
 ASSI {  654}
   (( segid "    " and resid 152  and name HB1 ))
   (( segid "    " and resid 152  and name HA  ))
      2.300     0.700     0.700 peak   654 spectrum    1 weight  0.10000E+01 volume  0.30365E-02 ppm1      1.691 ppm2      4.787 CV     1
 ASSI {  658}
   (( segid "    " and resid 152  and name HB1 ))
   (( segid "    " and resid 60   and name HA  ))
      3.500     1.600     1.600 peak   658 spectrum    1 weight  0.10000E+01 volume  0.16671E-02 ppm1      1.631 ppm2      5.315 CV     1
 ASSI {  664}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HD22))
      3.700     1.700     1.700 peak   664 spectrum    1 weight  0.10000E+01 volume  0.13469E-02 ppm1      3.501 ppm2      7.084 CV     1
 ASSI {  665}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 91   and name HA  ))
      2.400     2.400     3.600 peak   665 spectrum    1 weight  0.10000E+01 volume  0.66199E-02 ppm1      3.457 ppm2      3.603 CV     1
 ASSI {  667}
   (( segid "    " and resid 94   and name HB2 ))
   (( segid "    " and resid 94   and name HB1 ))
      2.100     0.500     0.500 peak   667 spectrum    1 weight  0.10000E+01 volume  0.37375E-02 ppm1      3.455 ppm2      2.467 CV     1
 ASSI {  669}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 95   and name HN  ))
      2.600     0.800     0.800 peak   669 spectrum    1 weight  0.10000E+01 volume  0.18062E-02 ppm1      2.493 ppm2      8.557 CV     1
 ASSI {  670}
   (( segid "    " and resid 117  and name HB2 ))
   (( segid "    " and resid 117  and name HB1 ))
      1.900     0.400     0.400 peak   670 spectrum    1 weight  0.10000E+01 volume  0.83480E-02 ppm1      3.051 ppm2      2.861 CV     1
 ASSI {  671}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HD21))
      2.800     1.000     1.000 peak   671 spectrum    1 weight  0.10000E+01 volume  0.19452E-02 ppm1      3.042 ppm2      7.598 CV     1
 ASSI {  672}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HA  ))
      2.400     0.700     0.700 peak   672 spectrum    1 weight  0.10000E+01 volume  0.39067E-02 ppm1      3.042 ppm2      4.273 CV     1
 ASSI {  673}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HD22))
      3.700     1.700     1.700 peak   673 spectrum    1 weight  0.10000E+01 volume  0.13551E-02 ppm1      3.032 ppm2      7.084 CV     1
 ASSI {  674}
   (( segid "    " and resid 112  and name HB1 ))
   (( segid "    " and resid 112  and name HB2 ))
      1.900     0.500     0.500 peak   674 spectrum    1 weight  0.10000E+01 volume  0.62633E-02 ppm1      3.036 ppm2      3.507 CV     1
 ASSI {  679}
   (( segid "    " and resid 117  and name HB1 ))
   (( segid "    " and resid 117  and name HD21))
      3.100     1.200     1.200 peak   679 spectrum    1 weight  0.10000E+01 volume  0.14724E-02 ppm1      2.870 ppm2      7.609 CV     1
 ASSI {  680}
   (( segid "    " and resid 117  and name HB1 ))
   (  segid "    " and resid 83   and name HE% )
      3.700     1.700     1.700 peak   680 spectrum    1 weight  0.10000E+01 volume  0.13606E-02 ppm1      2.871 ppm2      6.389 CV     1
 ASSI {  682}
   (( segid "    " and resid 35   and name HB2 ))
   (( segid "    " and resid 35   and name HB1 ))
      1.900     0.400     0.400 peak   682 spectrum    1 weight  0.10000E+01 volume  0.48291E-02 ppm1      2.699 ppm2      2.416 CV     1
 ASSI {  688}
   (( segid "    " and resid 153  and name HB  ))
   (( segid "    " and resid 153  and name HN  ))
      2.600     0.900     0.900 peak   688 spectrum    1 weight  0.10000E+01 volume  0.36097E-02 ppm1      2.504 ppm2      8.886 CV     1
 ASSI {  691}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 94   and name HN  ))
      2.600     0.800     0.800 peak   691 spectrum    1 weight  0.10000E+01 volume  0.28192E-02 ppm1      2.504 ppm2      8.383 CV     1
 ASSI {  693}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 94   and name HA  ))
      3.300     1.400     1.400 peak   693 spectrum    1 weight  0.10000E+01 volume  0.17882E-02 ppm1      2.494 ppm2      3.824 CV     1
 ASSI {  695}
   (( segid "    " and resid 153  and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
      2.900     1.100     1.100 peak   695 spectrum    1 weight  0.10000E+01 volume  0.13622E-02 ppm1      2.494 ppm2      4.750 CV     1
 ASSI {  701}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 97   and name HB1 ))
      2.200     2.200     3.800 peak   701 spectrum    1 weight  0.10000E+01 volume  0.16487E-02 ppm1      2.280 ppm2      1.752 CV     1
 OR {  701}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 97   and name HB2 ))
 OR {  701}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 97   and name HB1 ))
 OR {  701}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI {  703}
   (( segid "    " and resid 139  and name HG2 ))
   (( segid "    " and resid 142  and name HN  ))
      3.600     1.600     1.600 peak   703 spectrum    1 weight  0.10000E+01 volume  0.13276E-02 ppm1      2.276 ppm2      7.163 CV     1
 OR {  703}
   (( segid "    " and resid 139  and name HG1 ))
   (( segid "    " and resid 142  and name HN  ))
 ASSI {  707}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 38   and name HD2%)
      2.100     2.100     3.900 peak   707 spectrum    1 weight  0.10000E+01 volume  0.23963E-02 ppm1      1.754 ppm2      0.163 CV     1
 ASSI {  711}
   (( segid "    " and resid 71   and name HB  ))
   (  segid "    " and resid 71   and name HG1%)
      2.400     0.700     0.700 peak   711 spectrum    1 weight  0.10000E+01 volume  0.55217E-02 ppm1      1.754 ppm2      0.561 CV     1
 ASSI {  716}
   (( segid "    " and resid 131  and name HB2 ))
   (( segid "    " and resid 131  and name HN  ))
      3.400     1.500     1.500 peak   716 spectrum    1 weight  0.10000E+01 volume  0.16777E-02 ppm1      2.113 ppm2      9.610 CV     1
 ASSI {  717}
   (( segid "    " and resid 119  and name HB  ))
   (  segid "    " and resid 119  and name HG2%)
      2.700     0.900     0.900 peak   717 spectrum    1 weight  0.10000E+01 volume  0.25065E-02 ppm1      1.951 ppm2      0.575 CV     1
 ASSI {  719}
   (( segid "    " and resid 119  and name HB  ))
   (  segid "    " and resid 156  and name HD% )
      3.300     1.400     1.400 peak   719 spectrum    1 weight  0.10000E+01 volume  0.13015E-02 ppm1      1.945 ppm2      6.788 CV     1
 ASSI {  720}
   (( segid "    " and resid 119  and name HB  ))
   (( segid "    " and resid 119  and name HG12))
      2.800     1.000     1.000 peak   720 spectrum    1 weight  0.10000E+01 volume  0.22120E-02 ppm1      1.947 ppm2      1.571 CV     1
 ASSI {  721}
   (( segid "    " and resid 119  and name HB  ))
   (( segid "    " and resid 119  and name HG11))
      2.700     0.900     0.900 peak   721 spectrum    1 weight  0.10000E+01 volume  0.27395E-02 ppm1      1.949 ppm2      1.128 CV     1
 ASSI {  724}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HB2 ))
      1.900     0.400     0.400 peak   724 spectrum    1 weight  0.10000E+01 volume  0.44387E-02 ppm1      1.590 ppm2      2.093 CV     1
 OR {  724}
   (( segid "    " and resid 131  and name HB1 ))
   (( segid "    " and resid 131  and name HE1 ))
 ASSI {  725}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 61   and name HN  ))
      2.800     2.800     3.200 peak   725 spectrum    1 weight  0.10000E+01 volume  0.25658E-02 ppm1      1.531 ppm2      8.171 CV     1
 ASSI {  726}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 61   and name HA  ))
      2.600     0.800     0.800 peak   726 spectrum    1 weight  0.10000E+01 volume  0.13699E-02 ppm1      1.532 ppm2      4.571 CV     1
 ASSI {  733}
   (( segid "    " and resid 116  and name HG2 ))
   (  segid "    " and resid 62   and name HG2%)
      3.200     1.200     1.200 peak   733 spectrum    1 weight  0.10000E+01 volume  0.13472E-02 ppm1      1.480 ppm2     -0.006 CV     1
 ASSI {  734}
   (( segid "    " and resid 116  and name HG1 ))
   (( segid "    " and resid 116  and name HG2 ))
      2.100     0.500     0.500 peak   734 spectrum    1 weight  0.10000E+01 volume  0.39534E-02 ppm1      1.373 ppm2      1.459 CV     1
 ASSI {  735}
   (( segid "    " and resid 116  and name HG1 ))
   (  segid "    " and resid 62   and name HG2%)
      3.300     3.300     2.700 peak   735 spectrum    1 weight  0.10000E+01 volume  0.14448E-02 ppm1      1.376 ppm2     -0.006 CV     1
 ASSI {  736}
   (( segid "    " and resid 116  and name HG1 ))
   (( segid "    " and resid 116  and name HB2 ))
      3.100     1.200     1.200 peak   736 spectrum    1 weight  0.10000E+01 volume  0.14763E-02 ppm1      1.368 ppm2      1.215 CV     1
 ASSI {  737}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HA  ))
      2.800     1.000     1.000 peak   737 spectrum    1 weight  0.10000E+01 volume  0.16338E-02 ppm1      2.621 ppm2      3.804 CV     1
 ASSI {  738}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HG1 ))
      1.900     0.400     0.400 peak   738 spectrum    1 weight  0.10000E+01 volume  0.75809E-02 ppm1      2.618 ppm2      2.480 CV     1
 ASSI {  739}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HB1 ))
      2.900     1.000     1.000 peak   739 spectrum    1 weight  0.10000E+01 volume  0.16788E-02 ppm1      2.613 ppm2      2.174 CV     1
 ASSI {  744}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 112  and name HB1 ))
      3.600     1.600     1.600 peak   744 spectrum    1 weight  0.10000E+01 volume  0.17430E-02 ppm1      2.464 ppm2      3.021 CV     1
 ASSI {  745}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 15   and name HB  ))
      3.200     3.200     2.800 peak   745 spectrum    1 weight  0.10000E+01 volume  0.28591E-02 ppm1      2.460 ppm2      1.996 CV     1
 OR {  745}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 15   and name HB  ))
 OR {  745}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 15   and name HG11))
 OR {  745}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 15   and name HG11))
 OR {  745}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 15   and name HG12))
 ASSI {  750}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 152  and name HB2 ))
      3.300     1.400     1.400 peak   750 spectrum    1 weight  0.10000E+01 volume  0.16269E-02 ppm1      2.179 ppm2      1.828 CV     1
 ASSI {  753}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HB1 ))
      1.800     0.400     0.400 peak   753 spectrum    1 weight  0.10000E+01 volume  0.64864E-02 ppm1      2.162 ppm2      1.508 CV     1
 ASSI {  755}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 60   and name HG1 ))
      3.500     3.500     2.500 peak   755 spectrum    1 weight  0.10000E+01 volume  0.20078E-02 ppm1      2.161 ppm2      0.775 CV     1
 OR {  755}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI {  759}
   (( segid "    " and resid 158  and name HB1 ))
   (( segid "    " and resid 107  and name HA  ))
      3.100     3.100     2.900 peak   759 spectrum    1 weight  0.10000E+01 volume  0.28182E-02 ppm1      1.881 ppm2      3.948 CV     1
 ASSI {  761}
   (( segid "    " and resid 158  and name HB1 ))
   (( segid "    " and resid 158  and name HG1 ))
      2.700     0.900     0.900 peak   761 spectrum    1 weight  0.10000E+01 volume  0.24655E-02 ppm1      1.881 ppm2      1.361 CV     1
 OR {  761}
   (( segid "    " and resid 158  and name HB1 ))
   (( segid "    " and resid 158  and name HG2 ))
 ASSI {  762}
   (( segid "    " and resid 158  and name HB2 ))
   (( segid "    " and resid 107  and name HA  ))
      2.900     2.900     3.100 peak   762 spectrum    1 weight  0.10000E+01 volume  0.21992E-02 ppm1      1.706 ppm2      3.939 CV     1
 ASSI {  763}
   (( segid "    " and resid 158  and name HB2 ))
   (( segid "    " and resid 158  and name HB1 ))
      1.500     0.300     0.700 peak   763 spectrum    1 weight  0.10000E+01 volume  0.15970E-01 ppm1      1.706 ppm2      1.849 CV     1
 ASSI {  764}
   (( segid "    " and resid 158  and name HB2 ))
   (( segid "    " and resid 158  and name HG2 ))
      2.700     0.900     0.900 peak   764 spectrum    1 weight  0.10000E+01 volume  0.22613E-02 ppm1      1.705 ppm2      1.312 CV     1
 OR {  764}
   (( segid "    " and resid 158  and name HB2 ))
   (( segid "    " and resid 158  and name HG1 ))
 ASSI {  766}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 60   and name HG1 ))
      3.400     3.400     2.600 peak   766 spectrum    1 weight  0.10000E+01 volume  0.23866E-02 ppm1      1.521 ppm2      0.775 CV     1
 OR {  766}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 60   and name HG2 ))
 ASSI {  767}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HD2 ))
      2.800     1.000     1.000 peak   767 spectrum    1 weight  0.10000E+01 volume  0.25698E-02 ppm1      1.512 ppm2      1.654 CV     1
 OR {  767}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HD1 ))
 ASSI {  774}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 35   and name HN  ))
      2.800     1.000     1.000 peak   774 spectrum    1 weight  0.10000E+01 volume  0.41307E-02 ppm1      2.240 ppm2      8.870 CV     1
 OR {  774}
   (( segid "    " and resid 32   and name HG1 ))
   (( segid "    " and resid 35   and name HN  ))
 ASSI {  775}
   (( segid "    " and resid 32   and name HG1 ))
   (( segid "    " and resid 32   and name HN  ))
      3.100     1.200     1.200 peak   775 spectrum    1 weight  0.10000E+01 volume  0.17915E-02 ppm1      2.240 ppm2      8.045 CV     1
 OR {  775}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 32   and name HN  ))
 ASSI {  776}
   (( segid "    " and resid 111  and name HB  ))
   (( segid "    " and resid 111  and name HA  ))
      2.700     0.900     0.900 peak   776 spectrum    1 weight  0.10000E+01 volume  0.15357E-02 ppm1      2.241 ppm2      4.729 CV     1
 ASSI {  782}
   (( segid "    " and resid 32   and name HG1 ))
   (( segid "    " and resid 32   and name HB1 ))
      2.700     0.900     0.900 peak   782 spectrum    1 weight  0.10000E+01 volume  0.25429E-02 ppm1      2.236 ppm2      2.484 CV     1
 OR {  782}
   (( segid "    " and resid 32   and name HG2 ))
   (( segid "    " and resid 32   and name HB1 ))
 ASSI {  785}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 86   and name HB2 ))
      2.800     2.800     3.200 peak   785 spectrum    1 weight  0.10000E+01 volume  0.11413E-01 ppm1      2.009 ppm2      1.800 CV     1
 ASSI {  792}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HB1 ))
      1.800     0.400     0.400 peak   792 spectrum    1 weight  0.10000E+01 volume  0.67671E-02 ppm1      1.722 ppm2      0.930 CV     1
 ASSI {  793}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HN  ))
      2.500     0.800     0.800 peak   793 spectrum    1 weight  0.10000E+01 volume  0.31385E-02 ppm1      1.724 ppm2      8.174 CV     1
 ASSI {  795}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HG2 ))
      2.800     1.000     1.000 peak   795 spectrum    1 weight  0.10000E+01 volume  0.18391E-02 ppm1      1.710 ppm2      1.166 CV     1
 OR {  795}
   (( segid "    " and resid 10   and name HB2 ))
   (( segid "    " and resid 10   and name HG1 ))
 ASSI {  799}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 107  and name HE2 ))
      3.300     1.400     1.400 peak   799 spectrum    1 weight  0.10000E+01 volume  0.14121E-02 ppm1      1.090 ppm2      2.777 CV     1
 OR {  799}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 107  and name HE1 ))
 ASSI {  800}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 107  and name HN  ))
      3.100     1.200     1.200 peak   800 spectrum    1 weight  0.10000E+01 volume  0.17401E-02 ppm1      1.029 ppm2      9.364 CV     1
 ASSI {  801}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 107  and name HA  ))
      2.600     0.800     0.800 peak   801 spectrum    1 weight  0.10000E+01 volume  0.25493E-02 ppm1      1.028 ppm2      3.969 CV     1
 ASSI {  802}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 107  and name HG2 ))
      2.900     1.000     1.000 peak   802 spectrum    1 weight  0.10000E+01 volume  0.12660E-02 ppm1      1.032 ppm2      0.727 CV     1
 OR {  802}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 107  and name HG1 ))
 OR {  802}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 107  and name HG2 ))
 OR {  802}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 107  and name HG1 ))
 ASSI {  805}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HG1 ))
      2.900     1.100     1.100 peak   805 spectrum    1 weight  0.10000E+01 volume  0.14485E-02 ppm1      0.923 ppm2      1.166 CV     1
 OR {  805}
   (( segid "    " and resid 10   and name HB1 ))
   (( segid "    " and resid 10   and name HG2 ))
 ASSI {  814}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 157  and name HG1 ))
      2.800     2.800     3.200 peak   814 spectrum    1 weight  0.10000E+01 volume  0.98131E-02 ppm1      1.058 ppm2      2.191 CV     1
 OR {  814}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 157  and name HG2 ))
 OR {  814}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 157  and name HG1 ))
 OR {  814}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 157  and name HG2 ))
 ASSI {  817}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 88   and name HB2 ))
      3.700     1.700     1.700 peak   817 spectrum    1 weight  0.10000E+01 volume  0.28019E-02 ppm1      2.544 ppm2      2.044 CV     1
 ASSI {  819}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 86   and name HB2 ))
      3.300     1.300     1.300 peak   819 spectrum    1 weight  0.10000E+01 volume  0.22587E-02 ppm1      2.527 ppm2      1.849 CV     1
 ASSI {  820}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HD2 ))
      3.200     1.300     1.300 peak   820 spectrum    1 weight  0.10000E+01 volume  0.12322E-02 ppm1      2.522 ppm2      3.021 CV     1
 OR {  820}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HD1 ))
 ASSI {  821}
   (( segid "    " and resid 64   and name HB2 ))
   (( segid "    " and resid 64   and name HG1 ))
      2.700     0.900     0.900 peak   821 spectrum    1 weight  0.10000E+01 volume  0.32777E-02 ppm1      2.519 ppm2      1.654 CV     1
 ASSI {  824}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HA  ))
      2.700     0.900     0.900 peak   824 spectrum    1 weight  0.10000E+01 volume  0.48027E-02 ppm1      2.351 ppm2      4.389 CV     1
 ASSI {  825}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HG2 ))
      2.400     0.700     0.700 peak   825 spectrum    1 weight  0.10000E+01 volume  0.38930E-02 ppm1      2.351 ppm2      2.078 CV     1
 OR {  825}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HG1 ))
 ASSI {  826}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HB1 ))
      1.600     0.300     0.600 peak   826 spectrum    1 weight  0.10000E+01 volume  0.12797E-01 ppm1      2.348 ppm2      1.808 CV     1
 ASSI {  840}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HB2 ))
      1.600     0.300     0.600 peak   840 spectrum    1 weight  0.10000E+01 volume  0.72707E-02 ppm1      1.019 ppm2      2.533 CV     1
 ASSI {  841}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 156  and name HB1 ))
      3.300     1.300     1.300 peak   841 spectrum    1 weight  0.10000E+01 volume  0.15685E-02 ppm1      1.014 ppm2      1.849 CV     1
 ASSI {  842}
   (( segid "    " and resid 64   and name HB1 ))
   (( segid "    " and resid 64   and name HG1 ))
      2.200     0.600     0.600 peak   842 spectrum    1 weight  0.10000E+01 volume  0.28947E-02 ppm1      1.012 ppm2      1.654 CV     1
 ASSI {  843}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HN  ))
      3.400     1.400     1.400 peak   843 spectrum    1 weight  0.10000E+01 volume  0.27346E-02 ppm1      2.771 ppm2      8.536 CV     1
 ASSI {  844}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HA  ))
      3.100     1.200     1.200 peak   844 spectrum    1 weight  0.10000E+01 volume  0.16518E-02 ppm1      2.771 ppm2      4.095 CV     1
 ASSI {  845}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HG1 ))
      1.600     0.300     0.600 peak   845 spectrum    1 weight  0.10000E+01 volume  0.22793E-01 ppm1      2.775 ppm2      2.630 CV     1
 ASSI {  846}
   (( segid "    " and resid 19   and name HG2 ))
   (( segid "    " and resid 19   and name HB1 ))
      2.400     0.700     0.700 peak   846 spectrum    1 weight  0.10000E+01 volume  0.59307E-02 ppm1      2.772 ppm2      2.191 CV     1
 ASSI {  847}
   (( segid "    " and resid 19   and name HG2 ))
   (  segid "    " and resid 15   and name HG2%)
      2.100     2.100     3.900 peak   847 spectrum    1 weight  0.10000E+01 volume  0.22193E-02 ppm1      2.770 ppm2      0.971 CV     1
 ASSI {  848}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 19   and name HN  ))
      3.600     1.600     1.600 peak   848 spectrum    1 weight  0.10000E+01 volume  0.25518E-02 ppm1      2.654 ppm2      8.536 CV     1
 ASSI {  849}
   (( segid "    " and resid 19   and name HG1 ))
   (  segid "    " and resid 15   and name HG2%)
      3.100     3.100     2.900 peak   849 spectrum    1 weight  0.10000E+01 volume  0.17720E-02 ppm1      2.654 ppm2      0.971 CV     1
 ASSI {  851}
   (( segid "    " and resid 19   and name HG1 ))
   (( segid "    " and resid 19   and name HB1 ))
      2.600     0.800     0.800 peak   851 spectrum    1 weight  0.10000E+01 volume  0.51533E-02 ppm1      2.650 ppm2      2.191 CV     1
 ASSI {  854}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 15   and name HA  ))
      3.000     3.000     3.000 peak   854 spectrum    1 weight  0.10000E+01 volume  0.22850E-02 ppm1      2.202 ppm2      3.447 CV     1
 OR {  854}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  859}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HA  ))
      2.500     0.800     0.800 peak   859 spectrum    1 weight  0.10000E+01 volume  0.24301E-02 ppm1      2.161 ppm2      4.868 CV     1
 OR {  859}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HA  ))
 ASSI {  870}
   (( segid "    " and resid 73   and name HB1 ))
   (  segid "    " and resid 38   and name HD2%)
      2.100     2.100     3.900 peak   870 spectrum    1 weight  0.10000E+01 volume  0.22803E-02 ppm1      2.161 ppm2      0.135 CV     1
 ASSI {  879}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 131  and name HE2 ))
      3.500     3.500     2.500 peak   879 spectrum    1 weight  0.10000E+01 volume  0.18763E-02 ppm1      1.890 ppm2      2.044 CV     1
 OR {  879}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 131  and name HE1 ))
 ASSI {  882}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 139  and name HB2 ))
      1.800     0.400     0.400 peak   882 spectrum    1 weight  0.10000E+01 volume  0.76070E-02 ppm1      1.867 ppm2      2.386 CV     1
 ASSI {  883}
   (( segid "    " and resid 157  and name HB2 ))
   (( segid "    " and resid 157  and name HG2 ))
      2.500     0.800     0.800 peak   883 spectrum    1 weight  0.10000E+01 volume  0.51751E-02 ppm1      1.749 ppm2      2.158 CV     1
 OR {  883}
   (( segid "    " and resid 157  and name HB2 ))
   (( segid "    " and resid 157  and name HG1 ))
 ASSI {  885}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HN  ))
      2.900     1.100     1.100 peak   885 spectrum    1 weight  0.10000E+01 volume  0.17187E-02 ppm1      2.244 ppm2      8.537 CV     1
 ASSI {  887}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HA  ))
      2.700     0.900     0.900 peak   887 spectrum    1 weight  0.10000E+01 volume  0.19983E-02 ppm1      2.245 ppm2      4.069 CV     1
 ASSI {  888}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HG2 ))
      2.900     1.100     1.100 peak   888 spectrum    1 weight  0.10000E+01 volume  0.21591E-02 ppm1      2.240 ppm2      2.777 CV     1
 OR {  888}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 19   and name HG2 ))
 ASSI {  892}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 19   and name HN  ))
      2.800     1.000     1.000 peak   892 spectrum    1 weight  0.10000E+01 volume  0.18126E-02 ppm1      2.175 ppm2      8.539 CV     1
 ASSI {  896}
   (( segid "    " and resid 157  and name HB1 ))
   (( segid "    " and resid 157  and name HG2 ))
      2.800     1.000     1.000 peak   896 spectrum    1 weight  0.10000E+01 volume  0.18364E-02 ppm1      1.631 ppm2      2.143 CV     1
 OR {  896}
   (( segid "    " and resid 157  and name HB1 ))
   (( segid "    " and resid 157  and name HG1 ))
 ASSI {  901}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 33   and name HN  ))
      3.100     1.200     1.200 peak   901 spectrum    1 weight  0.10000E+01 volume  0.15094E-02 ppm1      2.188 ppm2      8.782 CV     1
 ASSI {  902}
   (( segid "    " and resid 15   and name HG12))
   (( segid "    " and resid 15   and name HA  ))
      2.900     1.100     1.100 peak   902 spectrum    1 weight  0.10000E+01 volume  0.18670E-02 ppm1      1.967 ppm2      3.465 CV     1
 OR {  902}
   (( segid "    " and resid 15   and name HG11))
   (( segid "    " and resid 15   and name HA  ))
 ASSI {  904}
   (( segid "    " and resid 15   and name HG11))
   (( segid "    " and resid 15   and name HN  ))
      2.700     0.900     0.900 peak   904 spectrum    1 weight  0.10000E+01 volume  0.26891E-02 ppm1      1.973 ppm2      8.435 CV     1
 OR {  904}
   (( segid "    " and resid 15   and name HG12))
   (( segid "    " and resid 15   and name HN  ))
 ASSI {  932}
   (( segid "    " and resid 32   and name HB1 ))
   (( segid "    " and resid 32   and name HA  ))
      2.500     0.800     0.800 peak   932 spectrum    1 weight  0.10000E+01 volume  0.33476E-02 ppm1      2.498 ppm2      4.680 CV     1
 ASSI {  935}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 32   and name HN  ))
      2.900     1.000     1.000 peak   935 spectrum    1 weight  0.10000E+01 volume  0.21389E-02 ppm1      2.187 ppm2      8.053 CV     1
 ASSI {  936}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 32   and name HA  ))
      3.300     1.400     1.400 peak   936 spectrum    1 weight  0.10000E+01 volume  0.12977E-02 ppm1      2.179 ppm2      4.674 CV     1
 ASSI {  937}
   (( segid "    " and resid 32   and name HB2 ))
   (( segid "    " and resid 32   and name HB1 ))
      1.800     0.400     0.400 peak   937 spectrum    1 weight  0.10000E+01 volume  0.69264E-02 ppm1      2.180 ppm2      2.469 CV     1
 ASSI {  940}
   (( segid "    " and resid 42   and name HG11))
   (( segid "    " and resid 41   and name HB  ))
      3.200     3.200     2.800 peak   940 spectrum    1 weight  0.10000E+01 volume  0.19350E-02 ppm1      1.695 ppm2      4.299 CV     1
 OR {  940}
   (( segid "    " and resid 42   and name HG12))
   (( segid "    " and resid 41   and name HB  ))
 ASSI {  947}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 58   and name HB2 ))
      2.500     2.500     3.500 peak   947 spectrum    1 weight  0.10000E+01 volume  0.34238E-02 ppm1      1.608 ppm2      2.777 CV     1
 ASSI {  951}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 10   and name HG1 ))
      2.500     0.800     0.800 peak   951 spectrum    1 weight  0.10000E+01 volume  0.37744E-02 ppm1      1.510 ppm2      1.166 CV     1
 OR {  951}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 10   and name HG2 ))
 OR {  951}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 10   and name HG1 ))
 OR {  951}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 10   and name HG2 ))
 ASSI {  952}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 10   and name HE1 ))
      2.500     0.800     0.800 peak   952 spectrum    1 weight  0.10000E+01 volume  0.38761E-02 ppm1      1.502 ppm2      3.023 CV     1
 OR {  952}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 10   and name HE1 ))
 OR {  952}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 10   and name HE2 ))
 OR {  952}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 10   and name HE2 ))
 ASSI {  953}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 100  and name HB1 ))
      3.200     1.300     1.300 peak   953 spectrum    1 weight  0.10000E+01 volume  0.13486E-02 ppm1      1.500 ppm2      2.133 CV     1
 OR {  953}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 100  and name HB1 ))
 OR {  953}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 100  and name HB2 ))
 OR {  953}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI {  954}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 10   and name HB1 ))
      3.100     1.200     1.200 peak   954 spectrum    1 weight  0.10000E+01 volume  0.14275E-02 ppm1      1.498 ppm2      0.914 CV     1
 ASSI {  957}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 55   and name HN  ))
      3.800     1.800     1.800 peak   957 spectrum    1 weight  0.10000E+01 volume  0.17129E-02 ppm1      1.755 ppm2      8.666 CV     1
 ASSI {  959}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 60   and name HG2 ))
      2.300     0.700     0.700 peak   959 spectrum    1 weight  0.10000E+01 volume  0.45584E-02 ppm1      1.748 ppm2      0.824 CV     1
 OR {  959}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 60   and name HG1 ))
 ASSI {  960}
   (( segid "    " and resid 10   and name HD2 ))
   (( segid "    " and resid 97   and name HG  ))
      3.100     3.100     2.900 peak   960 spectrum    1 weight  0.10000E+01 volume  0.21982E-02 ppm1      1.547 ppm2      1.849 CV     1
 OR {  960}
   (( segid "    " and resid 10   and name HD1 ))
   (( segid "    " and resid 97   and name HG  ))
 ASSI {  965}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HG2 ))
      2.400     0.700     0.700 peak   965 spectrum    1 weight  0.10000E+01 volume  0.43854E-02 ppm1      2.172 ppm2      1.312 CV     1
 OR {  965}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HG1 ))
 ASSI {  969}
   (( segid "    " and resid 97   and name HG  ))
   (( segid "    " and resid 97   and name HN  ))
      2.600     0.900     0.900 peak   969 spectrum    1 weight  0.10000E+01 volume  0.21871E-02 ppm1      1.835 ppm2      8.056 CV     1
 ASSI {  970}
   (( segid "    " and resid 97   and name HG  ))
   (( segid "    " and resid 97   and name HA  ))
      2.700     0.900     0.900 peak   970 spectrum    1 weight  0.10000E+01 volume  0.21698E-02 ppm1      1.840 ppm2      4.339 CV     1
 ASSI {  971}
   (( segid "    " and resid 97   and name HG  ))
   (  segid "    " and resid 97   and name HD1%)
      2.200     0.600     0.600 peak   971 spectrum    1 weight  0.10000E+01 volume  0.80266E-02 ppm1      1.836 ppm2      1.019 CV     1
 OR {  971}
   (( segid "    " and resid 97   and name HG  ))
   (  segid "    " and resid 97   and name HD2%)
 ASSI {  974}
   (( segid "    " and resid 42   and name HG11))
   (( segid "    " and resid 42   and name HA  ))
      2.800     1.000     1.000 peak   974 spectrum    1 weight  0.10000E+01 volume  0.43796E-02 ppm1      1.702 ppm2      4.006 CV     1
 OR {  974}
   (( segid "    " and resid 42   and name HG12))
   (( segid "    " and resid 42   and name HA  ))
 ASSI {  978}
   (( segid "    " and resid 42   and name HG12))
   (  segid "    " and resid 42   and name HG2%)
      2.500     0.800     0.800 peak   978 spectrum    1 weight  0.10000E+01 volume  0.63913E-02 ppm1      1.689 ppm2      0.783 CV     1
 OR {  978}
   (( segid "    " and resid 42   and name HG11))
   (  segid "    " and resid 42   and name HG2%)
 ASSI {  979}
   (( segid "    " and resid 59   and name HB1 ))
   (( segid "    " and resid 59   and name HB2 ))
      1.500     0.300     0.700 peak   979 spectrum    1 weight  0.10000E+01 volume  0.17181E-01 ppm1      1.635 ppm2      2.156 CV     1
 ASSI {  981}
   (( segid "    " and resid 135  and name HG11))
   (( segid "    " and resid 135  and name HB  ))
      2.000     0.500     0.500 peak   981 spectrum    1 weight  0.10000E+01 volume  0.15241E-01 ppm1      1.325 ppm2      1.716 CV     1
 OR {  981}
   (( segid "    " and resid 135  and name HG12))
   (( segid "    " and resid 135  and name HB  ))
 ASSI {  984}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 131  and name HB2 ))
      3.500     1.500     1.500 peak   984 spectrum    1 weight  0.10000E+01 volume  0.13430E-02 ppm1      1.254 ppm2      2.142 CV     1
 ASSI {  987}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 84   and name HA  ))
      2.800     1.000     1.000 peak   987 spectrum    1 weight  0.10000E+01 volume  0.18230E-02 ppm1      0.916 ppm2      5.285 CV     1
 OR {  987}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HA  ))
 ASSI {  994}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HN  ))
      3.100     1.200     1.200 peak   994 spectrum    1 weight  0.10000E+01 volume  0.30199E-02 ppm1      2.400 ppm2      8.163 CV     1
 ASSI {  995}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HA  ))
      2.800     1.000     1.000 peak   995 spectrum    1 weight  0.10000E+01 volume  0.30388E-02 ppm1      2.402 ppm2      3.988 CV     1
 ASSI {  996}
   (( segid "    " and resid 17   and name HB1 ))
   (( segid "    " and resid 17   and name HG1 ))
      2.300     0.700     0.700 peak   996 spectrum    1 weight  0.10000E+01 volume  0.77651E-02 ppm1      2.400 ppm2      1.984 CV     1
 ASSI {  999}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HG1 ))
      2.600     0.800     0.800 peak   999 spectrum    1 weight  0.10000E+01 volume  0.40308E-02 ppm1      2.165 ppm2      2.446 CV     1
 OR {  999}
   (( segid "    " and resid 12   and name HB1 ))
   (( segid "    " and resid 12   and name HG2 ))
 OR {  999}
   (( segid "    " and resid 12   and name HB1 ))
   (( segid "    " and resid 12   and name HG1 ))
 OR {  999}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 12   and name HG2 ))
 ASSI { 1003}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 43   and name HA  ))
      3.400     1.400     1.400 peak  1003 spectrum    1 weight  0.10000E+01 volume  0.28250E-02 ppm1      2.119 ppm2      4.219 CV     1
 ASSI { 1004}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HB1 ))
      1.500     0.300     0.700 peak  1004 spectrum    1 weight  0.10000E+01 volume  0.15182E-01 ppm1      2.086 ppm2      1.745 CV     1
 ASSI { 1007}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HA  ))
      3.400     1.500     1.500 peak  1007 spectrum    1 weight  0.10000E+01 volume  0.18271E-02 ppm1      2.060 ppm2      4.351 CV     1
 OR { 1007}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HA  ))
 ASSI { 1008}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 43   and name HA  ))
      2.500     0.800     0.800 peak  1008 spectrum    1 weight  0.10000E+01 volume  0.20994E-02 ppm1      2.056 ppm2      4.237 CV     1
 ASSI { 1009}
   (( segid "    " and resid 88   and name HB2 ))
   (( segid "    " and resid 88   and name HA  ))
      2.400     0.700     0.700 peak  1009 spectrum    1 weight  0.10000E+01 volume  0.33648E-02 ppm1      2.044 ppm2      3.997 CV     1
 ASSI { 1017}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 86   and name HN  ))
      2.900     2.900     3.100 peak  1017 spectrum    1 weight  0.10000E+01 volume  0.12749E-02 ppm1      1.789 ppm2      9.171 CV     1
 ASSI { 1018}
   (( segid "    " and resid 60   and name HD2 ))
   (( segid "    " and resid 86   and name HA  ))
      3.100     3.100     2.900 peak  1018 spectrum    1 weight  0.10000E+01 volume  0.16817E-02 ppm1      1.788 ppm2      5.608 CV     1
 ASSI { 1030}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 107  and name HA  ))
      3.200     1.300     1.300 peak  1030 spectrum    1 weight  0.10000E+01 volume  0.28796E-02 ppm1      1.561 ppm2      3.997 CV     1
 OR { 1030}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 1035}
   (( segid "    " and resid 69   and name HG  ))
   (( segid "    " and resid 70   and name HN  ))
      3.400     1.400     1.400 peak  1035 spectrum    1 weight  0.10000E+01 volume  0.12445E-02 ppm1      1.477 ppm2      9.523 CV     1
 ASSI { 1039}
   (( segid "    " and resid 113  and name HG11))
   (  segid "    " and resid 113  and name HG2%)
      2.100     0.500     0.500 peak  1039 spectrum    1 weight  0.10000E+01 volume  0.12999E-01 ppm1      1.295 ppm2      0.565 CV     1
 OR { 1039}
   (( segid "    " and resid 113  and name HG12))
   (  segid "    " and resid 113  and name HG2%)
 ASSI { 1040}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HG2 ))
      2.900     1.000     1.000 peak  1040 spectrum    1 weight  0.10000E+01 volume  0.20780E-02 ppm1      1.200 ppm2      1.439 CV     1
 ASSI { 1041}
   (( segid "    " and resid 116  and name HB2 ))
   (( segid "    " and resid 116  and name HB1 ))
      2.000     0.500     0.500 peak  1041 spectrum    1 weight  0.10000E+01 volume  0.38984E-02 ppm1      1.201 ppm2      0.902 CV     1
 ASSI { 1045}
   (  segid "    " and resid 84   and name HD2%)
   (  segid "    " and resid 71   and name HG1%)
      3.100     3.100     2.900 peak  1045 spectrum    1 weight  0.10000E+01 volume  0.19902E-02 ppm1      0.936 ppm2      0.580 CV     1
 OR { 1045}
   (  segid "    " and resid 84   and name HD1%)
   (  segid "    " and resid 71   and name HG1%)
 ASSI { 1050}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HG  ))
      2.100     2.100     3.900 peak  1050 spectrum    1 weight  0.10000E+01 volume  0.10257E-01 ppm1      0.571 ppm2      1.263 CV     1
 ASSI { 1054}
   (( segid "    " and resid 43   and name HG  ))
   (( segid "    " and resid 43   and name HN  ))
      3.500     1.500     1.500 peak  1054 spectrum    1 weight  0.10000E+01 volume  0.21500E-02 ppm1      1.624 ppm2      6.998 CV     1
 ASSI { 1056}
   (( segid "    " and resid 119  and name HG12))
   (  segid "    " and resid 119  and name HD1%)
      2.700     0.900     0.900 peak  1056 spectrum    1 weight  0.10000E+01 volume  0.20632E-02 ppm1      1.588 ppm2     -0.201 CV     1
 ASSI { 1057}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 116  and name HA  ))
      3.600     3.600     2.400 peak  1057 spectrum    1 weight  0.10000E+01 volume  0.16200E-02 ppm1      1.581 ppm2      3.615 CV     1
 ASSI { 1061}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 81   and name HN  ))
      3.300     1.400     1.400 peak  1061 spectrum    1 weight  0.10000E+01 volume  0.15121E-02 ppm1      1.523 ppm2      8.804 CV     1
 OR { 1061}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 81   and name HN  ))
 ASSI { 1062}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 105  and name HA  ))
      3.000     3.000     3.000 peak  1062 spectrum    1 weight  0.10000E+01 volume  0.14025E-02 ppm1      1.526 ppm2      4.383 CV     1
 OR { 1062}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 105  and name HA  ))
 ASSI { 1063}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 107  and name HG1 ))
      2.300     0.600     0.600 peak  1063 spectrum    1 weight  0.10000E+01 volume  0.60630E-02 ppm1      1.522 ppm2      0.678 CV     1
 OR { 1063}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 107  and name HG2 ))
 OR { 1063}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 107  and name HG1 ))
 OR { 1063}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 107  and name HG2 ))
 ASSI { 1065}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 157  and name HG1 ))
      3.000     3.000     3.000 peak  1065 spectrum    1 weight  0.10000E+01 volume  0.39534E-02 ppm1      1.493 ppm2      2.155 CV     1
 OR { 1065}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 157  and name HG1 ))
 OR { 1065}
   (( segid "    " and resid 107  and name HD2 ))
   (( segid "    " and resid 157  and name HG2 ))
 OR { 1065}
   (( segid "    " and resid 107  and name HD1 ))
   (( segid "    " and resid 157  and name HG2 ))
 ASSI { 1074}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 131  and name HG2 ))
      2.900     1.100     1.100 peak  1074 spectrum    1 weight  0.10000E+01 volume  0.13058E-02 ppm1      1.260 ppm2      1.459 CV     1
 OR { 1074}
   (( segid "    " and resid 131  and name HD2 ))
   (( segid "    " and resid 131  and name HG1 ))
 ASSI { 1078}
   (( segid "    " and resid 119  and name HG11))
   (( segid "    " and resid 119  and name HN  ))
      3.800     1.800     1.800 peak  1078 spectrum    1 weight  0.10000E+01 volume  0.17457E-02 ppm1      1.144 ppm2      7.127 CV     1
 ASSI { 1085}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HB2 ))
      1.900     1.900     4.100 peak  1085 spectrum    1 weight  0.10000E+01 volume  0.11182E-01 ppm1      1.069 ppm2      1.781 CV     1
 ASSI { 1093}
   (( segid "    " and resid 60   and name HD1 ))
   (( segid "    " and resid 61   and name HN  ))
      2.700     2.700     3.300 peak  1093 spectrum    1 weight  0.10000E+01 volume  0.37876E-02 ppm1      0.568 ppm2      8.183 CV     1
 ASSI { 1097}
   (( segid "    " and resid 60   and name HD1 ))
   (( segid "    " and resid 60   and name HD2 ))
      1.800     0.400     0.400 peak  1097 spectrum    1 weight  0.10000E+01 volume  0.53475E-02 ppm1      0.567 ppm2      1.759 CV     1
 ASSI { 1099}
   (  segid "    " and resid 89   and name HD1%)
   (  segid "    " and resid 89   and name HD2%)
      2.600     0.800     0.800 peak  1099 spectrum    1 weight  0.10000E+01 volume  0.45504E-02 ppm1      0.572 ppm2      0.307 CV     1
 ASSI { 1100}
   (  segid "    " and resid 38   and name HD2%)
   (  segid "    " and resid 35   and name HD% )
      2.300     2.300     3.700 peak  1100 spectrum    1 weight  0.10000E+01 volume  0.15733E-02 ppm1      0.182 ppm2      6.159 CV     1
 ASSI { 1103}
   (  segid "    " and resid 38   and name HD2%)
   (( segid "    " and resid 38   and name HB2 ))
      2.600     0.900     0.900 peak  1103 spectrum    1 weight  0.10000E+01 volume  0.46280E-02 ppm1      0.180 ppm2      1.472 CV     1
 OR { 1103}
   (  segid "    " and resid 38   and name HD2%)
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 1104}
   (  segid "    " and resid 38   and name HD2%)
   (( segid "    " and resid 38   and name HG  ))
      2.300     2.300     3.700 peak  1104 spectrum    1 weight  0.10000E+01 volume  0.54890E-02 ppm1      0.180 ppm2      0.936 CV     1
 ASSI { 1105}
   (  segid "    " and resid 38   and name HD2%)
   (  segid "    " and resid 38   and name HD1%)
      2.300     2.300     3.700 peak  1105 spectrum    1 weight  0.10000E+01 volume  0.97653E-02 ppm1      0.183 ppm2      0.779 CV     1
 ASSI { 1106}
   (( segid "    " and resid 128  and name HB2 ))
   (( segid "    " and resid 128  and name HB1 ))
      1.800     0.400     0.400 peak  1106 spectrum    1 weight  0.10000E+01 volume  0.92313E-02 ppm1      2.358 ppm2      2.191 CV     1
 ASSI { 1108}
   (( segid "    " and resid 128  and name HB1 ))
   (( segid "    " and resid 129  and name HA  ))
      2.900     2.900     3.100 peak  1108 spectrum    1 weight  0.10000E+01 volume  0.26559E-02 ppm1      2.249 ppm2      4.057 CV     1
 ASSI { 1123}
   (( segid "    " and resid 28   and name HG  ))
   (( segid "    " and resid 28   and name HA  ))
      2.900     1.000     1.000 peak  1123 spectrum    1 weight  0.10000E+01 volume  0.32496E-02 ppm1      1.641 ppm2      4.185 CV     1
 ASSI { 1125}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HD1 ))
      2.500     0.800     0.800 peak  1125 spectrum    1 weight  0.10000E+01 volume  0.18435E-02 ppm1      1.641 ppm2      3.029 CV     1
 OR { 1125}
   (( segid "    " and resid 64   and name HG1 ))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 1130}
   (( segid "    " and resid 119  and name HG12))
   (( segid "    " and resid 119  and name HA  ))
      3.500     1.500     1.500 peak  1130 spectrum    1 weight  0.10000E+01 volume  0.14257E-02 ppm1      1.594 ppm2      3.850 CV     1
 ASSI { 1133}
   (( segid "    " and resid 64   and name HG2 ))
   (( segid "    " and resid 66   and name HN  ))
      3.800     1.800     1.800 peak  1133 spectrum    1 weight  0.10000E+01 volume  0.12853E-02 ppm1      1.405 ppm2      8.146 CV     1
 ASSI { 1135}
   (( segid "    " and resid 131  and name HD1 ))
   (( segid "    " and resid 109  and name HB1 ))
      2.700     2.700     3.300 peak  1135 spectrum    1 weight  0.10000E+01 volume  0.13222E-02 ppm1      1.404 ppm2      2.820 CV     1
 ASSI { 1140}
   (( segid "    " and resid 119  and name HG11))
   (( segid "    " and resid 119  and name HG12))
      1.800     0.400     0.400 peak  1140 spectrum    1 weight  0.10000E+01 volume  0.61524E-02 ppm1      1.148 ppm2      1.560 CV     1
 ASSI { 1142}
   (  segid "    " and resid 86   and name HD1%)
   (  segid "    " and resid 69   and name HD1%)
      2.400     2.400     3.600 peak  1142 spectrum    1 weight  0.10000E+01 volume  0.12573E-02 ppm1      1.102 ppm2      0.727 CV     1
 ASSI { 1148}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 102  and name HG  ))
      2.100     2.100     3.900 peak  1148 spectrum    1 weight  0.10000E+01 volume  0.11172E-01 ppm1      0.555 ppm2      1.508 CV     1
 ASSI { 1150}
   (  segid "    " and resid 102  and name HD1%)
   (( segid "    " and resid 102  and name HA  ))
      3.400     1.500     1.500 peak  1150 spectrum    1 weight  0.10000E+01 volume  0.15083E-02 ppm1      0.556 ppm2      4.404 CV     1
 ASSI { 1155}
   (( segid "    " and resid 54   and name HD2 ))
   (( segid "    " and resid 54   and name HB2 ))
      2.900     1.100     1.100 peak  1155 spectrum    1 weight  0.10000E+01 volume  0.13687E-02 ppm1      1.650 ppm2      2.142 CV     1
 ASSI { 1166}
   (( segid "    " and resid 10   and name HG2 ))
   (( segid "    " and resid 10   and name HD1 ))
      2.000     0.500     0.500 peak  1166 spectrum    1 weight  0.10000E+01 volume  0.11751E-01 ppm1      1.185 ppm2      1.556 CV     1
 OR { 1166}
   (( segid "    " and resid 10   and name HG1 ))
   (( segid "    " and resid 10   and name HD1 ))
 ASSI { 1173}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HA  ))
      3.700     1.700     1.700 peak  1173 spectrum    1 weight  0.10000E+01 volume  0.17859E-02 ppm1      0.705 ppm2      5.225 CV     1
 ASSI { 1174}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HB2 ))
      2.300     2.300     3.700 peak  1174 spectrum    1 weight  0.10000E+01 volume  0.52985E-02 ppm1      0.705 ppm2      1.624 CV     1
 ASSI { 1176}
   (  segid "    " and resid 102  and name HD2%)
   (  segid "    " and resid 106  and name HB% )
      2.500     2.500     3.500 peak  1176 spectrum    1 weight  0.10000E+01 volume  0.55761E-02 ppm1      0.704 ppm2      1.106 CV     1
 ASSI { 1178}
   (( segid "    " and resid 86   and name HG  ))
   (  segid "    " and resid 86   and name HD2%)
      2.000     0.500     0.500 peak  1178 spectrum    1 weight  0.10000E+01 volume  0.78670E-02 ppm1      1.663 ppm2      0.967 CV     1
 ASSI { 1187}
   (  segid "    " and resid 97   and name HD2%)
   (( segid "    " and resid 97   and name HA  ))
      2.600     2.600     3.400 peak  1187 spectrum    1 weight  0.10000E+01 volume  0.49067E-02 ppm1      0.978 ppm2      4.361 CV     1
 ASSI { 1190}
   (  segid "    " and resid 97   and name HD2%)
   (( segid "    " and resid 97   and name HB1 ))
      2.100     0.500     0.500 peak  1190 spectrum    1 weight  0.10000E+01 volume  0.17923E-01 ppm1      0.977 ppm2      1.789 CV     1
 OR { 1190}
   (  segid "    " and resid 97   and name HD2%)
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 1195}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 67   and name HN  ))
      2.200     2.200     3.800 peak  1195 spectrum    1 weight  0.10000E+01 volume  0.78361E-02 ppm1      0.966 ppm2      7.196 CV     1
 ASSI { 1196}
   (  segid "    " and resid 97   and name HD2%)
   (  segid "    " and resid 155  and name HE% )
      2.600     2.600     3.400 peak  1196 spectrum    1 weight  0.10000E+01 volume  0.36154E-02 ppm1      0.966 ppm2      6.721 CV     1
 ASSI { 1197}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 69   and name HA  ))
      3.500     3.500     2.500 peak  1197 spectrum    1 weight  0.10000E+01 volume  0.26853E-02 ppm1      0.965 ppm2      5.269 CV     1
 ASSI { 1202}
   (  segid "    " and resid 100  and name HD2%)
   (  segid "    " and resid 102  and name HD1%)
      2.700     2.700     3.300 peak  1202 spectrum    1 weight  0.10000E+01 volume  0.50937E-02 ppm1      0.876 ppm2      0.561 CV     1
 ASSI { 1207}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HB1 ))
      2.400     0.700     0.700 peak  1207 spectrum    1 weight  0.10000E+01 volume  0.64377E-02 ppm1      0.843 ppm2      2.186 CV     1
 OR { 1207}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 1208}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 15   and name HG12))
      2.900     2.900     3.100 peak  1208 spectrum    1 weight  0.10000E+01 volume  0.21325E-02 ppm1      0.845 ppm2      1.957 CV     1
 OR { 1208}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 15   and name HG11))
 ASSI { 1209}
   (  segid "    " and resid 100  and name HD2%)
   (( segid "    " and resid 100  and name HG  ))
      2.000     0.500     0.500 peak  1209 spectrum    1 weight  0.10000E+01 volume  0.12968E-01 ppm1      0.843 ppm2      1.501 CV     1
 ASSI { 1212}
   (  segid "    " and resid 38   and name HD1%)
   (( segid "    " and resid 72   and name HA1 ))
      3.000     3.000     3.000 peak  1212 spectrum    1 weight  0.10000E+01 volume  0.57345E-02 ppm1      0.787 ppm2      3.833 CV     1
 ASSI { 1218}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HA  ))
      2.800     1.000     1.000 peak  1218 spectrum    1 weight  0.10000E+01 volume  0.51290E-02 ppm1      0.994 ppm2      5.583 CV     1
 ASSI { 1220}
   (  segid "    " and resid 97   and name HD2%)
   (( segid "    " and resid 98   and name HN  ))
      3.800     1.800     1.800 peak  1220 spectrum    1 weight  0.10000E+01 volume  0.14284E-02 ppm1      0.991 ppm2      9.522 CV     1
 ASSI { 1221}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 66   and name HN  ))
      3.100     1.200     1.200 peak  1221 spectrum    1 weight  0.10000E+01 volume  0.27608E-02 ppm1      0.990 ppm2      8.140 CV     1
 ASSI { 1223}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 88   and name HH11))
      2.300     2.300     3.700 peak  1223 spectrum    1 weight  0.10000E+01 volume  0.25439E-02 ppm1      0.993 ppm2      6.624 CV     1
 OR { 1223}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 88   and name HH12))
 ASSI { 1225}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 88   and name HB2 ))
      2.300     0.700     0.700 peak  1225 spectrum    1 weight  0.10000E+01 volume  0.43504E-02 ppm1      0.989 ppm2      2.045 CV     1
 ASSI { 1228}
   (  segid "    " and resid 28   and name HD2%)
   (( segid "    " and resid 28   and name HA  ))
      2.800     2.800     3.200 peak  1228 spectrum    1 weight  0.10000E+01 volume  0.26695E-02 ppm1      0.800 ppm2      4.192 CV     1
 ASSI { 1229}
   (  segid "    " and resid 28   and name HD2%)
   (( segid "    " and resid 25   and name HA  ))
      3.600     1.600     1.600 peak  1229 spectrum    1 weight  0.10000E+01 volume  0.19737E-02 ppm1      0.801 ppm2      3.490 CV     1
 ASSI { 1230}
   (  segid "    " and resid 28   and name HD2%)
   (( segid "    " and resid 28   and name HB2 ))
      2.800     1.000     1.000 peak  1230 spectrum    1 weight  0.10000E+01 volume  0.87693E-02 ppm1      0.802 ppm2      1.895 CV     1
 ASSI { 1231}
   (  segid "    " and resid 28   and name HD2%)
   (( segid "    " and resid 28   and name HG  ))
      2.000     0.500     0.500 peak  1231 spectrum    1 weight  0.10000E+01 volume  0.12936E-01 ppm1      0.793 ppm2      1.646 CV     1
 ASSI { 1233}
   (  segid "    " and resid 86   and name HD2%)
   (( segid "    " and resid 86   and name HB2 ))
      3.100     1.200     1.200 peak  1233 spectrum    1 weight  0.10000E+01 volume  0.17279E-02 ppm1      0.984 ppm2      1.802 CV     1
 ASSI { 1234}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HA  ))
      3.600     1.600     1.600 peak  1234 spectrum    1 weight  0.10000E+01 volume  0.23836E-02 ppm1      0.635 ppm2      5.277 CV     1
 OR { 1234}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HA  ))
 ASSI { 1235}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HG  ))
      2.100     0.600     0.600 peak  1235 spectrum    1 weight  0.10000E+01 volume  0.10869E-01 ppm1      0.637 ppm2      1.459 CV     1
 OR { 1235}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HG  ))
 ASSI { 1239}
   (( segid "    " and resid 54   and name HD1 ))
   (( segid "    " and resid 152  and name HG1 ))
      2.900     1.100     1.100 peak  1239 spectrum    1 weight  0.10000E+01 volume  0.37621E-02 ppm1      1.674 ppm2      1.263 CV     1
 OR { 1239}
   (( segid "    " and resid 54   and name HD2 ))
   (( segid "    " and resid 152  and name HG1 ))
 OR { 1239}
   (( segid "    " and resid 54   and name HD1 ))
   (( segid "    " and resid 152  and name HG2 ))
 OR { 1239}
   (( segid "    " and resid 54   and name HD2 ))
   (( segid "    " and resid 152  and name HG2 ))
 ASSI { 1247}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HE1 ))
      2.600     0.900     0.900 peak  1247 spectrum    1 weight  0.10000E+01 volume  0.28329E-02 ppm1      1.273 ppm2      2.978 CV     1
 OR { 1247}
   (( segid "    " and resid 59   and name HD1 ))
   (( segid "    " and resid 59   and name HE2 ))
 OR { 1247}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HE1 ))
 OR { 1247}
   (( segid "    " and resid 59   and name HD2 ))
   (( segid "    " and resid 59   and name HE2 ))
 ASSI { 1255}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HB2 ))
      2.700     0.900     0.900 peak  1255 spectrum    1 weight  0.10000E+01 volume  0.85147E-02 ppm1      0.633 ppm2      1.625 CV     1
 ASSI { 1259}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 15   and name HN  ))
      3.600     3.600     2.400 peak  1259 spectrum    1 weight  0.10000E+01 volume  0.12263E-02 ppm1      1.515 ppm2      8.449 CV     1
 ASSI { 1261}
   (( segid "    " and resid 100  and name HG  ))
   (  segid "    " and resid 100  and name HD1%)
      2.500     0.800     0.800 peak  1261 spectrum    1 weight  0.10000E+01 volume  0.31293E-02 ppm1      1.491 ppm2      0.964 CV     1
 ASSI { 1263}
   (( segid "    " and resid 102  and name HG  ))
   (( segid "    " and resid 109  and name HB1 ))
      3.500     1.600     1.600 peak  1263 spectrum    1 weight  0.10000E+01 volume  0.14763E-02 ppm1      1.508 ppm2      2.754 CV     1
 ASSI { 1279}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 88   and name HH22))
      3.100     3.100     2.900 peak  1279 spectrum    1 weight  0.10000E+01 volume  0.43668E-02 ppm1      1.090 ppm2      7.314 CV     1
 OR { 1279}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 88   and name HH22))
 OR { 1279}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 88   and name HH21))
 ASSI { 1290}
   (( segid "    " and resid 38   and name HG  ))
   (( segid "    " and resid 38   and name HA  ))
      2.500     0.800     0.800 peak  1290 spectrum    1 weight  0.10000E+01 volume  0.90085E-02 ppm1      0.966 ppm2      4.100 CV     1
 ASSI { 1292}
   (( segid "    " and resid 38   and name HG  ))
   (( segid "    " and resid 38   and name HB2 ))
      1.900     0.500     0.500 peak  1292 spectrum    1 weight  0.10000E+01 volume  0.15891E-01 ppm1      0.967 ppm2      1.492 CV     1
 OR { 1292}
   (( segid "    " and resid 38   and name HG  ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 1293}
   (( segid "    " and resid 107  and name HG1 ))
   (( segid "    " and resid 107  and name HA  ))
      3.000     1.100     1.100 peak  1293 spectrum    1 weight  0.10000E+01 volume  0.17898E-02 ppm1      0.742 ppm2      3.933 CV     1
 OR { 1293}
   (( segid "    " and resid 107  and name HG2 ))
   (( segid "    " and resid 107  and name HA  ))
 ASSI { 1294}
   (( segid "    " and resid 107  and name HG2 ))
   (( segid "    " and resid 107  and name HE2 ))
      2.700     0.900     0.900 peak  1294 spectrum    1 weight  0.10000E+01 volume  0.31889E-02 ppm1      0.739 ppm2      2.802 CV     1
 OR { 1294}
   (( segid "    " and resid 107  and name HG2 ))
   (( segid "    " and resid 107  and name HE1 ))
 OR { 1294}
   (( segid "    " and resid 107  and name HG1 ))
   (( segid "    " and resid 107  and name HE2 ))
 OR { 1294}
   (( segid "    " and resid 107  and name HG1 ))
   (( segid "    " and resid 107  and name HE1 ))
 ASSI { 1295}
   (( segid "    " and resid 107  and name HG2 ))
   (( segid "    " and resid 107  and name HB1 ))
      1.900     0.400     0.400 peak  1295 spectrum    1 weight  0.10000E+01 volume  0.16011E-01 ppm1      0.740 ppm2      1.019 CV     1
 OR { 1295}
   (( segid "    " and resid 107  and name HG1 ))
   (( segid "    " and resid 107  and name HB1 ))
 ASSI { 1307}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 62   and name HN  ))
      3.800     1.800     1.800 peak  1307 spectrum    1 weight  0.10000E+01 volume  0.13052E-02 ppm1      0.911 ppm2      8.780 CV     1
 ASSI { 1308}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HN  ))
      2.700     2.700     3.300 peak  1308 spectrum    1 weight  0.10000E+01 volume  0.28830E-02 ppm1      0.912 ppm2      8.176 CV     1
 ASSI { 1309}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 152  and name HA  ))
      3.600     1.600     1.600 peak  1309 spectrum    1 weight  0.10000E+01 volume  0.15321E-02 ppm1      0.910 ppm2      4.776 CV     1
 ASSI { 1310}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 61   and name HA  ))
      2.300     0.700     0.700 peak  1310 spectrum    1 weight  0.10000E+01 volume  0.45025E-02 ppm1      0.911 ppm2      4.577 CV     1
 ASSI { 1313}
   (  segid "    " and resid 61   and name HG2%)
   (  segid "    " and resid 61   and name HD1%)
      1.900     1.900     4.100 peak  1313 spectrum    1 weight  0.10000E+01 volume  0.19329E-01 ppm1      0.908 ppm2      0.520 CV     1
 ASSI { 1314}
   (  segid "    " and resid 61   and name HG2%)
   (( segid "    " and resid 89   and name HB2 ))
      2.400     2.400     3.600 peak  1314 spectrum    1 weight  0.10000E+01 volume  0.35203E-02 ppm1      0.882 ppm2      1.166 CV     1
 ASSI { 1315}
   (  segid "    " and resid 28   and name HD1%)
   (( segid "    " and resid 28   and name HG  ))
      2.300     0.700     0.700 peak  1315 spectrum    1 weight  0.10000E+01 volume  0.63039E-02 ppm1      0.849 ppm2      1.654 CV     1
 ASSI { 1316}
   (  segid "    " and resid 28   and name HD1%)
   (( segid "    " and resid 28   and name HA  ))
      2.900     1.100     1.100 peak  1316 spectrum    1 weight  0.10000E+01 volume  0.11426E-01 ppm1      0.842 ppm2      4.192 CV     1
 ASSI { 1317}
   (  segid "    " and resid 28   and name HD1%)
   (( segid "    " and resid 28   and name HB2 ))
      2.600     2.600     3.400 peak  1317 spectrum    1 weight  0.10000E+01 volume  0.31568E-02 ppm1      0.843 ppm2      1.898 CV     1
 ASSI { 1318}
   (  segid "    " and resid 28   and name HD1%)
   (( segid "    " and resid 28   and name HB1 ))
      2.400     0.700     0.700 peak  1318 spectrum    1 weight  0.10000E+01 volume  0.77381E-02 ppm1      0.841 ppm2      1.361 CV     1
 ASSI { 1328}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 44   and name HA  ))
      2.800     1.000     1.000 peak  1328 spectrum    1 weight  0.10000E+01 volume  0.90171E-02 ppm1      0.774 ppm2      3.790 CV     1
 OR { 1328}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 44   and name HA  ))
 ASSI { 1330}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 44   and name HG  ))
      2.000     0.500     0.500 peak  1330 spectrum    1 weight  0.10000E+01 volume  0.12178E-01 ppm1      0.778 ppm2      1.602 CV     1
 OR { 1330}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 44   and name HG  ))
 ASSI { 1331}
   (  segid "    " and resid 44   and name HD1%)
   (( segid "    " and resid 44   and name HB1 ))
      2.200     0.600     0.600 peak  1331 spectrum    1 weight  0.10000E+01 volume  0.12040E-01 ppm1      0.779 ppm2      1.508 CV     1
 OR { 1331}
   (  segid "    " and resid 44   and name HD2%)
   (( segid "    " and resid 44   and name HB1 ))
 ASSI { 1335}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 23   and name HN  ))
      3.400     1.400     1.400 peak  1335 spectrum    1 weight  0.10000E+01 volume  0.13613E-02 ppm1      1.408 ppm2      7.773 CV     1
 ASSI { 1340}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 62   and name HN  ))
      3.100     1.200     1.200 peak  1340 spectrum    1 weight  0.10000E+01 volume  0.16693E-02 ppm1      1.093 ppm2      8.842 CV     1
 OR { 1340}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 62   and name HN  ))
 ASSI { 1346}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 87   and name HB  ))
      2.300     0.700     0.700 peak  1346 spectrum    1 weight  0.10000E+01 volume  0.66454E-02 ppm1      1.092 ppm2      4.557 CV     1
 ASSI { 1349}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 64   and name HG1 ))
      2.000     0.500     0.500 peak  1349 spectrum    1 weight  0.10000E+01 volume  0.57485E-02 ppm1      1.095 ppm2      1.589 CV     1
 OR { 1349}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 64   and name HG1 ))
 ASSI { 1352}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 94   and name HN  ))
      2.300     2.300     3.700 peak  1352 spectrum    1 weight  0.10000E+01 volume  0.15896E-02 ppm1      1.034 ppm2      8.402 CV     1
 ASSI { 1354}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 97   and name HN  ))
      2.900     1.100     1.100 peak  1354 spectrum    1 weight  0.10000E+01 volume  0.29437E-02 ppm1      1.033 ppm2      8.048 CV     1
 ASSI { 1357}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 97   and name HA  ))
      2.800     2.800     3.200 peak  1357 spectrum    1 weight  0.10000E+01 volume  0.89037E-02 ppm1      1.031 ppm2      4.341 CV     1
 ASSI { 1358}
   (  segid "    " and resid 85   and name HG2%)
   (( segid "    " and resid 85   and name HB  ))
      2.400     0.700     0.700 peak  1358 spectrum    1 weight  0.10000E+01 volume  0.39116E-02 ppm1      1.033 ppm2      4.004 CV     1
 ASSI { 1361}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 97   and name HB2 ))
      2.200     0.600     0.600 peak  1361 spectrum    1 weight  0.10000E+01 volume  0.10537E-01 ppm1      1.033 ppm2      1.784 CV     1
 OR { 1361}
   (  segid "    " and resid 97   and name HD1%)
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1382}
   (  segid "    " and resid 130  and name HB% )
   (  segid "    " and resid 122  and name HE% )
      2.800     1.000     1.000 peak  1382 spectrum    1 weight  0.10000E+01 volume  0.25443E-02 ppm1      0.567 ppm2      6.366 CV     1
 ASSI { 1383}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 130  and name HA  ))
      2.200     0.600     0.600 peak  1383 spectrum    1 weight  0.10000E+01 volume  0.67178E-02 ppm1      0.567 ppm2      4.892 CV     1
 ASSI { 1384}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 129  and name HA  ))
      3.800     1.800     1.800 peak  1384 spectrum    1 weight  0.10000E+01 volume  0.13439E-02 ppm1      0.568 ppm2      4.052 CV     1
 ASSI { 1385}
   (  segid "    " and resid 130  and name HB% )
   (  segid "    " and resid 119  and name HD1%)
      2.400     2.400     3.600 peak  1385 spectrum    1 weight  0.10000E+01 volume  0.58978E-02 ppm1      0.567 ppm2     -0.212 CV     1
 ASSI { 1386}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 131  and name HN  ))
      2.800     1.000     1.000 peak  1386 spectrum    1 weight  0.10000E+01 volume  0.23695E-02 ppm1      0.567 ppm2      9.608 CV     1
 ASSI { 1387}
   (  segid "    " and resid 130  and name HB% )
   (( segid "    " and resid 130  and name HN  ))
      2.300     0.700     0.700 peak  1387 spectrum    1 weight  0.10000E+01 volume  0.60040E-02 ppm1      0.566 ppm2      8.120 CV     1
 ASSI { 1388}
   (  segid "    " and resid 130  and name HB% )
   (  segid "    " and resid 122  and name HD% )
      2.300     2.300     3.700 peak  1388 spectrum    1 weight  0.10000E+01 volume  0.62667E-02 ppm1      0.567 ppm2      6.781 CV     1
 ASSI { 1397}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 97   and name HB2 ))
      2.700     2.700     3.300 peak  1397 spectrum    1 weight  0.10000E+01 volume  0.33387E-02 ppm1      0.287 ppm2      1.771 CV     1
 OR { 1397}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 1398}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HG  ))
      2.200     0.600     0.600 peak  1398 spectrum    1 weight  0.10000E+01 volume  0.73861E-02 ppm1      0.287 ppm2      1.281 CV     1
 ASSI { 1399}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HB1 ))
      2.400     2.400     3.600 peak  1399 spectrum    1 weight  0.10000E+01 volume  0.84740E-02 ppm1      0.287 ppm2      0.962 CV     1
 ASSI { 1402}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 89   and name HB2 ))
      2.900     2.900     3.100 peak  1402 spectrum    1 weight  0.10000E+01 volume  0.18360E-02 ppm1      0.286 ppm2      1.167 CV     1
 ASSI { 1412}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 83   and name HB2 ))
      2.700     0.900     0.900 peak  1412 spectrum    1 weight  0.10000E+01 volume  0.19056E-02 ppm1      0.020 ppm2      2.305 CV     1
 ASSI { 1413}
   (  segid "    " and resid 62   and name HG2%)
   (( segid "    " and resid 83   and name HB1 ))
      3.400     1.500     1.500 peak  1413 spectrum    1 weight  0.10000E+01 volume  0.31216E-02 ppm1      0.022 ppm2      2.145 CV     1
 ASSI { 1420}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 22   and name HN  ))
      2.600     0.900     0.900 peak  1420 spectrum    1 weight  0.10000E+01 volume  0.49981E-02 ppm1      1.408 ppm2      8.364 CV     1
 ASSI { 1422}
   (  segid "    " and resid 22   and name HG2%)
   (( segid "    " and resid 22   and name HB  ))
      2.300     0.600     0.600 peak  1422 spectrum    1 weight  0.10000E+01 volume  0.84307E-02 ppm1      1.406 ppm2      4.128 CV     1
 ASSI { 1439}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 53   and name HA  ))
      2.800     1.000     1.000 peak  1439 spectrum    1 weight  0.10000E+01 volume  0.16454E-02 ppm1      1.220 ppm2      4.962 CV     1
 ASSI { 1441}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 60   and name HD2 ))
      2.500     2.500     3.500 peak  1441 spectrum    1 weight  0.10000E+01 volume  0.39291E-02 ppm1      1.207 ppm2      1.752 CV     1
 ASSI { 1446}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 44   and name HN  ))
      3.800     1.800     1.800 peak  1446 spectrum    1 weight  0.10000E+01 volume  0.18457E-02 ppm1      0.902 ppm2      8.050 CV     1
 ASSI { 1448}
   (  segid "    " and resid 18   and name HG2%)
   (( segid "    " and resid 18   and name HA  ))
      2.500     2.500     3.500 peak  1448 spectrum    1 weight  0.10000E+01 volume  0.89022E-02 ppm1      0.899 ppm2      3.421 CV     1
 ASSI { 1451}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 50   and name HG2 ))
      2.500     2.500     3.500 peak  1451 spectrum    1 weight  0.10000E+01 volume  0.97403E-02 ppm1      0.902 ppm2      2.086 CV     1
 ASSI { 1452}
   (  segid "    " and resid 43   and name HD1%)
   (( segid "    " and resid 43   and name HB1 ))
      2.600     2.600     3.400 peak  1452 spectrum    1 weight  0.10000E+01 volume  0.14660E-01 ppm1      0.899 ppm2      1.430 CV     1
 ASSI { 1454}
   (  segid "    " and resid 43   and name HD2%)
   (( segid "    " and resid 43   and name HA  ))
      2.900     2.900     3.100 peak  1454 spectrum    1 weight  0.10000E+01 volume  0.11055E-01 ppm1      0.817 ppm2      4.241 CV     1
 ASSI { 1460}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 131  and name HE2 ))
      3.200     1.300     1.300 peak  1460 spectrum    1 weight  0.10000E+01 volume  0.14669E-02 ppm1      1.394 ppm2      2.093 CV     1
 OR { 1460}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 131  and name HE1 ))
 ASSI { 1464}
   (  segid "    " and resid 104  and name HG2%)
   (( segid "    " and resid 104  and name HA  ))
      2.400     0.700     0.700 peak  1464 spectrum    1 weight  0.10000E+01 volume  0.94147E-02 ppm1      1.344 ppm2      4.241 CV     1
 ASSI { 1465}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 41   and name HB  ))
      2.200     0.600     0.600 peak  1465 spectrum    1 weight  0.10000E+01 volume  0.11568E-01 ppm1      1.320 ppm2      4.290 CV     1
 ASSI { 1468}
   (  segid "    " and resid 41   and name HG2%)
   (( segid "    " and resid 41   and name HA  ))
      2.500     0.800     0.800 peak  1468 spectrum    1 weight  0.10000E+01 volume  0.62000E-02 ppm1      1.317 ppm2      3.846 CV     1
 ASSI { 1476}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 133  and name HA  ))
      2.000     2.000     4.000 peak  1476 spectrum    1 weight  0.10000E+01 volume  0.22161E-01 ppm1      1.270 ppm2      4.697 CV     1
 ASSI { 1479}
   (  segid "    " and resid 78   and name HG2%)
   (( segid "    " and resid 78   and name HA  ))
      3.100     1.200     1.200 peak  1479 spectrum    1 weight  0.10000E+01 volume  0.20612E-02 ppm1      1.265 ppm2      3.948 CV     1
 ASSI { 1482}
   (  segid "    " and resid 133  and name HG2%)
   (( segid "    " and resid 133  and name HN  ))
      3.100     1.200     1.200 peak  1482 spectrum    1 weight  0.10000E+01 volume  0.19962E-02 ppm1      1.251 ppm2      7.348 CV     1
 ASSI { 1486}
   (  segid "    " and resid 33   and name HG2%)
   (( segid "    " and resid 33   and name HB  ))
      2.100     0.600     0.600 peak  1486 spectrum    1 weight  0.10000E+01 volume  0.14046E-01 ppm1      1.234 ppm2      4.436 CV     1
 ASSI { 1487}
   (  segid "    " and resid 154  and name HG2%)
   (( segid "    " and resid 155  and name HN  ))
      3.600     1.600     1.600 peak  1487 spectrum    1 weight  0.10000E+01 volume  0.23429E-02 ppm1      1.220 ppm2      8.000 CV     1
 ASSI { 1488}
   (  segid "    " and resid 142  and name HG2%)
   (( segid "    " and resid 142  and name HN  ))
      3.800     1.800     1.800 peak  1488 spectrum    1 weight  0.10000E+01 volume  0.16305E-02 ppm1      1.206 ppm2      7.181 CV     1
 ASSI { 1496}
   (  segid "    " and resid 120  and name HG2%)
   (( segid "    " and resid 120  and name HA  ))
      2.500     0.800     0.800 peak  1496 spectrum    1 weight  0.10000E+01 volume  0.83036E-02 ppm1      1.165 ppm2      4.485 CV     1
 ASSI { 1497}
   (  segid "    " and resid 120  and name HG2%)
   (( segid "    " and resid 120  and name HB  ))
      2.200     0.600     0.600 peak  1497 spectrum    1 weight  0.10000E+01 volume  0.12193E-01 ppm1      1.168 ppm2      4.339 CV     1
 ASSI { 1499}
   (  segid "    " and resid 120  and name HG2%)
   (  segid "    " and resid 119  and name HD1%)
      2.300     2.300     3.700 peak  1499 spectrum    1 weight  0.10000E+01 volume  0.12885E-02 ppm1      1.166 ppm2     -0.201 CV     1
 ASSI { 1512}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 60   and name HG1 ))
      2.600     2.600     3.400 peak  1512 spectrum    1 weight  0.10000E+01 volume  0.78948E-02 ppm1      1.104 ppm2      0.824 CV     1
 OR { 1512}
   (  segid "    " and resid 87   and name HG2%)
   (( segid "    " and resid 60   and name HG2 ))
 ASSI { 1514}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 112  and name HN  ))
      3.400     1.400     1.400 peak  1514 spectrum    1 weight  0.10000E+01 volume  0.15958E-02 ppm1      0.849 ppm2      9.122 CV     1
 ASSI { 1515}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 111  and name HN  ))
      2.400     0.700     0.700 peak  1515 spectrum    1 weight  0.10000E+01 volume  0.44954E-02 ppm1      0.850 ppm2      8.878 CV     1
 ASSI { 1516}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 111  and name HA  ))
      2.400     2.400     3.600 peak  1516 spectrum    1 weight  0.10000E+01 volume  0.54796E-02 ppm1      0.847 ppm2      4.759 CV     1
 ASSI { 1517}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 111  and name HB  ))
      2.200     0.600     0.600 peak  1517 spectrum    1 weight  0.10000E+01 volume  0.92938E-02 ppm1      0.849 ppm2      2.240 CV     1
 ASSI { 1518}
   (  segid "    " and resid 111  and name HG1%)
   (( segid "    " and resid 110  and name HA2 ))
      3.600     1.600     1.600 peak  1518 spectrum    1 weight  0.10000E+01 volume  0.12288E-02 ppm1      0.844 ppm2      5.120 CV     1
 ASSI { 1524}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 71   and name HA  ))
      2.700     0.900     0.900 peak  1524 spectrum    1 weight  0.10000E+01 volume  0.85997E-02 ppm1      0.809 ppm2      5.268 CV     1
 ASSI { 1525}
   (  segid "    " and resid 71   and name HG2%)
   (( segid "    " and resid 71   and name HB  ))
      2.100     0.500     0.500 peak  1525 spectrum    1 weight  0.10000E+01 volume  0.11915E-01 ppm1      0.811 ppm2      1.752 CV     1
 ASSI { 1528}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 126  and name HN  ))
      2.300     0.700     0.700 peak  1528 spectrum    1 weight  0.10000E+01 volume  0.60123E-02 ppm1      1.413 ppm2      9.214 CV     1
 ASSI { 1530}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 127  and name HB2 ))
      3.600     1.600     1.600 peak  1530 spectrum    1 weight  0.10000E+01 volume  0.12424E-02 ppm1      1.416 ppm2      2.866 CV     1
 ASSI { 1532}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 131  and name HN  ))
      3.400     3.400     2.600 peak  1532 spectrum    1 weight  0.10000E+01 volume  0.16019E-02 ppm1      1.411 ppm2      9.612 CV     1
 ASSI { 1533}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 127  and name HN  ))
      2.600     0.800     0.800 peak  1533 spectrum    1 weight  0.10000E+01 volume  0.17052E-02 ppm1      1.413 ppm2      7.622 CV     1
 ASSI { 1534}
   (  segid "    " and resid 126  and name HB% )
   (( segid "    " and resid 126  and name HA  ))
      2.100     0.500     0.500 peak  1534 spectrum    1 weight  0.10000E+01 volume  0.10307E-01 ppm1      1.412 ppm2      5.173 CV     1
 ASSI { 1541}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 49   and name HN  ))
      3.000     3.000     3.000 peak  1541 spectrum    1 weight  0.10000E+01 volume  0.24646E-02 ppm1      1.364 ppm2      6.901 CV     1
 ASSI { 1542}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HA  ))
      2.500     0.800     0.800 peak  1542 spectrum    1 weight  0.10000E+01 volume  0.48998E-02 ppm1      1.364 ppm2      4.782 CV     1
 ASSI { 1543}
   (  segid "    " and resid 46   and name HG2%)
   (( segid "    " and resid 46   and name HB  ))
      2.200     0.600     0.600 peak  1543 spectrum    1 weight  0.10000E+01 volume  0.96667E-02 ppm1      1.366 ppm2      4.328 CV     1
 ASSI { 1551}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HD22))
      3.400     1.500     1.500 peak  1551 spectrum    1 weight  0.10000E+01 volume  0.12449E-02 ppm1      1.187 ppm2      7.015 CV     1
 OR { 1551}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 58   and name HD21))
 ASSI { 1553}
   (  segid "    " and resid 57   and name HG2%)
   (( segid "    " and resid 57   and name HB  ))
      2.200     0.600     0.600 peak  1553 spectrum    1 weight  0.10000E+01 volume  0.11058E-01 ppm1      1.183 ppm2      4.192 CV     1
 ASSI { 1554}
   (  segid "    " and resid 129  and name HB% )
   (( segid "    " and resid 130  and name HN  ))
      2.300     0.700     0.700 peak  1554 spectrum    1 weight  0.10000E+01 volume  0.10032E-01 ppm1      1.130 ppm2      8.103 CV     1
 ASSI { 1556}
   (  segid "    " and resid 129  and name HB% )
   (( segid "    " and resid 129  and name HA  ))
      2.100     0.600     0.600 peak  1556 spectrum    1 weight  0.10000E+01 volume  0.13342E-01 ppm1      1.130 ppm2      4.046 CV     1
 ASSI { 1559}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 4    and name HB2 ))
      2.400     0.700     0.700 peak  1559 spectrum    1 weight  0.10000E+01 volume  0.68551E-02 ppm1      1.033 ppm2      4.729 CV     1
 OR { 1559}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 1560}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 99   and name HA  ))
      2.400     0.700     0.700 peak  1560 spectrum    1 weight  0.10000E+01 volume  0.56219E-02 ppm1      1.033 ppm2      4.290 CV     1
 ASSI { 1562}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 95   and name HA  ))
      3.400     3.400     2.600 peak  1562 spectrum    1 weight  0.10000E+01 volume  0.14856E-02 ppm1      1.027 ppm2      3.411 CV     1
 ASSI { 1564}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 137  and name HG1 ))
      3.200     3.200     2.800 peak  1564 spectrum    1 weight  0.10000E+01 volume  0.29205E-02 ppm1      1.024 ppm2      2.044 CV     1
 OR { 1564}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 137  and name HG2 ))
 ASSI { 1565}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 152  and name HD1 ))
      3.500     3.500     2.500 peak  1565 spectrum    1 weight  0.10000E+01 volume  0.25505E-02 ppm1      1.025 ppm2      1.605 CV     1
 OR { 1565}
   (  segid "    " and resid 150  and name HG2%)
   (( segid "    " and resid 152  and name HD2 ))
 ASSI { 1566}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 111  and name HB  ))
      2.300     0.600     0.600 peak  1566 spectrum    1 weight  0.10000E+01 volume  0.71862E-02 ppm1      0.977 ppm2      2.240 CV     1
 ASSI { 1567}
   (  segid "    " and resid 111  and name HG2%)
   (( segid "    " and resid 112  and name HN  ))
      2.800     1.000     1.000 peak  1567 spectrum    1 weight  0.10000E+01 volume  0.39769E-02 ppm1      0.971 ppm2      9.122 CV     1
 ASSI { 1575}
   (  segid "    " and resid 18   and name HG1%)
   (( segid "    " and resid 18   and name HA  ))
      2.400     0.700     0.700 peak  1575 spectrum    1 weight  0.10000E+01 volume  0.70530E-02 ppm1      0.872 ppm2      3.404 CV     1
 ASSI { 1581}
   (  segid "    " and resid 61   and name HD1%)
   (  segid "    " and resid 155  and name HD% )
      4.000     2.000     2.000 peak  1581 spectrum    1 weight  0.10000E+01 volume  0.17859E-02 ppm1      0.532 ppm2      7.197 CV     1
 ASSI { 1585}
   (  segid "    " and resid 61   and name HD1%)
   (( segid "    " and resid 61   and name HG12))
      1.900     0.500     0.500 peak  1585 spectrum    1 weight  0.10000E+01 volume  0.15444E-01 ppm1      0.532 ppm2      1.113 CV     1
 OR { 1585}
   (  segid "    " and resid 61   and name HD1%)
   (( segid "    " and resid 61   and name HG11))
 ASSI { 1597}
   (  segid "    " and resid 129  and name HB% )
   (( segid "    " and resid 125  and name HB1 ))
      3.000     1.200     1.200 peak  1597 spectrum    1 weight  0.10000E+01 volume  0.16509E-02 ppm1      1.123 ppm2      3.526 CV     1
 ASSI { 1610}
   (  segid "    " and resid 61   and name HD1%)
   (( segid "    " and resid 61   and name HA  ))
      3.500     1.500     1.500 peak  1610 spectrum    1 weight  0.10000E+01 volume  0.30145E-02 ppm1      0.530 ppm2      4.553 CV     1
 ASSI { 1613}
   (  segid "    " and resid 61   and name HD1%)
   (( segid "    " and resid 61   and name HB  ))
      2.100     2.100     3.900 peak  1613 spectrum    1 weight  0.10000E+01 volume  0.10856E-01 ppm1      0.530 ppm2      1.505 CV     1
 ASSI { 1630}
   (  segid "    " and resid 79   and name HB% )
   (( segid "    " and resid 79   and name HA  ))
      2.100     0.600     0.600 peak  1630 spectrum    1 weight  0.10000E+01 volume  0.13951E-01 ppm1      1.677 ppm2      4.440 CV     1
 ASSI { 1636}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 107  and name HN  ))
      2.300     0.600     0.600 peak  1636 spectrum    1 weight  0.10000E+01 volume  0.39804E-02 ppm1      1.125 ppm2      9.371 CV     1
 ASSI { 1638}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 108  and name HN  ))
      2.900     1.100     1.100 peak  1638 spectrum    1 weight  0.10000E+01 volume  0.22070E-02 ppm1      1.126 ppm2      7.499 CV     1
 ASSI { 1649}
   (  segid "    " and resid 48   and name HB% )
   (( segid "    " and resid 48   and name HA  ))
      2.100     0.500     0.500 peak  1649 spectrum    1 weight  0.10000E+01 volume  0.14065E-01 ppm1      1.394 ppm2      4.130 CV     1
 ASSI { 1658}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 13   and name HD22))
      1.800     1.800     4.200 peak  1658 spectrum    1 weight  0.10000E+01 volume  0.60983E-02 ppm1      1.667 ppm2      7.150 CV     1
 ASSI { 1659}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 14   and name HA  ))
      2.200     0.600     0.600 peak  1659 spectrum    1 weight  0.10000E+01 volume  0.93471E-02 ppm1      1.665 ppm2      4.023 CV     1
 ASSI { 1660}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 10   and name HE2 ))
      2.700     2.700     3.300 peak  1660 spectrum    1 weight  0.10000E+01 volume  0.36994E-02 ppm1      1.665 ppm2      3.035 CV     1
 OR { 1660}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 10   and name HE1 ))
 ASSI { 1661}
   (  segid "    " and resid 14   and name HB% )
   (  segid "    " and resid 100  and name HD1%)
      2.100     2.100     3.900 peak  1661 spectrum    1 weight  0.10000E+01 volume  0.13193E-01 ppm1      1.668 ppm2      1.007 CV     1
 ASSI { 1665}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 25   and name HB  ))
      2.900     2.900     3.100 peak  1665 spectrum    1 weight  0.10000E+01 volume  0.59095E-02 ppm1      1.506 ppm2      1.772 CV     1
 ASSI { 1673}
   (  segid "    " and resid 140  and name HB% )
   (  segid "    " and resid 95   and name HG1%)
      1.900     1.900     4.100 peak  1673 spectrum    1 weight  0.10000E+01 volume  0.30589E-01 ppm1      1.433 ppm2      0.868 CV     1
 OR { 1673}
   (  segid "    " and resid 140  and name HB% )
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 1681}
   (  segid "    " and resid 153  and name HG2%)
   (( segid "    " and resid 153  and name HN  ))
      3.000     1.100     1.100 peak  1681 spectrum    1 weight  0.10000E+01 volume  0.16482E-02 ppm1      1.112 ppm2      8.878 CV     1
 OR { 1681}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 153  and name HN  ))
 ASSI { 1682}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 153  and name HA  ))
      2.400     0.700     0.700 peak  1682 spectrum    1 weight  0.10000E+01 volume  0.60361E-02 ppm1      1.112 ppm2      5.168 CV     1
 OR { 1682}
   (  segid "    " and resid 153  and name HG2%)
   (( segid "    " and resid 153  and name HA  ))
 ASSI { 1683}
   (  segid "    " and resid 153  and name HG1%)
   (( segid "    " and resid 153  and name HB  ))
      2.200     0.600     0.600 peak  1683 spectrum    1 weight  0.10000E+01 volume  0.86493E-02 ppm1      1.113 ppm2      2.484 CV     1
 OR { 1683}
   (  segid "    " and resid 153  and name HG2%)
   (( segid "    " and resid 153  and name HB  ))
 ASSI { 1701}
   (  segid "    " and resid 93   and name HB% )
   (( segid "    " and resid 89   and name HG  ))
      3.500     1.500     1.500 peak  1701 spectrum    1 weight  0.10000E+01 volume  0.13233E-02 ppm1      0.522 ppm2      1.312 CV     1
 ASSI { 1704}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 74   and name HN  ))
      2.300     2.300     3.700 peak  1704 spectrum    1 weight  0.10000E+01 volume  0.66302E-02 ppm1      0.111 ppm2      6.974 CV     1
 ASSI { 1705}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 74   and name HA  ))
      2.300     0.600     0.600 peak  1705 spectrum    1 weight  0.10000E+01 volume  0.67568E-02 ppm1      0.110 ppm2      3.850 CV     1
 ASSI { 1707}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 76   and name HN  ))
      3.000     3.000     3.000 peak  1707 spectrum    1 weight  0.10000E+01 volume  0.32388E-02 ppm1      0.106 ppm2      7.804 CV     1
 ASSI { 1708}
   (  segid "    " and resid 74   and name HB% )
   (  segid "    " and resid 156  and name HE% )
      2.900     1.000     1.000 peak  1708 spectrum    1 weight  0.10000E+01 volume  0.17545E-02 ppm1      0.105 ppm2      7.658 CV     1
 ASSI { 1709}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 80   and name HN  ))
      3.300     1.300     1.300 peak  1709 spectrum    1 weight  0.10000E+01 volume  0.22316E-02 ppm1      0.105 ppm2      7.316 CV     1
 ASSI { 1710}
   (  segid "    " and resid 74   and name HB% )
   (( segid "    " and resid 156  and name HZ  ))
      3.000     1.100     1.100 peak  1710 spectrum    1 weight  0.10000E+01 volume  0.15334E-02 ppm1      0.105 ppm2      7.170 CV     1
 ASSI { 1713}
   (  segid "    " and resid 74   and name HB% )
   (  segid "    " and resid 79   and name HB% )
      3.800     3.800     2.200 peak  1713 spectrum    1 weight  0.10000E+01 volume  0.17230E-02 ppm1      0.107 ppm2      1.654 CV     1
 ASSI { 1717}
   (  segid "    " and resid 24   and name HB% )
   (( segid "    " and resid 24   and name HA  ))
      2.200     0.600     0.600 peak  1717 spectrum    1 weight  0.10000E+01 volume  0.13713E-01 ppm1      1.472 ppm2      4.192 CV     1
 ASSI { 1719}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 138  and name HN  ))
      2.200     0.600     0.600 peak  1719 spectrum    1 weight  0.10000E+01 volume  0.11057E-01 ppm1      1.394 ppm2      8.243 CV     1
 ASSI { 1721}
   (  segid "    " and resid 138  and name HB% )
   (( segid "    " and resid 138  and name HA  ))
      2.100     0.500     0.500 peak  1721 spectrum    1 weight  0.10000E+01 volume  0.18245E-01 ppm1      1.394 ppm2      4.095 CV     1
 ASSI { 1723}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 98   and name HN  ))
      2.100     0.600     0.600 peak  1723 spectrum    1 weight  0.10000E+01 volume  0.93972E-02 ppm1      1.344 ppm2      9.561 CV     1
 ASSI { 1725}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 99   and name HN  ))
      2.900     1.100     1.100 peak  1725 spectrum    1 weight  0.10000E+01 volume  0.21601E-02 ppm1      1.344 ppm2      6.779 CV     1
 ASSI { 1727}
   (  segid "    " and resid 98   and name HB% )
   (( segid "    " and resid 95   and name HA  ))
      2.500     0.800     0.800 peak  1727 spectrum    1 weight  0.10000E+01 volume  0.34164E-02 ppm1      1.344 ppm2      3.411 CV     1
 ASSI { 1733}
   (  segid "    " and resid 71   and name HG1%)
   (( segid "    " and resid 71   and name HN  ))
      2.400     0.700     0.700 peak  1733 spectrum    1 weight  0.10000E+01 volume  0.57895E-02 ppm1      0.562 ppm2      8.166 CV     1
 ASSI { 1741}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HN  ))
      4.000     2.000     2.000 peak  1741 spectrum    1 weight  0.10000E+01 volume  0.19777E-02 ppm1      0.166 ppm2      8.341 CV     1
 ASSI { 1743}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 25   and name HA  ))
      2.800     1.000     1.000 peak  1743 spectrum    1 weight  0.10000E+01 volume  0.45249E-02 ppm1      0.163 ppm2      3.481 CV     1
 ASSI { 1744}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 25   and name HG2%)
      2.300     2.300     3.700 peak  1744 spectrum    1 weight  0.10000E+01 volume  0.10124E-01 ppm1      0.159 ppm2      0.590 CV     1
 ASSI { 1746}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 29   and name HD% )
      2.800     2.800     3.200 peak  1746 spectrum    1 weight  0.10000E+01 volume  0.36478E-02 ppm1      0.163 ppm2      7.337 CV     1
 ASSI { 1747}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 29   and name HE% )
      2.900     1.100     1.100 peak  1747 spectrum    1 weight  0.10000E+01 volume  0.21112E-02 ppm1      0.163 ppm2      6.692 CV     1
 ASSI { 1752}
   (  segid "    " and resid 92   and name HB% )
   (( segid "    " and resid 92   and name HN  ))
      2.200     0.600     0.600 peak  1752 spectrum    1 weight  0.10000E+01 volume  0.11881E-01 ppm1      1.416 ppm2      7.999 CV     1
 ASSI { 1755}
   (  segid "    " and resid 143  and name HB% )
   (( segid "    " and resid 144  and name HN  ))
      2.700     0.900     0.900 peak  1755 spectrum    1 weight  0.10000E+01 volume  0.24226E-02 ppm1      1.348 ppm2      8.341 CV     1
 ASSI { 1756}
   (  segid "    " and resid 143  and name HB% )
   (( segid "    " and resid 143  and name HN  ))
      2.200     0.600     0.600 peak  1756 spectrum    1 weight  0.10000E+01 volume  0.84989E-02 ppm1      1.349 ppm2      7.902 CV     1
 ASSI { 1760}
   (  segid "    " and resid 134  and name HB% )
   (( segid "    " and resid 135  and name HN  ))
      3.300     1.400     1.400 peak  1760 spectrum    1 weight  0.10000E+01 volume  0.36140E-02 ppm1      1.069 ppm2      8.642 CV     1
 ASSI { 1764}
   (  segid "    " and resid 134  and name HB% )
   (( segid "    " and resid 133  and name HB  ))
      3.700     1.700     1.700 peak  1764 spectrum    1 weight  0.10000E+01 volume  0.15287E-02 ppm1      1.070 ppm2      4.339 CV     1
 ASSI { 1767}
   (  segid "    " and resid 134  and name HB% )
   (( segid "    " and resid 102  and name HB2 ))
      2.600     2.600     3.400 peak  1767 spectrum    1 weight  0.10000E+01 volume  0.23509E-02 ppm1      1.065 ppm2      1.605 CV     1
 ASSI { 1770}
   (  segid "    " and resid 15   and name HG2%)
   (  segid "    " and resid 14   and name HB% )
      3.300     3.300     2.700 peak  1770 spectrum    1 weight  0.10000E+01 volume  0.46936E-02 ppm1      0.960 ppm2      1.654 CV     1
 ASSI { 1787}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HN  ))
      3.900     1.900     1.900 peak  1787 spectrum    1 weight  0.10000E+01 volume  0.17708E-02 ppm1      0.958 ppm2      8.446 CV     1
 ASSI { 1789}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 16   and name HA  ))
      2.800     1.000     1.000 peak  1789 spectrum    1 weight  0.10000E+01 volume  0.27007E-02 ppm1      0.960 ppm2      4.222 CV     1
 ASSI { 1790}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 105  and name HB2 ))
      2.600     2.600     3.400 peak  1790 spectrum    1 weight  0.10000E+01 volume  0.75405E-02 ppm1      0.962 ppm2      4.016 CV     1
 ASSI { 1794}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 114  and name HN  ))
      2.500     2.500     3.500 peak  1794 spectrum    1 weight  0.10000E+01 volume  0.40265E-02 ppm1      0.590 ppm2      8.240 CV     1
 ASSI { 1797}
   (  segid "    " and resid 113  and name HG2%)
   (( segid "    " and resid 113  and name HB  ))
      2.100     0.500     0.500 peak  1797 spectrum    1 weight  0.10000E+01 volume  0.93648E-02 ppm1      0.586 ppm2      1.504 CV     1
 ASSI { 1804}
   (  segid "    " and resid 30   and name HG2%)
   (( segid "    " and resid 31   and name HA1 ))
      3.100     1.200     1.200 peak  1804 spectrum    1 weight  0.10000E+01 volume  0.25196E-02 ppm1      1.115 ppm2      3.803 CV     1
 ASSI { 1807}
   (  segid "    " and resid 30   and name HG2%)
   (( segid "    " and resid 30   and name HB  ))
      2.200     0.600     0.600 peak  1807 spectrum    1 weight  0.10000E+01 volume  0.90641E-02 ppm1      1.117 ppm2      2.003 CV     1
 ASSI { 1812}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HB  ))
      2.000     0.500     0.500 peak  1812 spectrum    1 weight  0.10000E+01 volume  0.18382E-01 ppm1      0.973 ppm2      1.975 CV     1
 OR { 1812}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HG12))
 OR { 1812}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HG11))
 ASSI { 1813}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 16   and name HN  ))
      3.100     3.100     2.900 peak  1813 spectrum    1 weight  0.10000E+01 volume  0.26282E-02 ppm1      0.957 ppm2      8.194 CV     1
 ASSI { 1814}
   (  segid "    " and resid 15   and name HG2%)
   (( segid "    " and resid 15   and name HA  ))
      2.500     0.800     0.800 peak  1814 spectrum    1 weight  0.10000E+01 volume  0.53137E-02 ppm1      0.963 ppm2      3.485 CV     1
 ASSI { 1821}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 122  and name HD% )
      3.600     3.600     2.400 peak  1821 spectrum    1 weight  0.10000E+01 volume  0.17779E-02 ppm1     -0.197 ppm2      6.773 CV     1
 ASSI { 1825}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HA  ))
      2.900     1.000     1.000 peak  1825 spectrum    1 weight  0.10000E+01 volume  0.36959E-02 ppm1     -0.198 ppm2      3.835 CV     1
 ASSI { 1826}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HB  ))
      2.300     0.700     0.700 peak  1826 spectrum    1 weight  0.10000E+01 volume  0.62512E-02 ppm1     -0.198 ppm2      1.947 CV     1
 ASSI { 1828}
   (  segid "    " and resid 119  and name HD1%)
   (( segid "    " and resid 119  and name HG11))
      2.500     0.800     0.800 peak  1828 spectrum    1 weight  0.10000E+01 volume  0.36928E-02 ppm1     -0.200 ppm2      1.123 CV     1
 ASSI { 1829}
   (  segid "    " and resid 119  and name HD1%)
   (  segid "    " and resid 119  and name HG2%)
      2.300     2.300     3.700 peak  1829 spectrum    1 weight  0.10000E+01 volume  0.15643E-01 ppm1     -0.199 ppm2      0.575 CV     1
 ASSI { 1854}
   (  segid "    " and resid 135  and name HD1%)
   (( segid "    " and resid 7    and name HB1 ))
      3.100     1.200     1.200 peak  1854 spectrum    1 weight  0.10000E+01 volume  0.31345E-02 ppm1      0.853 ppm2      2.770 CV     1
 ASSI { 1856}
   (  segid "    " and resid 135  and name HD1%)
   (( segid "    " and resid 135  and name HG11))
      2.100     0.600     0.600 peak  1856 spectrum    1 weight  0.10000E+01 volume  0.11449E-01 ppm1      0.853 ppm2      1.361 CV     1
 OR { 1856}
   (  segid "    " and resid 135  and name HD1%)
   (( segid "    " and resid 135  and name HG12))
 ASSI { 1857}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HN  ))
      2.600     0.800     0.800 peak  1857 spectrum    1 weight  0.10000E+01 volume  0.26976E-02 ppm1      0.575 ppm2      8.339 CV     1
 ASSI { 1858}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 82   and name HE% )
      3.100     1.200     1.200 peak  1858 spectrum    1 weight  0.10000E+01 volume  0.13372E-02 ppm1      0.573 ppm2      6.492 CV     1
 OR { 1858}
   (  segid "    " and resid 25   and name HG2%)
   (  segid "    " and resid 82   and name HD% )
 ASSI { 1861}
   (  segid "    " and resid 25   and name HG2%)
   (( segid "    " and resid 25   and name HB  ))
      2.100     0.500     0.500 peak  1861 spectrum    1 weight  0.10000E+01 volume  0.10018E-01 ppm1      0.571 ppm2      1.799 CV     1
 ASSI { 1867}
   (  segid "    " and resid 30   and name HD1%)
   (( segid "    " and resid 30   and name HA  ))
      3.300     1.300     1.300 peak  1867 spectrum    1 weight  0.10000E+01 volume  0.34645E-02 ppm1      0.971 ppm2      4.039 CV     1
 ASSI { 1869}
   (  segid "    " and resid 30   and name HD1%)
   (( segid "    " and resid 30   and name HB  ))
      2.800     0.900     0.900 peak  1869 spectrum    1 weight  0.10000E+01 volume  0.46240E-02 ppm1      0.967 ppm2      1.979 CV     1
 ASSI { 1875}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 94   and name HN  ))
      3.600     1.600     1.600 peak  1875 spectrum    1 weight  0.10000E+01 volume  0.23967E-02 ppm1      0.878 ppm2      8.439 CV     1
 OR { 1875}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 94   and name HN  ))
 ASSI { 1877}
   (  segid "    " and resid 95   and name HG1%)
   (( segid "    " and resid 95   and name HA  ))
      2.900     1.000     1.000 peak  1877 spectrum    1 weight  0.10000E+01 volume  0.22413E-02 ppm1      0.877 ppm2      3.465 CV     1
 OR { 1877}
   (  segid "    " and resid 95   and name HG2%)
   (( segid "    " and resid 95   and name HA  ))
 ASSI { 1881}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 128  and name HN  ))
      3.400     3.400     2.600 peak  1881 spectrum    1 weight  0.10000E+01 volume  0.14978E-02 ppm1      0.653 ppm2      8.860 CV     1
 ASSI { 1886}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 130  and name HA  ))
      3.000     1.100     1.100 peak  1886 spectrum    1 weight  0.10000E+01 volume  0.20143E-02 ppm1      0.652 ppm2      4.897 CV     1
 ASSI { 1888}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 113  and name HB  ))
      2.600     0.800     0.800 peak  1888 spectrum    1 weight  0.10000E+01 volume  0.37930E-02 ppm1      0.653 ppm2      1.535 CV     1
 ASSI { 1889}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 113  and name HG11))
      2.300     0.600     0.600 peak  1889 spectrum    1 weight  0.10000E+01 volume  0.63793E-02 ppm1      0.652 ppm2      1.264 CV     1
 OR { 1889}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 113  and name HG12))
 ASSI { 1903}
   (  segid "    " and resid 42   and name HD1%)
   (( segid "    " and resid 42   and name HG11))
      2.300     0.700     0.700 peak  1903 spectrum    1 weight  0.10000E+01 volume  0.56119E-02 ppm1      0.945 ppm2      1.673 CV     1
 OR { 1903}
   (  segid "    " and resid 42   and name HD1%)
   (( segid "    " and resid 42   and name HG12))
 ASSI { 1913}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 72   and name HA1 ))
      2.900     2.900     3.100 peak  1913 spectrum    1 weight  0.10000E+01 volume  0.32499E-02 ppm1      0.780 ppm2      3.805 CV     1
 ASSI { 1915}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 43   and name HB2 ))
      3.100     3.100     2.900 peak  1915 spectrum    1 weight  0.10000E+01 volume  0.34946E-02 ppm1      0.781 ppm2      1.976 CV     1
 ASSI { 1916}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 38   and name HB1 ))
      2.800     2.800     3.200 peak  1916 spectrum    1 weight  0.10000E+01 volume  0.11934E-01 ppm1      0.777 ppm2      1.463 CV     1
 OR { 1916}
   (  segid "    " and resid 42   and name HG2%)
   (( segid "    " and resid 38   and name HB2 ))
 ASSI { 1937}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name HG12))
      2.200     2.200     3.800 peak  1937 spectrum    1 weight  0.10000E+01 volume  0.75451E-02 ppm1      0.583 ppm2      1.556 CV     1
 ASSI { 1938}
   (  segid "    " and resid 119  and name HG2%)
   (( segid "    " and resid 119  and name HG11))
      2.500     2.500     3.500 peak  1938 spectrum    1 weight  0.10000E+01 volume  0.98111E-02 ppm1      0.583 ppm2      1.114 CV     1
 ASSI { 1941}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 85   and name HN  ))
      2.400     0.700     0.700 peak  1941 spectrum    1 weight  0.10000E+01 volume  0.38062E-02 ppm1      3.997 ppm2      9.805 CV     1
 ASSI { 1942}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 70   and name HD21))
      2.400     0.700     0.700 peak  1942 spectrum    1 weight  0.10000E+01 volume  0.36572E-02 ppm1      4.005 ppm2      7.311 CV     1
 ASSI { 1943}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 84   and name HA  ))
      3.900     1.900     1.900 peak  1943 spectrum    1 weight  0.10000E+01 volume  0.12704E-02 ppm1      4.002 ppm2      5.269 CV     1
 ASSI { 1947}
   (( segid "    " and resid 133  and name HB  ))
   (( segid "    " and resid 134  and name HN  ))
      2.300     0.600     0.600 peak  1947 spectrum    1 weight  0.10000E+01 volume  0.68473E-02 ppm1      4.364 ppm2      7.804 CV     1
 ASSI { 1948}
   (( segid "    " and resid 133  and name HB  ))
   (  segid "    " and resid 133  and name HG2%)
      2.200     0.600     0.600 peak  1948 spectrum    1 weight  0.10000E+01 volume  0.95358E-02 ppm1      4.363 ppm2      1.248 CV     1
 ASSI { 1949}
   (( segid "    " and resid 133  and name HB  ))
   (( segid "    " and resid 133  and name HA  ))
      2.300     0.700     0.700 peak  1949 spectrum    1 weight  0.10000E+01 volume  0.60937E-02 ppm1      4.357 ppm2      4.680 CV     1
 ASSI { 1950}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 48   and name HN  ))
      3.400     1.400     1.400 peak  1950 spectrum    1 weight  0.10000E+01 volume  0.13985E-02 ppm1      4.353 ppm2      8.043 CV     1
 ASSI { 1951}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HN  ))
      2.700     0.900     0.900 peak  1951 spectrum    1 weight  0.10000E+01 volume  0.27131E-02 ppm1      4.347 ppm2      7.226 CV     1
 ASSI { 1952}
   (( segid "    " and resid 78   and name HB  ))
   (  segid "    " and resid 79   and name HB% )
      3.300     3.300     2.700 peak  1952 spectrum    1 weight  0.10000E+01 volume  0.17269E-02 ppm1      4.349 ppm2      1.653 CV     1
 ASSI { 1953}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 43   and name HA  ))
      2.400     2.400     3.600 peak  1953 spectrum    1 weight  0.10000E+01 volume  0.85221E-02 ppm1      4.345 ppm2      4.225 CV     1
 ASSI { 1955}
   (( segid "    " and resid 46   and name HB  ))
   (( segid "    " and resid 46   and name HA  ))
      2.500     0.800     0.800 peak  1955 spectrum    1 weight  0.10000E+01 volume  0.55698E-02 ppm1      4.349 ppm2      4.764 CV     1
 ASSI { 1956}
   (( segid "    " and resid 78   and name HB  ))
   (( segid "    " and resid 78   and name HN  ))
      3.400     1.400     1.400 peak  1956 spectrum    1 weight  0.10000E+01 volume  0.20922E-02 ppm1      4.374 ppm2      8.123 CV     1
 ASSI { 1957}
   (( segid "    " and resid 78   and name HB  ))
   (  segid "    " and resid 78   and name HG2%)
      2.300     0.600     0.600 peak  1957 spectrum    1 weight  0.10000E+01 volume  0.93694E-02 ppm1      4.375 ppm2      1.286 CV     1
 ASSI { 1962}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 57   and name HN  ))
      2.500     0.800     0.800 peak  1962 spectrum    1 weight  0.10000E+01 volume  0.34109E-02 ppm1      4.193 ppm2      8.325 CV     1
 ASSI { 1965}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 143  and name HN  ))
      2.500     0.800     0.800 peak  1965 spectrum    1 weight  0.10000E+01 volume  0.34424E-02 ppm1      4.114 ppm2      7.902 CV     1
 ASSI { 1966}
   (( segid "    " and resid 142  and name HB  ))
   (( segid "    " and resid 142  and name HN  ))
      2.300     0.600     0.600 peak  1966 spectrum    1 weight  0.10000E+01 volume  0.56408E-02 ppm1      4.115 ppm2      7.170 CV     1
 ASSI { 1967}
   (( segid "    " and resid 142  and name HB  ))
   (  segid "    " and resid 142  and name HG2%)
      2.200     0.600     0.600 peak  1967 spectrum    1 weight  0.10000E+01 volume  0.81675E-02 ppm1      4.112 ppm2      1.215 CV     1
 ASSI { 1971}
   (( segid "    " and resid 41   and name HB  ))
   (( segid "    " and resid 42   and name HN  ))
      2.900     1.000     1.000 peak  1971 spectrum    1 weight  0.10000E+01 volume  0.16394E-02 ppm1      4.303 ppm2      7.560 CV     1
 ASSI { 1973}
   (( segid "    " and resid 41   and name HB  ))
   (( segid "    " and resid 41   and name HA  ))
      2.300     0.700     0.700 peak  1973 spectrum    1 weight  0.10000E+01 volume  0.70601E-02 ppm1      4.297 ppm2      3.850 CV     1
 ASSI { 1974}
   (( segid "    " and resid 41   and name HB  ))
   (  segid "    " and resid 44   and name HD2%)
      3.600     1.600     1.600 peak  1974 spectrum    1 weight  0.10000E+01 volume  0.19215E-02 ppm1      4.297 ppm2      0.775 CV     1
 OR { 1974}
   (( segid "    " and resid 41   and name HB  ))
   (  segid "    " and resid 44   and name HD1%)
 ASSI { 1975}
   (( segid "    " and resid 57   and name HB  ))
   (( segid "    " and resid 58   and name HN  ))
      2.600     0.800     0.800 peak  1975 spectrum    1 weight  0.10000E+01 volume  0.31414E-02 ppm1      4.193 ppm2      8.060 CV     1
 ASSI { 1977}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB2 ))
      2.800     1.000     1.000 peak  1977 spectrum    1 weight  0.10000E+01 volume  0.48440E-02 ppm1      4.012 ppm2      2.386 CV     1
 ASSI { 1978}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HB1 ))
      2.600     0.900     0.900 peak  1978 spectrum    1 weight  0.10000E+01 volume  0.33508E-02 ppm1      4.007 ppm2      1.996 CV     1
 OR { 1978}
   (( segid "    " and resid 137  and name HA  ))
   (( segid "    " and resid 137  and name HG1 ))
 ASSI { 1980}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 99   and name HG2%)
      1.800     1.800     4.200 peak  1980 spectrum    1 weight  0.10000E+01 volume  0.69126E-02 ppm1      4.010 ppm2      1.019 CV     1
 ASSI { 1981}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 95   and name HG1%)
      2.900     2.900     3.100 peak  1981 spectrum    1 weight  0.10000E+01 volume  0.29790E-02 ppm1      4.010 ppm2      0.873 CV     1
 OR { 1981}
   (( segid "    " and resid 137  and name HA  ))
   (  segid "    " and resid 95   and name HG2%)
 ASSI { 1983}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 57   and name HN  ))
      2.800     0.900     0.900 peak  1983 spectrum    1 weight  0.10000E+01 volume  0.26174E-02 ppm1      4.079 ppm2      8.328 CV     1
 ASSI { 1985}
   (( segid "    " and resid 57   and name HA  ))
   (  segid "    " and resid 57   and name HG2%)
      2.400     0.700     0.700 peak  1985 spectrum    1 weight  0.10000E+01 volume  0.79338E-02 ppm1      4.076 ppm2      1.194 CV     1
 ASSI { 1986}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      3.200     1.300     1.300 peak  1986 spectrum    1 weight  0.10000E+01 volume  0.14572E-02 ppm1      3.864 ppm2      7.999 CV     1
 ASSI { 1988}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      2.800     1.000     1.000 peak  1988 spectrum    1 weight  0.10000E+01 volume  0.23058E-02 ppm1      3.859 ppm2      8.585 CV     1
 ASSI { 1989}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      3.200     1.300     1.300 peak  1989 spectrum    1 weight  0.10000E+01 volume  0.12667E-02 ppm1      3.857 ppm2      7.560 CV     1
 ASSI { 1992}
   (( segid "    " and resid 41   and name HA  ))
   (( segid "    " and resid 44   and name HG  ))
      2.700     0.900     0.900 peak  1992 spectrum    1 weight  0.10000E+01 volume  0.22891E-02 ppm1      3.860 ppm2      1.626 CV     1
 ASSI { 1993}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 44   and name HD2%)
      2.600     0.900     0.900 peak  1993 spectrum    1 weight  0.10000E+01 volume  0.59095E-02 ppm1      3.857 ppm2      0.775 CV     1
 OR { 1993}
   (( segid "    " and resid 41   and name HA  ))
   (  segid "    " and resid 44   and name HD1%)
 ASSI { 1995}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HA  ))
      2.500     0.800     0.800 peak  1995 spectrum    1 weight  0.10000E+01 volume  0.52447E-02 ppm1      4.016 ppm2      4.680 CV     1
 OR { 1995}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HA  ))
 ASSI { 1999}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 65   and name HN  ))
      2.800     1.000     1.000 peak  1999 spectrum    1 weight  0.10000E+01 volume  0.16494E-02 ppm1      4.366 ppm2      8.060 CV     1
 ASSI { 2000}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 82   and name HE% )
      2.800     2.800     3.200 peak  2000 spectrum    1 weight  0.10000E+01 volume  0.24200E-02 ppm1      4.365 ppm2      6.535 CV     1
 ASSI { 2001}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB2 ))
      2.500     0.800     0.800 peak  2001 spectrum    1 weight  0.10000E+01 volume  0.50084E-02 ppm1      4.364 ppm2      2.519 CV     1
 ASSI { 2002}
   (( segid "    " and resid 64   and name HA  ))
   (( segid "    " and resid 64   and name HB1 ))
      2.300     0.700     0.700 peak  2002 spectrum    1 weight  0.10000E+01 volume  0.34593E-02 ppm1      4.367 ppm2      0.997 CV     1
 ASSI { 2005}
   (( segid "    " and resid 56   and name HA  ))
   (( segid "    " and resid 151  and name HN  ))
      2.900     2.900     3.100 peak  2005 spectrum    1 weight  0.10000E+01 volume  0.22232E-02 ppm1      4.346 ppm2      8.529 CV     1
 ASSI { 2006}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 22   and name HB  ))
      2.400     0.700     0.700 peak  2006 spectrum    1 weight  0.10000E+01 volume  0.52424E-02 ppm1      4.347 ppm2      4.143 CV     1
 ASSI { 2007}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 22   and name HG2%)
      2.500     0.800     0.800 peak  2007 spectrum    1 weight  0.10000E+01 volume  0.64311E-02 ppm1      4.345 ppm2      1.410 CV     1
 ASSI { 2008}
   (( segid "    " and resid 22   and name HA  ))
   (  segid "    " and resid 25   and name HG2%)
      2.700     0.900     0.900 peak  2008 spectrum    1 weight  0.10000E+01 volume  0.28913E-02 ppm1      4.347 ppm2      0.570 CV     1
 ASSI { 2009}
   (( segid "    " and resid 22   and name HA  ))
   (( segid "    " and resid 23   and name HN  ))
      3.200     1.200     1.200 peak  2009 spectrum    1 weight  0.10000E+01 volume  0.13588E-02 ppm1      4.340 ppm2      7.804 CV     1
 ASSI { 2011}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
      2.800     1.000     1.000 peak  2011 spectrum    1 weight  0.10000E+01 volume  0.22617E-02 ppm1      3.992 ppm2      7.179 CV     1
 ASSI { 2013}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HN  ))
      3.200     1.300     1.300 peak  2013 spectrum    1 weight  0.10000E+01 volume  0.16966E-02 ppm1      4.266 ppm2      9.122 CV     1
 ASSI { 2014}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HA  ))
      2.400     0.700     0.700 peak  2014 spectrum    1 weight  0.10000E+01 volume  0.50932E-02 ppm1      4.268 ppm2      4.680 CV     1
 ASSI { 2015}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 132  and name HB1 ))
      1.700     0.400     0.500 peak  2015 spectrum    1 weight  0.10000E+01 volume  0.12245E-01 ppm1      4.268 ppm2      3.811 CV     1
 ASSI { 2016}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 103  and name HA1 ))
      3.500     1.600     1.600 peak  2016 spectrum    1 weight  0.10000E+01 volume  0.14684E-02 ppm1      4.219 ppm2      3.948 CV     1
 ASSI { 2018}
   (( segid "    " and resid 34   and name HB1 ))
   (( segid "    " and resid 34   and name HN  ))
      3.200     1.300     1.300 peak  2018 spectrum    1 weight  0.10000E+01 volume  0.18159E-02 ppm1      3.992 ppm2      7.658 CV     1
 OR { 2018}
   (( segid "    " and resid 34   and name HB2 ))
   (( segid "    " and resid 34   and name HN  ))
 ASSI { 2019}
   (( segid "    " and resid 142  and name HA  ))
   (  segid "    " and resid 142  and name HG2%)
      2.300     0.700     0.700 peak  2019 spectrum    1 weight  0.10000E+01 volume  0.78321E-02 ppm1      3.990 ppm2      1.198 CV     1
 ASSI { 2022}
   (( segid "    " and resid 132  and name HB1 ))
   (( segid "    " and resid 132  and name HA  ))
      2.600     0.900     0.900 peak  2022 spectrum    1 weight  0.10000E+01 volume  0.48677E-02 ppm1      3.831 ppm2      4.695 CV     1
 ASSI { 2024}
   (( segid "    " and resid 132  and name HB1 ))
   (( segid "    " and resid 122  and name HB2 ))
      3.200     1.300     1.300 peak  2024 spectrum    1 weight  0.10000E+01 volume  0.18753E-02 ppm1      3.834 ppm2      2.801 CV     1
 ASSI { 2025}
   (( segid "    " and resid 132  and name HB1 ))
   (( segid "    " and resid 122  and name HB1 ))
      3.000     1.100     1.100 peak  2025 spectrum    1 weight  0.10000E+01 volume  0.17538E-02 ppm1      3.831 ppm2      2.526 CV     1
 ASSI { 2026}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      3.200     1.300     1.300 peak  2026 spectrum    1 weight  0.10000E+01 volume  0.15246E-02 ppm1      4.243 ppm2      7.951 CV     1
 ASSI { 2027}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 104  and name HB  ))
      2.300     0.700     0.700 peak  2027 spectrum    1 weight  0.10000E+01 volume  0.80681E-02 ppm1      4.238 ppm2      4.387 CV     1
 ASSI { 2032}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 95   and name HA  ))
      3.500     1.500     1.500 peak  2032 spectrum    1 weight  0.10000E+01 volume  0.20379E-02 ppm1      3.916 ppm2      3.460 CV     1
 OR { 2032}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 95   and name HA  ))
 ASSI { 2035}
   (( segid "    " and resid 105  and name HB1 ))
   (( segid "    " and resid 15   and name HA  ))
      2.200     2.200     3.800 peak  2035 spectrum    1 weight  0.10000E+01 volume  0.21056E-02 ppm1      3.843 ppm2      3.509 CV     1
 ASSI { 2037}
   (( segid "    " and resid 114  and name HB2 ))
   (( segid "    " and resid 114  and name HA  ))
      2.600     0.800     0.800 peak  2037 spectrum    1 weight  0.10000E+01 volume  0.36899E-02 ppm1      3.768 ppm2      4.485 CV     1
 OR { 2037}
   (( segid "    " and resid 114  and name HB1 ))
   (( segid "    " and resid 114  and name HA  ))
 ASSI { 2038}
   (( segid "    " and resid 6    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.300     1.400     1.400 peak  2038 spectrum    1 weight  0.10000E+01 volume  0.22296E-02 ppm1      4.314 ppm2      8.378 CV     1
 OR { 2038}
   (( segid "    " and resid 6    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
 ASSI { 2039}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 76   and name HD22))
      2.700     2.700     3.300 peak  2039 spectrum    1 weight  0.10000E+01 volume  0.38211E-02 ppm1      4.304 ppm2      7.154 CV     1
 ASSI { 2050}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 44   and name HN  ))
      2.800     2.800     3.200 peak  2050 spectrum    1 weight  0.10000E+01 volume  0.41015E-02 ppm1      4.016 ppm2      8.046 CV     1
 ASSI { 2054}
   (( segid "    " and resid 8    and name HB1 ))
   (( segid "    " and resid 9    and name HN  ))
      3.200     1.300     1.300 peak  2054 spectrum    1 weight  0.10000E+01 volume  0.19305E-02 ppm1      3.941 ppm2      8.323 CV     1
 OR { 2054}
   (( segid "    " and resid 8    and name HB2 ))
   (( segid "    " and resid 9    and name HN  ))
 ASSI { 2058}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 97   and name HD1%)
      3.600     1.600     1.600 peak  2058 spectrum    1 weight  0.10000E+01 volume  0.15173E-02 ppm1      3.882 ppm2      1.019 CV     1
 OR { 2058}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 97   and name HD2%)
 OR { 2058}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 97   and name HD1%)
 OR { 2058}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 97   and name HD2%)
 ASSI { 2060}
   (( segid "    " and resid 20   and name HB1 ))
   (( segid "    " and resid 23   and name HN  ))
      3.300     3.300     2.700 peak  2060 spectrum    1 weight  0.10000E+01 volume  0.30953E-02 ppm1      4.020 ppm2      7.784 CV     1
 ASSI { 2062}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 97   and name HG  ))
      3.200     1.300     1.300 peak  2062 spectrum    1 weight  0.10000E+01 volume  0.27651E-02 ppm1      3.868 ppm2      1.796 CV     1
 OR { 2062}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 97   and name HB2 ))
 OR { 2062}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 97   and name HG  ))
 OR { 2062}
   (( segid "    " and resid 96   and name HB1 ))
   (( segid "    " and resid 97   and name HB1 ))
 OR { 2062}
   (( segid "    " and resid 96   and name HB2 ))
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 2065}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 33   and name HN  ))
      2.900     1.100     1.100 peak  2065 spectrum    1 weight  0.10000E+01 volume  0.19552E-02 ppm1      4.304 ppm2      8.775 CV     1
 ASSI { 2069}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 150  and name HA  ))
      3.900     3.900     2.100 peak  2069 spectrum    1 weight  0.10000E+01 volume  0.13738E-02 ppm1      4.219 ppm2      4.534 CV     1
 ASSI { 2073}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 7    and name HA  ))
      2.700     0.900     0.900 peak  2073 spectrum    1 weight  0.10000E+01 volume  0.30159E-02 ppm1      4.068 ppm2      4.655 CV     1
 OR { 2073}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 7    and name HA  ))
 ASSI { 2077}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 40   and name HN  ))
      2.200     0.600     0.600 peak  2077 spectrum    1 weight  0.10000E+01 volume  0.12640E-01 ppm1      4.063 ppm2      8.870 CV     1
 ASSI { 2082}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 45   and name HB2 ))
      2.700     0.900     0.900 peak  2082 spectrum    1 weight  0.10000E+01 volume  0.21640E-02 ppm1      4.015 ppm2      3.041 CV     1
 ASSI { 2084}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      3.300     1.400     1.400 peak  2084 spectrum    1 weight  0.10000E+01 volume  0.12645E-02 ppm1      4.015 ppm2      7.350 CV     1
 ASSI { 2085}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.800     1.000     1.000 peak  2085 spectrum    1 weight  0.10000E+01 volume  0.21348E-02 ppm1      4.014 ppm2      6.987 CV     1
 ASSI { 2086}
   (( segid "    " and resid 11   and name HB2 ))
   (( segid "    " and resid 13   and name HN  ))
      3.500     3.500     2.500 peak  2086 spectrum    1 weight  0.10000E+01 volume  0.25572E-02 ppm1      4.012 ppm2      8.399 CV     1
 OR { 2086}
   (( segid "    " and resid 11   and name HB1 ))
   (( segid "    " and resid 13   and name HN  ))
 ASSI { 2087}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HN  ))
      2.400     0.700     0.700 peak  2087 spectrum    1 weight  0.10000E+01 volume  0.41597E-02 ppm1      4.013 ppm2      7.549 CV     1
 ASSI { 2088}
   (( segid "    " and resid 42   and name HA  ))
   (( segid "    " and resid 42   and name HB  ))
      2.500     0.800     0.800 peak  2088 spectrum    1 weight  0.10000E+01 volume  0.47572E-02 ppm1      4.012 ppm2      2.216 CV     1
 ASSI { 2090}
   (( segid "    " and resid 42   and name HA  ))
   (  segid "    " and resid 42   and name HD1%)
      2.000     0.500     0.500 peak  2090 spectrum    1 weight  0.10000E+01 volume  0.12503E-01 ppm1      4.012 ppm2      0.931 CV     1
 ASSI { 2094}
   (( segid "    " and resid 147  and name HA  ))
   (( segid "    " and resid 148  and name HB2 ))
      3.800     1.800     1.800 peak  2094 spectrum    1 weight  0.10000E+01 volume  0.17776E-02 ppm1      4.289 ppm2      2.935 CV     1
 ASSI { 2098}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.500     2.500     3.500 peak  2098 spectrum    1 weight  0.10000E+01 volume  0.26509E-02 ppm1      4.234 ppm2      2.175 CV     1
 ASSI { 2108}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB1 ))
      2.100     0.600     0.600 peak  2108 spectrum    1 weight  0.10000E+01 volume  0.13967E-01 ppm1      4.075 ppm2      3.852 CV     1
 OR { 2108}
   (( segid "    " and resid 36   and name HA  ))
   (( segid "    " and resid 36   and name HB2 ))
 ASSI { 2111}
   (( segid "    " and resid 149  and name HB1 ))
   (( segid "    " and resid 149  and name HN  ))
      3.100     1.200     1.200 peak  2111 spectrum    1 weight  0.10000E+01 volume  0.15960E-02 ppm1      3.907 ppm2      8.732 CV     1
 OR { 2111}
   (( segid "    " and resid 149  and name HB2 ))
   (( segid "    " and resid 149  and name HN  ))
 ASSI { 2114}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
      2.700     0.900     0.900 peak  2114 spectrum    1 weight  0.10000E+01 volume  0.27924E-02 ppm1      4.291 ppm2      4.727 CV     1
 OR { 2114}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 2115}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HB  ))
      2.600     0.800     0.800 peak  2115 spectrum    1 weight  0.10000E+01 volume  0.28565E-02 ppm1      4.291 ppm2      4.519 CV     1
 ASSI { 2119}
   (( segid "    " and resid 99   and name HA  ))
   (( segid "    " and resid 99   and name HN  ))
      2.900     1.100     1.100 peak  2119 spectrum    1 weight  0.10000E+01 volume  0.15663E-02 ppm1      4.291 ppm2      6.815 CV     1
 ASSI { 2124}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HB2 ))
      2.500     0.800     0.800 peak  2124 spectrum    1 weight  0.10000E+01 volume  0.29913E-02 ppm1      3.823 ppm2      1.699 CV     1
 ASSI { 2125}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HD1 ))
      3.400     1.500     1.500 peak  2125 spectrum    1 weight  0.10000E+01 volume  0.28996E-02 ppm1      3.820 ppm2      1.552 CV     1
 OR { 2125}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HD2 ))
 ASSI { 2126}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HG2 ))
      2.600     0.800     0.800 peak  2126 spectrum    1 weight  0.10000E+01 volume  0.36730E-02 ppm1      3.821 ppm2      1.165 CV     1
 OR { 2126}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HG1 ))
 ASSI { 2127}
   (( segid "    " and resid 10   and name HA  ))
   (( segid "    " and resid 10   and name HB1 ))
      2.600     0.800     0.800 peak  2127 spectrum    1 weight  0.10000E+01 volume  0.54062E-02 ppm1      3.824 ppm2      0.920 CV     1
 ASSI { 2128}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HB2 ))
      3.200     1.300     1.300 peak  2128 spectrum    1 weight  0.10000E+01 volume  0.12543E-02 ppm1      4.417 ppm2      3.946 CV     1
 OR { 2128}
   (( segid "    " and resid 8    and name HA  ))
   (( segid "    " and resid 8    and name HB1 ))
 ASSI { 2129}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      2.800     2.800     3.200 peak  2129 spectrum    1 weight  0.10000E+01 volume  0.30228E-02 ppm1      3.967 ppm2      8.780 CV     1
 ASSI { 2130}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      2.500     0.800     0.800 peak  2130 spectrum    1 weight  0.10000E+01 volume  0.48196E-02 ppm1      3.968 ppm2      8.146 CV     1
 ASSI { 2132}
   (( segid "    " and resid 136  and name HA  ))
   (( segid "    " and resid 135  and name HB  ))
      1.900     1.900     4.100 peak  2132 spectrum    1 weight  0.10000E+01 volume  0.39918E-02 ppm1      3.961 ppm2      1.703 CV     1
 ASSI { 2134}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 120  and name HN  ))
      2.000     0.500     0.500 peak  2134 spectrum    1 weight  0.10000E+01 volume  0.94370E-02 ppm1      3.875 ppm2      8.390 CV     1
 ASSI { 2135}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HN  ))
      2.700     0.900     0.900 peak  2135 spectrum    1 weight  0.10000E+01 volume  0.23040E-02 ppm1      3.877 ppm2      7.175 CV     1
 ASSI { 2136}
   (( segid "    " and resid 119  and name HA  ))
   (( segid "    " and resid 119  and name HB  ))
      2.700     0.900     0.900 peak  2136 spectrum    1 weight  0.10000E+01 volume  0.16705E-02 ppm1      3.879 ppm2      1.925 CV     1
 ASSI { 2139}
   (( segid "    " and resid 119  and name HA  ))
   (  segid "    " and resid 119  and name HG2%)
      2.700     0.900     0.900 peak  2139 spectrum    1 weight  0.10000E+01 volume  0.86293E-02 ppm1      3.879 ppm2      0.568 CV     1
 ASSI { 2143}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG2 ))
      3.000     1.100     1.100 peak  2143 spectrum    1 weight  0.10000E+01 volume  0.25972E-02 ppm1      4.053 ppm2      2.472 CV     1
 OR { 2143}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HG1 ))
 ASSI { 2144}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 15   and name HB  ))
      2.400     2.400     3.600 peak  2144 spectrum    1 weight  0.10000E+01 volume  0.45953E-02 ppm1      4.053 ppm2      1.971 CV     1
 ASSI { 2145}
   (( segid "    " and resid 17   and name HA  ))
   (( segid "    " and resid 17   and name HB2 ))
      2.800     1.000     1.000 peak  2145 spectrum    1 weight  0.10000E+01 volume  0.28816E-02 ppm1      3.974 ppm2      2.128 CV     1
 ASSI { 2151}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      2.900     1.000     1.000 peak  2151 spectrum    1 weight  0.10000E+01 volume  0.21390E-02 ppm1      4.253 ppm2      7.670 CV     1
 ASSI { 2153}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 29   and name HB1 ))
      2.700     0.900     0.900 peak  2153 spectrum    1 weight  0.10000E+01 volume  0.21443E-02 ppm1      4.250 ppm2      2.625 CV     1
 ASSI { 2154}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 32   and name HG1 ))
      3.300     1.400     1.400 peak  2154 spectrum    1 weight  0.10000E+01 volume  0.26003E-02 ppm1      4.249 ppm2      2.278 CV     1
 OR { 2154}
   (( segid "    " and resid 29   and name HA  ))
   (( segid "    " and resid 32   and name HG2 ))
 ASSI { 2155}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HN  ))
      2.800     0.900     0.900 peak  2155 spectrum    1 weight  0.10000E+01 volume  0.27920E-02 ppm1      4.056 ppm2      8.139 CV     1
 ASSI { 2156}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB1 ))
      2.300     0.700     0.700 peak  2156 spectrum    1 weight  0.10000E+01 volume  0.73761E-02 ppm1      4.056 ppm2      2.148 CV     1
 OR { 2156}
   (( segid "    " and resid 12   and name HA  ))
   (( segid "    " and resid 12   and name HB2 ))
 ASSI { 2161}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HG1 ))
      3.000     1.100     1.100 peak  2161 spectrum    1 weight  0.10000E+01 volume  0.31190E-02 ppm1      4.090 ppm2      2.636 CV     1
 ASSI { 2162}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 19   and name HB1 ))
      2.500     0.800     0.800 peak  2162 spectrum    1 weight  0.10000E+01 volume  0.74296E-02 ppm1      4.090 ppm2      2.194 CV     1
 ASSI { 2164}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 140  and name HN  ))
      3.300     1.300     1.300 peak  2164 spectrum    1 weight  0.10000E+01 volume  0.14349E-02 ppm1      3.985 ppm2      8.778 CV     1
 ASSI { 2167}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HG1 ))
      2.700     0.900     0.900 peak  2167 spectrum    1 weight  0.10000E+01 volume  0.46549E-02 ppm1      3.981 ppm2      2.291 CV     1
 OR { 2167}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HG2 ))
 ASSI { 2168}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
      2.800     1.000     1.000 peak  2168 spectrum    1 weight  0.10000E+01 volume  0.41806E-02 ppm1      3.981 ppm2      1.835 CV     1
 ASSI { 2169}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HN  ))
      2.700     0.900     0.900 peak  2169 spectrum    1 weight  0.10000E+01 volume  0.19531E-02 ppm1      4.273 ppm2      8.823 CV     1
 ASSI { 2172}
   (( segid "    " and resid 35   and name HA  ))
   (  segid "    " and resid 29   and name HE% )
      2.900     1.100     1.100 peak  2172 spectrum    1 weight  0.10000E+01 volume  0.21206E-02 ppm1      4.272 ppm2      6.687 CV     1
 ASSI { 2173}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB2 ))
      2.900     1.100     1.100 peak  2173 spectrum    1 weight  0.10000E+01 volume  0.26352E-02 ppm1      4.272 ppm2      2.684 CV     1
 ASSI { 2174}
   (( segid "    " and resid 35   and name HA  ))
   (( segid "    " and resid 35   and name HB1 ))
      2.600     0.900     0.900 peak  2174 spectrum    1 weight  0.10000E+01 volume  0.19694E-02 ppm1      4.272 ppm2      2.434 CV     1
 ASSI { 2176}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HN  ))
      2.700     0.900     0.900 peak  2176 spectrum    1 weight  0.10000E+01 volume  0.31279E-02 ppm1      4.140 ppm2      8.625 CV     1
 ASSI { 2177}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HE2 ))
      3.000     1.100     1.100 peak  2177 spectrum    1 weight  0.10000E+01 volume  0.17128E-02 ppm1      4.137 ppm2      3.170 CV     1
 OR { 2177}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 54   and name HE1 ))
 ASSI { 2179}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB2 ))
      2.600     0.800     0.800 peak  2179 spectrum    1 weight  0.10000E+01 volume  0.46160E-02 ppm1      4.136 ppm2      2.692 CV     1
 OR { 2179}
   (( segid "    " and resid 51   and name HA  ))
   (( segid "    " and resid 51   and name HB1 ))
 ASSI { 2181}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 150  and name HN  ))
      3.200     1.300     1.300 peak  2181 spectrum    1 weight  0.10000E+01 volume  0.14499E-02 ppm1      4.042 ppm2      7.026 CV     1
 ASSI { 2183}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 149  and name HB2 ))
      2.600     0.800     0.800 peak  2183 spectrum    1 weight  0.10000E+01 volume  0.49431E-02 ppm1      4.042 ppm2      3.863 CV     1
 OR { 2183}
   (( segid "    " and resid 149  and name HA  ))
   (( segid "    " and resid 149  and name HB1 ))
 ASSI { 2184}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 48   and name HN  ))
      3.000     1.100     1.100 peak  2184 spectrum    1 weight  0.10000E+01 volume  0.19209E-02 ppm1      3.814 ppm2      8.035 CV     1
 ASSI { 2185}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB2 ))
      2.600     0.900     0.900 peak  2185 spectrum    1 weight  0.10000E+01 volume  0.35341E-02 ppm1      3.812 ppm2      1.895 CV     1
 ASSI { 2186}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 44   and name HB1 ))
      2.400     0.700     0.700 peak  2186 spectrum    1 weight  0.10000E+01 volume  0.40643E-02 ppm1      3.814 ppm2      1.530 CV     1
 ASSI { 2194}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 156  and name HB2 ))
      3.000     1.100     1.100 peak  2194 spectrum    1 weight  0.10000E+01 volume  0.19299E-02 ppm1      4.187 ppm2      2.317 CV     1
 ASSI { 2197}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 28   and name HB1 ))
      2.400     0.700     0.700 peak  2197 spectrum    1 weight  0.10000E+01 volume  0.42476E-02 ppm1      4.188 ppm2      1.307 CV     1
 ASSI { 2198}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 28   and name HD1%)
      2.400     0.700     0.700 peak  2198 spectrum    1 weight  0.10000E+01 volume  0.81223E-02 ppm1      4.189 ppm2      0.807 CV     1
 OR { 2198}
   (( segid "    " and resid 28   and name HA  ))
   (  segid "    " and resid 28   and name HD2%)
 ASSI { 2199}
   (( segid "    " and resid 38   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      2.900     1.000     1.000 peak  2199 spectrum    1 weight  0.10000E+01 volume  0.20170E-02 ppm1      4.141 ppm2      8.599 CV     1
 ASSI { 2202}
   (( segid "    " and resid 38   and name HA  ))
   (  segid "    " and resid 38   and name HD1%)
      3.400     1.400     1.400 peak  2202 spectrum    1 weight  0.10000E+01 volume  0.58207E-02 ppm1      4.128 ppm2      0.767 CV     1
 ASSI { 2203}
   (( segid "    " and resid 44   and name HA  ))
   (( segid "    " and resid 47   and name HN  ))
      2.900     2.900     3.100 peak  2203 spectrum    1 weight  0.10000E+01 volume  0.51854E-02 ppm1      3.807 ppm2      8.890 CV     1
 ASSI { 2206}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HB2 ))
      3.100     1.200     1.200 peak  2206 spectrum    1 weight  0.10000E+01 volume  0.22258E-02 ppm1      3.808 ppm2      2.337 CV     1
 ASSI { 2207}
   (( segid "    " and resid 128  and name HA  ))
   (( segid "    " and resid 128  and name HB1 ))
      2.500     0.800     0.800 peak  2207 spectrum    1 weight  0.10000E+01 volume  0.35347E-02 ppm1      3.808 ppm2      2.189 CV     1
 ASSI { 2208}
   (( segid "    " and resid 59   and name HA  ))
   (( segid "    " and resid 59   and name HB1 ))
      2.100     0.600     0.600 peak  2208 spectrum    1 weight  0.10000E+01 volume  0.52118E-02 ppm1      3.743 ppm2      1.605 CV     1
 ASSI { 2213}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      3.300     3.300     2.700 peak  2213 spectrum    1 weight  0.10000E+01 volume  0.19560E-02 ppm1      4.316 ppm2      1.215 CV     1
 ASSI { 2216}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HN  ))
      2.300     0.600     0.600 peak  2216 spectrum    1 weight  0.10000E+01 volume  0.50597E-02 ppm1      3.950 ppm2      8.851 CV     1
 ASSI { 2220}
   (( segid "    " and resid 88   and name HA  ))
   (( segid "    " and resid 88   and name HB1 ))
      2.700     0.900     0.900 peak  2220 spectrum    1 weight  0.10000E+01 volume  0.33118E-02 ppm1      3.952 ppm2      1.732 CV     1
 ASSI { 2221}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HN  ))
      2.900     1.000     1.000 peak  2221 spectrum    1 weight  0.10000E+01 volume  0.19637E-02 ppm1      4.244 ppm2      7.007 CV     1
 ASSI { 2223}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HG  ))
      3.000     1.100     1.100 peak  2223 spectrum    1 weight  0.10000E+01 volume  0.14801E-02 ppm1      4.240 ppm2      1.604 CV     1
 ASSI { 2224}
   (( segid "    " and resid 43   and name HA  ))
   (( segid "    " and resid 43   and name HB1 ))
      2.500     0.800     0.800 peak  2224 spectrum    1 weight  0.10000E+01 volume  0.62478E-02 ppm1      4.244 ppm2      1.386 CV     1
 ASSI { 2227}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      2.700     0.900     0.900 peak  2227 spectrum    1 weight  0.10000E+01 volume  0.25468E-02 ppm1      4.111 ppm2      7.046 CV     1
 ASSI { 2228}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB1 ))
      2.700     0.900     0.900 peak  2228 spectrum    1 weight  0.10000E+01 volume  0.24074E-02 ppm1      4.110 ppm2      2.148 CV     1
 OR { 2228}
   (( segid "    " and resid 100  and name HA  ))
   (( segid "    " and resid 100  and name HB2 ))
 ASSI { 2229}
   (( segid "    " and resid 100  and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      2.800     1.000     1.000 peak  2229 spectrum    1 weight  0.10000E+01 volume  0.68805E-02 ppm1      4.111 ppm2      0.960 CV     1
 ASSI { 2230}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
      2.700     0.900     0.900 peak  2230 spectrum    1 weight  0.10000E+01 volume  0.23949E-02 ppm1      4.372 ppm2      8.035 CV     1
 ASSI { 2231}
   (( segid "    " and resid 97   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      3.100     1.200     1.200 peak  2231 spectrum    1 weight  0.10000E+01 volume  0.14280E-02 ppm1      4.371 ppm2      9.540 CV     1
 ASSI { 2235}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HN  ))
      2.800     1.000     1.000 peak  2235 spectrum    1 weight  0.10000E+01 volume  0.25826E-02 ppm1      4.354 ppm2      8.281 CV     1
 ASSI { 2236}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 118  and name HN  ))
      3.300     1.300     1.300 peak  2236 spectrum    1 weight  0.10000E+01 volume  0.13858E-02 ppm1      4.311 ppm2      8.061 CV     1
 ASSI { 2239}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HD21))
      2.500     0.800     0.800 peak  2239 spectrum    1 weight  0.10000E+01 volume  0.33445E-02 ppm1      4.297 ppm2      7.658 CV     1
 ASSI { 2241}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HB1 ))
      2.700     0.900     0.900 peak  2241 spectrum    1 weight  0.10000E+01 volume  0.35318E-02 ppm1      4.297 ppm2      2.874 CV     1
 ASSI { 2242}
   (( segid "    " and resid 117  and name HA  ))
   (( segid "    " and resid 117  and name HD22))
      3.800     1.800     1.800 peak  2242 spectrum    1 weight  0.10000E+01 volume  0.12730E-02 ppm1      4.291 ppm2      6.779 CV     1
 ASSI { 2248}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      3.000     1.100     1.100 peak  2248 spectrum    1 weight  0.10000E+01 volume  0.20861E-02 ppm1      4.355 ppm2      7.407 CV     1
 ASSI { 2249}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB2 ))
      2.400     0.700     0.700 peak  2249 spectrum    1 weight  0.10000E+01 volume  0.66517E-02 ppm1      4.354 ppm2      2.348 CV     1
 OR { 2249}
   (( segid "    " and resid 52   and name HA  ))
   (( segid "    " and resid 52   and name HB1 ))
 ASSI { 2250}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 112  and name HB2 ))
      3.300     1.300     1.300 peak  2250 spectrum    1 weight  0.10000E+01 volume  0.14361E-02 ppm1      4.274 ppm2      3.472 CV     1
 ASSI { 2253}
   (( segid "    " and resid 112  and name HA  ))
   (( segid "    " and resid 113  and name HB  ))
      3.400     3.400     2.600 peak  2253 spectrum    1 weight  0.10000E+01 volume  0.39632E-02 ppm1      4.276 ppm2      1.516 CV     1
 ASSI { 2254}
   (( segid "    " and resid 24   and name HA  ))
   (( segid "    " and resid 24   and name HN  ))
      2.700     0.900     0.900 peak  2254 spectrum    1 weight  0.10000E+01 volume  0.37165E-02 ppm1      4.197 ppm2      8.097 CV     1
 ASSI { 2257}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 98   and name HN  ))
      2.600     0.900     0.900 peak  2257 spectrum    1 weight  0.10000E+01 volume  0.36166E-02 ppm1      4.047 ppm2      9.561 CV     1
 ASSI { 2260}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 17   and name HN  ))
      3.200     1.300     1.300 peak  2260 spectrum    1 weight  0.10000E+01 volume  0.13349E-02 ppm1      4.025 ppm2      8.145 CV     1
 ASSI { 2262}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 97   and name HB2 ))
      3.100     1.200     1.200 peak  2262 spectrum    1 weight  0.10000E+01 volume  0.18487E-02 ppm1      4.026 ppm2      1.797 CV     1
 OR { 2262}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 97   and name HB1 ))
 ASSI { 2263}
   (( segid "    " and resid 14   and name HA  ))
   (( segid "    " and resid 14   and name HN  ))
      2.700     0.900     0.900 peak  2263 spectrum    1 weight  0.10000E+01 volume  0.31365E-02 ppm1      4.020 ppm2      8.586 CV     1
 ASSI { 2266}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 93   and name HN  ))
      3.200     1.300     1.300 peak  2266 spectrum    1 weight  0.10000E+01 volume  0.15831E-02 ppm1      4.008 ppm2      8.292 CV     1
 ASSI { 2267}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 92   and name HN  ))
      2.700     0.900     0.900 peak  2267 spectrum    1 weight  0.10000E+01 volume  0.31448E-02 ppm1      4.004 ppm2      7.999 CV     1
 ASSI { 2268}
   (( segid "    " and resid 92   and name HA  ))
   (( segid "    " and resid 95   and name HB  ))
      2.700     2.700     3.300 peak  2268 spectrum    1 weight  0.10000E+01 volume  0.33605E-02 ppm1      4.006 ppm2      2.099 CV     1
 ASSI { 2269}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      2.600     0.800     0.800 peak  2269 spectrum    1 weight  0.10000E+01 volume  0.21642E-02 ppm1      3.980 ppm2      9.366 CV     1
 ASSI { 2271}
   (( segid "    " and resid 107  and name HA  ))
   (( segid "    " and resid 107  and name HB2 ))
      2.500     0.800     0.800 peak  2271 spectrum    1 weight  0.10000E+01 volume  0.57654E-02 ppm1      3.977 ppm2      1.068 CV     1
 ASSI { 2274}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 144  and name HN  ))
      2.700     2.700     3.300 peak  2274 spectrum    1 weight  0.10000E+01 volume  0.39076E-02 ppm1      3.766 ppm2      8.302 CV     1
 ASSI { 2275}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 97   and name HN  ))
      3.100     1.200     1.200 peak  2275 spectrum    1 weight  0.10000E+01 volume  0.33181E-02 ppm1      3.766 ppm2      8.048 CV     1
 ASSI { 2277}
   (( segid "    " and resid 141  and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
      3.400     1.500     1.500 peak  2277 spectrum    1 weight  0.10000E+01 volume  0.13595E-02 ppm1      3.770 ppm2      7.190 CV     1
 ASSI { 2278}
   (( segid "    " and resid 141  and name HA  ))
   (  segid "    " and resid 141  and name HB% )
      2.200     0.600     0.600 peak  2278 spectrum    1 weight  0.10000E+01 volume  0.12525E-01 ppm1      3.766 ppm2      1.429 CV     1
 ASSI { 2280}
   (( segid "    " and resid 93   and name HA  ))
   (  segid "    " and resid 93   and name HB% )
      2.200     0.600     0.600 peak  2280 spectrum    1 weight  0.10000E+01 volume  0.93073E-02 ppm1      3.766 ppm2      0.542 CV     1
 ASSI { 2281}
   (( segid "    " and resid 93   and name HA  ))
   (( segid "    " and resid 90   and name HB1 ))
      4.000     2.000     2.000 peak  2281 spectrum    1 weight  0.10000E+01 volume  0.15752E-02 ppm1      3.766 ppm2      2.850 CV     1
 ASSI { 2283}
   (( segid "    " and resid 143  and name HA  ))
   (( segid "    " and resid 143  and name HN  ))
      2.700     0.900     0.900 peak  2283 spectrum    1 weight  0.10000E+01 volume  0.33639E-02 ppm1      4.067 ppm2      7.895 CV     1
 ASSI { 2285}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 4    and name HB1 ))
      3.400     3.400     2.600 peak  2285 spectrum    1 weight  0.10000E+01 volume  0.13185E-02 ppm1      4.059 ppm2      4.729 CV     1
 OR { 2285}
   (( segid "    " and resid 98   and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2291}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 90   and name HN  ))
      2.200     0.600     0.600 peak  2291 spectrum    1 weight  0.10000E+01 volume  0.58058E-02 ppm1      4.201 ppm2      8.341 CV     1
 ASSI { 2292}
   (( segid "    " and resid 89   and name HA  ))
   (( segid "    " and resid 89   and name HB2 ))
      2.700     0.900     0.900 peak  2292 spectrum    1 weight  0.10000E+01 volume  0.15194E-02 ppm1      4.192 ppm2      1.219 CV     1
 ASSI { 2293}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 61   and name HG2%)
      3.200     3.200     2.800 peak  2293 spectrum    1 weight  0.10000E+01 volume  0.22126E-02 ppm1      4.197 ppm2      0.884 CV     1
 ASSI { 2294}
   (( segid "    " and resid 89   and name HA  ))
   (  segid "    " and resid 89   and name HD2%)
      2.700     0.900     0.900 peak  2294 spectrum    1 weight  0.10000E+01 volume  0.43980E-02 ppm1      4.189 ppm2      0.280 CV     1
 ASSI { 2306}
   (( segid "    " and resid 129  and name HA  ))
   (( segid "    " and resid 130  and name HN  ))
      2.200     0.600     0.600 peak  2306 spectrum    1 weight  0.10000E+01 volume  0.73744E-02 ppm1      4.054 ppm2      8.097 CV     1
 ASSI { 2321}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 73   and name HB1 ))
      3.000     1.100     1.100 peak  2321 spectrum    1 weight  0.10000E+01 volume  0.27696E-02 ppm1      4.059 ppm2      2.191 CV     1
 OR { 2321}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HB1 ))
 OR { 2321}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 73   and name HB2 ))
 OR { 2321}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 73   and name HB2 ))
 ASSI { 2322}
   (( segid "    " and resid 73   and name HD2 ))
   (( segid "    " and resid 38   and name HB2 ))
      2.800     1.000     1.000 peak  2322 spectrum    1 weight  0.10000E+01 volume  0.12763E-02 ppm1      4.054 ppm2      1.459 CV     1
 OR { 2322}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 38   and name HB2 ))
 OR { 2322}
   (( segid "    " and resid 73   and name HD1 ))
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 2327}
   (( segid "    " and resid 81   and name HA1 ))
   (( segid "    " and resid 82   and name HN  ))
      2.700     0.900     0.900 peak  2327 spectrum    1 weight  0.10000E+01 volume  0.20375E-02 ppm1      4.000 ppm2      7.999 CV     1
 ASSI { 2329}
   (( segid "    " and resid 81   and name HA1 ))
   (  segid "    " and resid 35   and name HD% )
      3.600     1.600     1.600 peak  2329 spectrum    1 weight  0.10000E+01 volume  0.16564E-02 ppm1      3.995 ppm2      6.193 CV     1
 ASSI { 2330}
   (( segid "    " and resid 81   and name HA1 ))
   (( segid "    " and resid 81   and name HA2 ))
      1.800     0.400     0.400 peak  2330 spectrum    1 weight  0.10000E+01 volume  0.10137E-01 ppm1      3.994 ppm2      4.485 CV     1
 ASSI { 2333}
   (( segid "    " and resid 108  and name HA2 ))
   (( segid "    " and resid 108  and name HA1 ))
      1.900     0.400     0.400 peak  2333 spectrum    1 weight  0.10000E+01 volume  0.71598E-02 ppm1      4.232 ppm2      3.997 CV     1
 ASSI { 2334}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 130  and name HA  ))
      3.700     1.700     1.700 peak  2334 spectrum    1 weight  0.10000E+01 volume  0.16212E-02 ppm1      4.117 ppm2      4.896 CV     1
 ASSI { 2337}
   (( segid "    " and resid 110  and name HA1 ))
   (( segid "    " and resid 111  and name HN  ))
      3.100     1.200     1.200 peak  2337 spectrum    1 weight  0.10000E+01 volume  0.26749E-02 ppm1      4.114 ppm2      8.878 CV     1
 ASSI { 2339}
   (( segid "    " and resid 110  and name HA1 ))
   (  segid "    " and resid 111  and name HG1%)
      4.100     2.100     1.900 peak  2339 spectrum    1 weight  0.10000E+01 volume  0.12535E-02 ppm1      4.115 ppm2      0.824 CV     1
 ASSI { 2340}
   (( segid "    " and resid 110  and name HA1 ))
   (  segid "    " and resid 113  and name HD1%)
      2.600     2.600     3.400 peak  2340 spectrum    1 weight  0.10000E+01 volume  0.39746E-02 ppm1      4.114 ppm2      0.629 CV     1
 ASSI { 2341}
   (( segid "    " and resid 108  and name HA1 ))
   (  segid "    " and resid 109  and name HD% )
      4.200     2.200     1.800 peak  2341 spectrum    1 weight  0.10000E+01 volume  0.12380E-02 ppm1      4.030 ppm2      7.050 CV     1
 ASSI { 2345}
   (( segid "    " and resid 27   and name HA1 ))
   (  segid "    " and resid 30   and name HD1%)
      3.200     1.300     1.300 peak  2345 spectrum    1 weight  0.10000E+01 volume  0.13850E-02 ppm1      3.957 ppm2      0.950 CV     1
 OR { 2345}
   (( segid "    " and resid 27   and name HA2 ))
   (  segid "    " and resid 30   and name HD1%)
 ASSI { 2346}
   (( segid "    " and resid 115  and name HA2 ))
   (( segid "    " and resid 116  and name HN  ))
      2.800     1.000     1.000 peak  2346 spectrum    1 weight  0.10000E+01 volume  0.14552E-02 ppm1      3.907 ppm2     10.644 CV     1
 ASSI { 2348}
   (( segid "    " and resid 115  and name HA1 ))
   (( segid "    " and resid 115  and name HN  ))
      3.000     1.100     1.100 peak  2348 spectrum    1 weight  0.10000E+01 volume  0.22153E-02 ppm1      3.759 ppm2      8.773 CV     1
 ASSI { 2349}
   (( segid "    " and resid 115  and name HA1 ))
   (( segid "    " and resid 115  and name HA2 ))
      1.700     0.400     0.500 peak  2349 spectrum    1 weight  0.10000E+01 volume  0.11124E-01 ppm1      3.758 ppm2      3.899 CV     1
 ASSI { 2350}
   (( segid "    " and resid 115  and name HA1 ))
   (( segid "    " and resid 116  and name HN  ))
      3.700     1.700     1.700 peak  2350 spectrum    1 weight  0.10000E+01 volume  0.13629E-02 ppm1      3.772 ppm2     10.683 CV     1
 ASSI { 2351}
   (( segid "    " and resid 103  and name HA2 ))
   (( segid "    " and resid 103  and name HN  ))
      2.700     0.900     0.900 peak  2351 spectrum    1 weight  0.10000E+01 volume  0.35951E-02 ppm1      4.207 ppm2      8.634 CV     1
 ASSI { 2352}
   (( segid "    " and resid 103  and name HA2 ))
   (( segid "    " and resid 103  and name HA1 ))
      1.800     0.400     0.400 peak  2352 spectrum    1 weight  0.10000E+01 volume  0.10187E-01 ppm1      4.206 ppm2      3.899 CV     1
 ASSI { 2359}
   (( segid "    " and resid 31   and name HA1 ))
   (( segid "    " and resid 31   and name HN  ))
      2.700     0.900     0.900 peak  2359 spectrum    1 weight  0.10000E+01 volume  0.47371E-02 ppm1      3.810 ppm2      8.878 CV     1
 ASSI { 2364}
   (( segid "    " and resid 123  and name HA1 ))
   (( segid "    " and resid 123  and name HA2 ))
      1.800     0.400     0.400 peak  2364 spectrum    1 weight  0.10000E+01 volume  0.10894E-01 ppm1      3.781 ppm2      4.719 CV     1
 ASSI { 2365}
   (( segid "    " and resid 37   and name HA2 ))
   (( segid "    " and resid 37   and name HN  ))
      3.000     1.100     1.100 peak  2365 spectrum    1 weight  0.10000E+01 volume  0.23968E-02 ppm1      4.305 ppm2      8.976 CV     1
 ASSI { 2367}
   (( segid "    " and resid 72   and name HA2 ))
   (( segid "    " and resid 72   and name HN  ))
      2.900     1.100     1.100 peak  2367 spectrum    1 weight  0.10000E+01 volume  0.15356E-02 ppm1      4.061 ppm2      6.654 CV     1
 ASSI { 2369}
   (( segid "    " and resid 66   and name HA1 ))
   (( segid "    " and resid 66   and name HA2 ))
      1.800     0.400     0.400 peak  2369 spectrum    1 weight  0.10000E+01 volume  0.12238E-01 ppm1      3.915 ppm2      4.485 CV     1
 ASSI { 2375}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HA  ))
      2.800     1.000     1.000 peak  2375 spectrum    1 weight  0.10000E+01 volume  0.28538E-02 ppm1      3.744 ppm2      4.631 CV     1
 ASSI { 2376}
   (( segid "    " and resid 65   and name HB2 ))
   (( segid "    " and resid 65   and name HB1 ))
      1.800     0.400     0.400 peak  2376 spectrum    1 weight  0.10000E+01 volume  0.82603E-02 ppm1      3.744 ppm2      2.776 CV     1
 ASSI { 2377}
   (( segid "    " and resid 53   and name HB2 ))
   (  segid "    " and resid 53   and name HD% )
      2.800     1.000     1.000 peak  2377 spectrum    1 weight  0.10000E+01 volume  0.17168E-02 ppm1      3.834 ppm2      6.824 CV     1
 ASSI { 2397}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 85   and name HA  ))
      3.000     1.100     1.100 peak  2397 spectrum    1 weight  0.10000E+01 volume  0.11246E-02 ppm1      4.001 ppm2      5.671 CV     1
 ASSI { 2399}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 70   and name HN  ))
      3.600     1.600     1.600 peak  2399 spectrum    1 weight  0.10000E+01 volume  0.95118E-03 ppm1      3.999 ppm2      9.525 CV     1
 ASSI { 2401}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 62   and name HA  ))
      2.900     1.000     1.000 peak  2401 spectrum    1 weight  0.10000E+01 volume  0.10899E-02 ppm1      3.017 ppm2      5.093 CV     1
 ASSI { 2404}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 32   and name HB1 ))
      3.600     1.600     1.600 peak  2404 spectrum    1 weight  0.10000E+01 volume  0.10067E-02 ppm1      7.331 ppm2      2.479 CV     1
 ASSI { 2405}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 32   and name HG2 ))
      3.200     1.300     1.300 peak  2405 spectrum    1 weight  0.10000E+01 volume  0.10851E-02 ppm1      7.330 ppm2      2.266 CV     1
 OR { 2405}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 32   and name HG1 ))
 ASSI { 2407}
   (  segid "    " and resid 29   and name HD% )
   (  segid "    " and resid 38   and name HD1%)
      3.500     1.600     1.600 peak  2407 spectrum    1 weight  0.10000E+01 volume  0.10310E-02 ppm1      7.330 ppm2      0.790 CV     1
 ASSI { 2409}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 28   and name HB1 ))
      3.500     1.600     1.600 peak  2409 spectrum    1 weight  0.10000E+01 volume  0.97770E-03 ppm1      6.703 ppm2      1.318 CV     1
 ASSI { 2411}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 32   and name HB2 ))
      4.300     2.400     1.700 peak  2411 spectrum    1 weight  0.10000E+01 volume  0.72051E-03 ppm1      6.703 ppm2      2.163 CV     1
 ASSI { 2414}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 35   and name HA  ))
      4.100     2.100     1.900 peak  2414 spectrum    1 weight  0.10000E+01 volume  0.90260E-03 ppm1      6.843 ppm2      4.253 CV     1
 ASSI { 2419}
   (  segid "    " and resid 53   and name HD% )
   (( segid "    " and resid 50   and name HD2 ))
      3.300     1.300     1.300 peak  2419 spectrum    1 weight  0.10000E+01 volume  0.82463E-03 ppm1      6.838 ppm2      3.683 CV     1
 ASSI { 2420}
   (  segid "    " and resid 53   and name HD% )
   (( segid "    " and resid 50   and name HB2 ))
      3.000     1.100     1.100 peak  2420 spectrum    1 weight  0.10000E+01 volume  0.10395E-02 ppm1      6.837 ppm2      2.393 CV     1
 ASSI { 2422}
   (  segid "    " and resid 53   and name HD% )
   (( segid "    " and resid 50   and name HG1 ))
      4.700     2.700     1.300 peak  2422 spectrum    1 weight  0.10000E+01 volume  0.60407E-03 ppm1      6.835 ppm2      2.037 CV     1
 ASSI { 2425}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 85   and name HB  ))
      3.700     1.700     1.700 peak  2425 spectrum    1 weight  0.10000E+01 volume  0.89363E-03 ppm1      6.554 ppm2      3.980 CV     1
 ASSI { 2426}
   (  segid "    " and resid 53   and name HE% )
   (( segid "    " and resid 115  and name HA1 ))
      4.800     2.800     1.200 peak  2426 spectrum    1 weight  0.10000E+01 volume  0.74282E-03 ppm1      6.554 ppm2      3.773 CV     1
 ASSI { 2430}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HN  ))
      2.700     0.900     0.900 peak  2430 spectrum    1 weight  0.10000E+01 volume  0.24611E-02 ppm1      4.955 ppm2      7.408 CV     1
 ASSI { 2431}
   (( segid "    " and resid 53   and name HA  ))
   (  segid "    " and resid 53   and name HD% )
      2.200     0.600     0.600 peak  2431 spectrum    1 weight  0.10000E+01 volume  0.49216E-02 ppm1      4.951 ppm2      6.806 CV     1
 ASSI { 2432}
   (( segid "    " and resid 53   and name HA  ))
   (( segid "    " and resid 53   and name HB2 ))
      2.700     0.900     0.900 peak  2432 spectrum    1 weight  0.10000E+01 volume  0.44650E-02 ppm1      4.951 ppm2      3.812 CV     1
 ASSI { 2438}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 85   and name HN  ))
      3.400     1.400     1.400 peak  2438 spectrum    1 weight  0.10000E+01 volume  0.59559E-03 ppm1      6.767 ppm2      9.829 CV     1
 ASSI { 2440}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 84   and name HA  ))
      3.600     1.700     1.700 peak  2440 spectrum    1 weight  0.10000E+01 volume  0.66124E-03 ppm1      6.771 ppm2      5.274 CV     1
 ASSI { 2443}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 85   and name HB  ))
      3.300     1.300     1.300 peak  2443 spectrum    1 weight  0.10000E+01 volume  0.11109E-02 ppm1      6.419 ppm2      4.005 CV     1
 ASSI { 2444}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 117  and name HA  ))
      3.600     1.600     1.600 peak  2444 spectrum    1 weight  0.10000E+01 volume  0.86897E-03 ppm1      6.417 ppm2      4.294 CV     1
 ASSI { 2445}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 71   and name HA  ))
      4.100     2.100     1.900 peak  2445 spectrum    1 weight  0.10000E+01 volume  0.64231E-03 ppm1      6.419 ppm2      5.254 CV     1
 ASSI { 2447}
   (  segid "    " and resid 83   and name HE% )
   (( segid "    " and resid 70   and name HD21))
      3.400     1.400     1.400 peak  2447 spectrum    1 weight  0.10000E+01 volume  0.74294E-03 ppm1      6.422 ppm2      7.319 CV     1
 ASSI { 2449}
   (( segid "    " and resid 151  and name HA  ))
   (( segid "    " and resid 112  and name HD21))
      4.100     2.100     1.900 peak  2449 spectrum    1 weight  0.10000E+01 volume  0.90162E-03 ppm1      5.500 ppm2      7.572 CV     1
 ASSI { 2450}
   (( segid "    " and resid 83   and name HA  ))
   (( segid "    " and resid 156  and name HA  ))
      2.800     2.800     3.200 peak  2450 spectrum    1 weight  0.10000E+01 volume  0.23632E-02 ppm1      5.496 ppm2      4.178 CV     1
 ASSI { 2452}
   (( segid "    " and resid 83   and name HB2 ))
   (( segid "    " and resid 84   and name HN  ))
      3.400     1.400     1.400 peak  2452 spectrum    1 weight  0.10000E+01 volume  0.98145E-03 ppm1      2.326 ppm2      8.340 CV     1
 ASSI { 2454}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 83   and name HN  ))
      3.300     1.300     1.300 peak  2454 spectrum    1 weight  0.10000E+01 volume  0.58376E-03 ppm1      2.161 ppm2      9.017 CV     1
 ASSI { 2455}
   (( segid "    " and resid 83   and name HB1 ))
   (( segid "    " and resid 84   and name HN  ))
      4.300     2.300     1.700 peak  2455 spectrum    1 weight  0.10000E+01 volume  0.10579E-02 ppm1      2.159 ppm2      8.376 CV     1
 ASSI { 2456}
   (  segid "    " and resid 82   and name HD% )
   (  segid "    " and resid 35   and name HD% )
      2.600     2.600     3.400 peak  2456 spectrum    1 weight  0.10000E+01 volume  0.73111E-03 ppm1      6.459 ppm2      6.153 CV     1
 ASSI { 2458}
   (( segid "    " and resid 82   and name HB2 ))
   (  segid "    " and resid 82   and name HD% )
      3.100     1.200     1.200 peak  2458 spectrum    1 weight  0.10000E+01 volume  0.95742E-03 ppm1      2.636 ppm2      6.443 CV     1
 ASSI { 2460}
   (( segid "    " and resid 82   and name HB1 ))
   (  segid "    " and resid 82   and name HD% )
      3.200     1.300     1.300 peak  2460 spectrum    1 weight  0.10000E+01 volume  0.10925E-02 ppm1      1.844 ppm2      6.431 CV     1
 ASSI { 2465}
   (  segid "    " and resid 109  and name HD% )
   (( segid "    " and resid 97   and name HB1 ))
      3.900     1.900     1.900 peak  2465 spectrum    1 weight  0.10000E+01 volume  0.60716E-03 ppm1      7.062 ppm2      1.752 CV     1
 OR { 2465}
   (  segid "    " and resid 109  and name HD% )
   (( segid "    " and resid 97   and name HB2 ))
 ASSI { 2467}
   (  segid "    " and resid 109  and name HE% )
   (  segid "    " and resid 153  and name HG2%)
      3.400     1.400     1.400 peak  2467 spectrum    1 weight  0.10000E+01 volume  0.10798E-02 ppm1      6.862 ppm2      1.088 CV     1
 OR { 2467}
   (  segid "    " and resid 109  and name HE% )
   (  segid "    " and resid 153  and name HG1%)
 ASSI { 2474}
   (( segid "    " and resid 109  and name HB2 ))
   (( segid "    " and resid 109  and name HN  ))
      3.400     1.500     1.500 peak  2474 spectrum    1 weight  0.10000E+01 volume  0.79003E-03 ppm1      3.073 ppm2      8.759 CV     1
 ASSI { 2475}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 110  and name HN  ))
      4.100     2.100     1.900 peak  2475 spectrum    1 weight  0.10000E+01 volume  0.75216E-03 ppm1      2.804 ppm2      9.471 CV     1
 ASSI { 2476}
   (( segid "    " and resid 109  and name HB1 ))
   (( segid "    " and resid 109  and name HN  ))
      3.000     1.100     1.100 peak  2476 spectrum    1 weight  0.10000E+01 volume  0.10670E-02 ppm1      2.798 ppm2      8.748 CV     1
 ASSI { 2483}
   (( segid "    " and resid 155  and name HB1 ))
   (( segid "    " and resid 155  and name HA  ))
      2.900     1.000     1.000 peak  2483 spectrum    1 weight  0.10000E+01 volume  0.11299E-02 ppm1      2.612 ppm2      4.525 CV     1
 ASSI { 2486}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 65   and name HB1 ))
      4.900     3.000     1.100 peak  2486 spectrum    1 weight  0.10000E+01 volume  0.50293E-03 ppm1      7.163 ppm2      2.814 CV     1
 ASSI { 2487}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 65   and name HB2 ))
      4.800     2.900     1.200 peak  2487 spectrum    1 weight  0.10000E+01 volume  0.61564E-03 ppm1      7.158 ppm2      3.748 CV     1
 ASSI { 2488}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 64   and name HA  ))
      4.000     2.000     2.000 peak  2488 spectrum    1 weight  0.10000E+01 volume  0.51900E-03 ppm1      7.166 ppm2      4.322 CV     1
 ASSI { 2489}
   (  segid "    " and resid 65   and name HE% )
   (( segid "    " and resid 65   and name HN  ))
      4.200     2.200     1.800 peak  2489 spectrum    1 weight  0.10000E+01 volume  0.46856E-03 ppm1      7.166 ppm2      8.093 CV     1
 ASSI { 2490}
   (  segid "    " and resid 65   and name HD% )
   (( segid "    " and resid 65   and name HA  ))
      4.100     2.100     1.900 peak  2490 spectrum    1 weight  0.10000E+01 volume  0.85267E-03 ppm1      7.087 ppm2      4.629 CV     1
 ASSI { 2497}
   (  segid "    " and resid 80   and name HD% )
   (  segid "    " and resid 156  and name HD% )
      3.600     1.600     1.600 peak  2497 spectrum    1 weight  0.10000E+01 volume  0.79040E-03 ppm1      6.133 ppm2      6.777 CV     1
 ASSI { 2499}
   (  segid "    " and resid 80   and name HD% )
   (( segid "    " and resid 80   and name HB2 ))
      2.800     1.000     1.000 peak  2499 spectrum    1 weight  0.10000E+01 volume  0.11734E-02 ppm1      6.128 ppm2      3.535 CV     1
 ASSI { 2500}
   (  segid "    " and resid 80   and name HD% )
   (( segid "    " and resid 80   and name HB1 ))
      3.000     1.100     1.100 peak  2500 spectrum    1 weight  0.10000E+01 volume  0.95017E-03 ppm1      6.128 ppm2      2.768 CV     1
 ASSI { 2501}
   (  segid "    " and resid 80   and name HD% )
   (( segid "    " and resid 156  and name HB2 ))
      3.700     1.700     1.700 peak  2501 spectrum    1 weight  0.10000E+01 volume  0.10308E-02 ppm1      6.130 ppm2      2.337 CV     1
 ASSI { 2502}
   (  segid "    " and resid 80   and name HD% )
   (( segid "    " and resid 156  and name HB1 ))
      3.100     1.200     1.200 peak  2502 spectrum    1 weight  0.10000E+01 volume  0.97100E-03 ppm1      6.131 ppm2      1.862 CV     1
 ASSI { 2503}
   (  segid "    " and resid 80   and name HD% )
   (( segid "    " and resid 107  and name HB2 ))
      3.700     1.700     1.700 peak  2503 spectrum    1 weight  0.10000E+01 volume  0.65935E-03 ppm1      6.126 ppm2      1.069 CV     1
 ASSI { 2504}
   (  segid "    " and resid 80   and name HD% )
   (  segid "    " and resid 119  and name HG2%)
      4.000     2.000     2.000 peak  2504 spectrum    1 weight  0.10000E+01 volume  0.56669E-03 ppm1      6.128 ppm2      0.563 CV     1
 ASSI { 2508}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 80   and name HB2 ))
      4.500     2.500     1.500 peak  2508 spectrum    1 weight  0.10000E+01 volume  0.61304E-03 ppm1      6.370 ppm2      3.562 CV     1
 ASSI { 2510}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 156  and name HB1 ))
      3.600     1.700     1.700 peak  2510 spectrum    1 weight  0.10000E+01 volume  0.83709E-03 ppm1      6.374 ppm2      1.860 CV     1
 ASSI { 2511}
   (  segid "    " and resid 80   and name HE% )
   (( segid "    " and resid 107  and name HB1 ))
      3.100     1.200     1.200 peak  2511 spectrum    1 weight  0.10000E+01 volume  0.12084E-02 ppm1      6.374 ppm2      1.030 CV     1
 ASSI { 2514}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 80   and name HB2 ))
      2.600     0.900     0.900 peak  2514 spectrum    1 weight  0.10000E+01 volume  0.44238E-02 ppm1      4.551 ppm2      3.571 CV     1
 ASSI { 2519}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 81   and name HN  ))
      2.600     0.800     0.800 peak  2519 spectrum    1 weight  0.10000E+01 volume  0.32877E-02 ppm1      4.554 ppm2      8.785 CV     1
 ASSI { 2520}
   (( segid "    " and resid 80   and name HA  ))
   (( segid "    " and resid 82   and name HN  ))
      3.800     1.800     1.800 peak  2520 spectrum    1 weight  0.10000E+01 volume  0.20536E-02 ppm1      4.558 ppm2      8.020 CV     1
 ASSI { 2522}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 119  and name HG12))
      3.900     1.900     1.900 peak  2522 spectrum    1 weight  0.10000E+01 volume  0.66273E-03 ppm1      6.772 ppm2      1.606 CV     1
 ASSI { 2524}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 132  and name HA  ))
      3.400     1.500     1.500 peak  2524 spectrum    1 weight  0.10000E+01 volume  0.13528E-02 ppm1      6.774 ppm2      4.649 CV     1
 ASSI { 2526}
   (( segid "    " and resid 122  and name HZ  ))
   (  segid "    " and resid 122  and name HD% )
      3.100     1.200     1.200 peak  2526 spectrum    1 weight  0.10000E+01 volume  0.46621E-02 ppm1      6.664 ppm2      6.774 CV     1
 ASSI { 2527}
   (( segid "    " and resid 122  and name HZ  ))
   (( segid "    " and resid 119  and name HG12))
      3.100     3.100     2.900 peak  2527 spectrum    1 weight  0.10000E+01 volume  0.10826E-02 ppm1      6.661 ppm2      1.554 CV     1
 ASSI { 2529}
   (  segid "    " and resid 156  and name HD% )
   (  segid "    " and resid 119  and name HD1%)
      2.600     2.600     3.400 peak  2529 spectrum    1 weight  0.10000E+01 volume  0.63569E-03 ppm1      6.804 ppm2     -0.197 CV     1
 ASSI { 2530}
   (  segid "    " and resid 156  and name HD% )
   (  segid "    " and resid 62   and name HG2%)
      2.500     2.500     3.500 peak  2530 spectrum    1 weight  0.10000E+01 volume  0.84918E-03 ppm1      6.803 ppm2      0.008 CV     1
 ASSI { 2538}
   (  segid "    " and resid 156  and name HE% )
   (( segid "    " and resid 119  and name HB  ))
      3.600     1.700     1.700 peak  2538 spectrum    1 weight  0.10000E+01 volume  0.58551E-03 ppm1      7.656 ppm2      1.922 CV     1
 ASSI { 2540}
   (  segid "    " and resid 156  and name HE% )
   (( segid "    " and resid 74   and name HA  ))
      3.900     1.900     1.900 peak  2540 spectrum    1 weight  0.10000E+01 volume  0.78579E-03 ppm1      7.647 ppm2      3.847 CV     1
 ASSI { 2541}
   (  segid "    " and resid 156  and name HE% )
   (( segid "    " and resid 117  and name HA  ))
      3.400     1.500     1.500 peak  2541 spectrum    1 weight  0.10000E+01 volume  0.92938E-03 ppm1      7.657 ppm2      4.280 CV     1
 ASSI { 2542}
   (  segid "    " and resid 156  and name HE% )
   (( segid "    " and resid 156  and name HZ  ))
      3.100     1.200     1.200 peak  2542 spectrum    1 weight  0.10000E+01 volume  0.86324E-03 ppm1      7.650 ppm2      7.146 CV     1
 ASSI { 2544}
   (( segid "    " and resid 156  and name HZ  ))
   (  segid "    " and resid 119  and name HG2%)
      2.500     2.500     3.500 peak  2544 spectrum    1 weight  0.10000E+01 volume  0.93161E-03 ppm1      7.152 ppm2      0.546 CV     1
 ASSI { 2550}
   (( segid "    " and resid 156  and name HB1 ))
   (  segid "    " and resid 156  and name HD% )
      3.500     1.500     1.500 peak  2550 spectrum    1 weight  0.10000E+01 volume  0.53395E-03 ppm1      1.869 ppm2      6.789 CV     1
 ASSI { 2554}
   (( segid "    " and resid 156  and name HB2 ))
   (  segid "    " and resid 80   and name HE% )
      3.700     1.700     1.700 peak  2554 spectrum    1 weight  0.10000E+01 volume  0.50505E-03 ppm1      2.365 ppm2      6.360 CV     1
 ASSI { 2555}
   (( segid "    " and resid 156  and name HB2 ))
   (  segid "    " and resid 156  and name HD% )
      3.300     1.300     1.300 peak  2555 spectrum    1 weight  0.10000E+01 volume  0.58863E-03 ppm1      2.367 ppm2      6.796 CV     1
 ASSI { 2557}
   (( segid "    " and resid 156  and name HB2 ))
   (( segid "    " and resid 107  and name HB2 ))
      4.000     2.000     2.000 peak  2557 spectrum    1 weight  0.10000E+01 volume  0.73747E-03 ppm1      2.360 ppm2      1.073 CV     1
 ASSI { 2558}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 107  and name HB2 ))
      2.800     0.900     0.900 peak  2558 spectrum    1 weight  0.10000E+01 volume  0.87060E-03 ppm1      1.866 ppm2      1.039 CV     1
 OR { 2558}
   (( segid "    " and resid 156  and name HB1 ))
   (( segid "    " and resid 107  and name HB1 ))
 ASSI { 2559}
   (( segid "    " and resid 29   and name HB2 ))
   (( segid "    " and resid 32   and name HE22))
      4.300     2.300     1.700 peak  2559 spectrum    1 weight  0.10000E+01 volume  0.14256E-02 ppm1      2.915 ppm2      6.961 CV     1
 ASSI { 2561}
   (( segid "    " and resid 12   and name HB2 ))
   (( segid "    " and resid 9    and name HA  ))
      3.300     1.400     1.400 peak  2561 spectrum    1 weight  0.10000E+01 volume  0.11968E-02 ppm1      2.150 ppm2      4.680 CV     1
 OR { 2561}
   (( segid "    " and resid 12   and name HB1 ))
   (( segid "    " and resid 9    and name HA  ))
 ASSI { 2563}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 17   and name HN  ))
      4.000     2.000     2.000 peak  2563 spectrum    1 weight  0.10000E+01 volume  0.85081E-03 ppm1      1.667 ppm2      8.164 CV     1
 ASSI { 2565}
   (  segid "    " and resid 14   and name HB% )
   (( segid "    " and resid 15   and name HA  ))
      3.900     1.900     1.900 peak  2565 spectrum    1 weight  0.10000E+01 volume  0.61713E-03 ppm1      1.662 ppm2      3.484 CV     1
 ASSI { 2569}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 30   and name HG11))
      4.300     2.300     1.700 peak  2569 spectrum    1 weight  0.10000E+01 volume  0.68639E-03 ppm1      7.333 ppm2      1.737 CV     1
 OR { 2569}
   (  segid "    " and resid 29   and name HD% )
   (( segid "    " and resid 30   and name HG12))
 ASSI { 2571}
   (  segid "    " and resid 35   and name HD% )
   (  segid "    " and resid 29   and name HD% )
      3.300     1.400     1.400 peak  2571 spectrum    1 weight  0.10000E+01 volume  0.97484E-03 ppm1      6.181 ppm2      7.332 CV     1
 ASSI { 2572}
   (  segid "    " and resid 35   and name HD% )
   (  segid "    " and resid 38   and name HD1%)
      3.700     3.700     2.300 peak  2572 spectrum    1 weight  0.10000E+01 volume  0.66124E-03 ppm1      6.176 ppm2      0.775 CV     1
 ASSI { 2573}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 38   and name HB2 ))
      4.400     2.500     1.600 peak  2573 spectrum    1 weight  0.10000E+01 volume  0.66124E-03 ppm1      6.178 ppm2      1.458 CV     1
 OR { 2573}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 38   and name HB1 ))
 ASSI { 2574}
   (  segid "    " and resid 35   and name HD% )
   (( segid "    " and resid 82   and name HB1 ))
      3.500     1.600     1.600 peak  2574 spectrum    1 weight  0.10000E+01 volume  0.56334E-03 ppm1      6.176 ppm2      1.849 CV     1
 ASSI { 2575}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 85   and name HN  ))
      2.900     1.000     1.000 peak  2575 spectrum    1 weight  0.10000E+01 volume  0.11791E-02 ppm1      5.683 ppm2      9.804 CV     1
 ASSI { 2576}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 70   and name HD21))
      4.000     2.000     2.000 peak  2576 spectrum    1 weight  0.10000E+01 volume  0.85788E-03 ppm1      5.677 ppm2      7.316 CV     1
 ASSI { 2577}
   (( segid "    " and resid 85   and name HA  ))
   (  segid "    " and resid 83   and name HD% )
      3.400     1.500     1.500 peak  2577 spectrum    1 weight  0.10000E+01 volume  0.68215E-03 ppm1      5.694 ppm2      6.770 CV     1
 ASSI { 2582}
   (( segid "    " and resid 85   and name HA  ))
   (( segid "    " and resid 60   and name HD1 ))
      3.400     1.500     1.500 peak  2582 spectrum    1 weight  0.10000E+01 volume  0.12946E-02 ppm1      5.684 ppm2      0.545 CV     1
 ASSI { 2583}
   (( segid "    " and resid 154  and name HB  ))
   (( segid "    " and resid 62   and name HN  ))
      2.900     1.100     1.100 peak  2583 spectrum    1 weight  0.10000E+01 volume  0.54418E-02 ppm1      4.561 ppm2      8.849 CV     1
 ASSI { 2584}
   (( segid "    " and resid 154  and name HB  ))
   (( segid "    " and resid 154  and name HA  ))
      2.300     0.600     0.600 peak  2584 spectrum    1 weight  0.10000E+01 volume  0.34461E-02 ppm1      4.564 ppm2      5.233 CV     1
 ASSI { 2585}
   (( segid "    " and resid 154  and name HB  ))
   (  segid "    " and resid 154  and name HG2%)
      2.300     0.600     0.600 peak  2585 spectrum    1 weight  0.10000E+01 volume  0.63544E-02 ppm1      4.564 ppm2      1.202 CV     1
 ASSI { 2586}
   (( segid "    " and resid 22   and name HB  ))
   (( segid "    " and resid 22   and name HN  ))
      3.200     1.300     1.300 peak  2586 spectrum    1 weight  0.10000E+01 volume  0.11934E-02 ppm1      4.138 ppm2      8.349 CV     1
 ASSI { 2587}
   (( segid "    " and resid 99   and name HB  ))
   (  segid "    " and resid 99   and name HG2%)
      1.900     1.900     4.100 peak  2587 spectrum    1 weight  0.10000E+01 volume  0.17666E-01 ppm1      4.519 ppm2      1.022 CV     1
 ASSI { 2591}
   (( segid "    " and resid 56   and name HB  ))
   (  segid "    " and resid 56   and name HG2%)
      2.100     0.600     0.600 peak  2591 spectrum    1 weight  0.10000E+01 volume  0.12701E-01 ppm1      4.415 ppm2      1.315 CV     1
 ASSI { 2593}
   (( segid "    " and resid 56   and name HB  ))
   (( segid "    " and resid 56   and name HN  ))
      3.300     1.400     1.400 peak  2593 spectrum    1 weight  0.10000E+01 volume  0.17762E-02 ppm1      4.407 ppm2      8.457 CV     1
 ASSI { 2594}
   (( segid "    " and resid 57   and name HA  ))
   (( segid "    " and resid 58   and name HN  ))
      3.400     1.500     1.500 peak  2594 spectrum    1 weight  0.10000E+01 volume  0.96014E-03 ppm1      4.077 ppm2      8.072 CV     1
 ASSI { 2595}
   (( segid "    " and resid 62   and name HB  ))
   (( segid "    " and resid 154  and name HN  ))
      4.400     2.400     1.600 peak  2595 spectrum    1 weight  0.10000E+01 volume  0.64878E-03 ppm1      3.025 ppm2      9.459 CV     1
 ASSI { 2598}
   (( segid "    " and resid 50   and name HA  ))
   (( segid "    " and resid 50   and name HG2 ))
      3.500     1.500     1.500 peak  2598 spectrum    1 weight  0.10000E+01 volume  0.27271E-02 ppm1      4.397 ppm2      2.060 CV     1
 ASSI { 2601}
   (( segid "    " and resid 85   and name HB  ))
   (( segid "    " and resid 70   and name HD22))
      4.100     2.100     1.900 peak  2601 spectrum    1 weight  0.10000E+01 volume  0.99042E-03 ppm1      4.003 ppm2      7.126 CV     1
 ASSI { 2603}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 103  and name HN  ))
      3.900     1.900     1.900 peak  2603 spectrum    1 weight  0.10000E+01 volume  0.10662E-02 ppm1      4.239 ppm2      8.661 CV     1
 ASSI { 2604}
   (( segid "    " and resid 104  and name HA  ))
   (( segid "    " and resid 106  and name HN  ))
      3.800     1.800     1.800 peak  2604 spectrum    1 weight  0.10000E+01 volume  0.85803E-03 ppm1      4.240 ppm2      7.267 CV     1
 ASSI { 2608}
   (( segid "    " and resid 120  and name HA  ))
   (( segid "    " and resid 120  and name HN  ))
      2.700     0.900     0.900 peak  2608 spectrum    1 weight  0.10000E+01 volume  0.22677E-02 ppm1      4.488 ppm2      8.382 CV     1
 ASSI { 2609}
   (( segid "    " and resid 142  and name HA  ))
   (  segid "    " and resid 143  and name HB% )
      2.900     2.900     3.100 peak  2609 spectrum    1 weight  0.10000E+01 volume  0.78321E-02 ppm1      3.990 ppm2      1.300 CV     1
 ASSI { 2610}
   (( segid "    " and resid 142  and name HA  ))
   (( segid "    " and resid 143  and name HN  ))
      3.500     1.500     1.500 peak  2610 spectrum    1 weight  0.10000E+01 volume  0.94247E-03 ppm1      3.991 ppm2      7.892 CV     1
 ASSI { 2612}
   (( segid "    " and resid 150  and name HA  ))
   (  segid "    " and resid 150  and name HG2%)
      2.600     0.800     0.800 peak  2612 spectrum    1 weight  0.10000E+01 volume  0.41557E-02 ppm1      4.550 ppm2      1.024 CV     1
 ASSI { 2613}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 54   and name HB2 ))
      3.100     3.100     2.900 peak  2613 spectrum    1 weight  0.10000E+01 volume  0.25366E-02 ppm1      4.558 ppm2      2.147 CV     1
 ASSI { 2614}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 149  and name HB1 ))
      2.700     2.700     3.300 peak  2614 spectrum    1 weight  0.10000E+01 volume  0.42496E-02 ppm1      4.554 ppm2      3.944 CV     1
 OR { 2614}
   (( segid "    " and resid 150  and name HA  ))
   (( segid "    " and resid 149  and name HB2 ))
 ASSI { 2616}
   (( segid "    " and resid 67   and name HA2 ))
   (( segid "    " and resid 88   and name HB1 ))
      3.900     1.900     1.900 peak  2616 spectrum    1 weight  0.10000E+01 volume  0.34052E-02 ppm1      4.407 ppm2      1.752 CV     1
 ASSI { 2617}
   (( segid "    " and resid 67   and name HA2 ))
   (( segid "    " and resid 67   and name HA1 ))
      1.800     0.400     0.400 peak  2617 spectrum    1 weight  0.10000E+01 volume  0.74537E-02 ppm1      4.412 ppm2      3.881 CV     1
 ASSI { 2619}
   (( segid "    " and resid 37   and name HA2 ))
   (( segid "    " and resid 37   and name HA1 ))
      2.300     0.700     0.700 peak  2619 spectrum    1 weight  0.10000E+01 volume  0.27121E-02 ppm1      4.303 ppm2      3.688 CV     1
 ASSI { 2620}
   (( segid "    " and resid 125  and name HB1 ))
   (( segid "    " and resid 125  and name HB2 ))
      1.800     0.400     0.400 peak  2620 spectrum    1 weight  0.10000E+01 volume  0.10046E-01 ppm1      3.538 ppm2      3.736 CV     1
 ASSI { 2621}
   (( segid "    " and resid 121  and name HB2 ))
   (( segid "    " and resid 121  and name HA  ))
      2.700     0.900     0.900 peak  2621 spectrum    1 weight  0.10000E+01 volume  0.36372E-02 ppm1      3.635 ppm2      4.550 CV     1
 OR { 2621}
   (( segid "    " and resid 121  and name HB1 ))
   (( segid "    " and resid 121  and name HA  ))
 ASSI { 2624}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 135  and name HG2%)
      3.500     1.500     1.500 peak  2624 spectrum    1 weight  0.10000E+01 volume  0.14965E-02 ppm1      3.640 ppm2      0.616 CV     1
 ASSI { 2625}
   (( segid "    " and resid 135  and name HA  ))
   (  segid "    " and resid 135  and name HD1%)
      2.400     2.400     3.600 peak  2625 spectrum    1 weight  0.10000E+01 volume  0.53942E-02 ppm1      3.642 ppm2      0.817 CV     1
 ASSI { 2628}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 137  and name HD1 ))
      3.900     1.900     1.900 peak  2628 spectrum    1 weight  0.10000E+01 volume  0.92551E-03 ppm1      3.642 ppm2      2.305 CV     1
 OR { 2628}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 137  and name HD2 ))
 ASSI { 2631}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
      3.300     3.300     2.700 peak  2631 spectrum    1 weight  0.10000E+01 volume  0.12687E-02 ppm1      3.642 ppm2      3.083 CV     1
 ASSI { 2632}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 139  and name HB1 ))
      2.800     2.800     3.200 peak  2632 spectrum    1 weight  0.10000E+01 volume  0.38772E-02 ppm1      3.640 ppm2      1.830 CV     1
 ASSI { 2635}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 4    and name HB2 ))
      3.000     1.200     1.200 peak  2635 spectrum    1 weight  0.10000E+01 volume  0.22759E-02 ppm1      3.646 ppm2      4.726 CV     1
 OR { 2635}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 4    and name HB1 ))
 ASSI { 2636}
   (( segid "    " and resid 135  and name HA  ))
   (( segid "    " and resid 100  and name HN  ))
      3.200     1.300     1.300 peak  2636 spectrum    1 weight  0.10000E+01 volume  0.79773E-03 ppm1      3.646 ppm2      7.067 CV     1
 ASSI { 2639}
   (( segid "    " and resid 96   and name HB1 ))
   (  segid "    " and resid 93   and name HB% )
      4.100     2.100     1.900 peak  2639 spectrum    1 weight  0.10000E+01 volume  0.85130E-03 ppm1      3.882 ppm2      0.531 CV     1
 OR { 2639}
   (( segid "    " and resid 96   and name HB2 ))
   (  segid "    " and resid 93   and name HB% )
 ASSI { 2641}
   (( segid "    " and resid 16   and name HA  ))
   (( segid "    " and resid 19   and name HG2 ))
      3.800     1.800     1.800 peak  2641 spectrum    1 weight  0.10000E+01 volume  0.92614E-03 ppm1      4.234 ppm2      2.746 CV     1
 ASSI { 2645}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HB1 ))
      2.800     1.000     1.000 peak  2645 spectrum    1 weight  0.10000E+01 volume  0.36163E-02 ppm1      4.388 ppm2      3.858 CV     1
 ASSI { 2646}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 106  and name HN  ))
      3.300     1.400     1.400 peak  2646 spectrum    1 weight  0.10000E+01 volume  0.12219E-02 ppm1      4.384 ppm2      7.253 CV     1
 ASSI { 2647}
   (( segid "    " and resid 105  and name HA  ))
   (( segid "    " and resid 105  and name HN  ))
      2.800     1.000     1.000 peak  2647 spectrum    1 weight  0.10000E+01 volume  0.26723E-02 ppm1      4.387 ppm2      7.943 CV     1
 ASSI { 2655}
   (( segid "    " and resid 111  and name HA  ))
   (( segid "    " and resid 153  and name HA  ))
      2.100     0.600     0.600 peak  2655 spectrum    1 weight  0.10000E+01 volume  0.38116E-02 ppm1      4.780 ppm2      5.206 CV     1
 ASSI { 2656}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 8    and name HB1 ))
      2.800     2.800     3.200 peak  2656 spectrum    1 weight  0.10000E+01 volume  0.96642E-02 ppm1      4.423 ppm2      3.940 CV     1
 ASSI { 2657}
   (( segid "    " and resid 6    and name HA  ))
   (( segid "    " and resid 8    and name HN  ))
      2.700     0.900     0.900 peak  2657 spectrum    1 weight  0.10000E+01 volume  0.36945E-02 ppm1      4.425 ppm2      8.336 CV     1
 ASSI { 2659}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB1 ))
      2.900     1.000     1.000 peak  2659 spectrum    1 weight  0.10000E+01 volume  0.21396E-02 ppm1      3.632 ppm2      0.922 CV     1
 ASSI { 2660}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HB2 ))
      2.600     0.800     0.800 peak  2660 spectrum    1 weight  0.10000E+01 volume  0.40966E-02 ppm1      3.632 ppm2      1.166 CV     1
 ASSI { 2664}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 119  and name HN  ))
      3.300     1.300     1.300 peak  2664 spectrum    1 weight  0.10000E+01 volume  0.97509E-03 ppm1      3.639 ppm2      7.149 CV     1
 ASSI { 2665}
   (( segid "    " and resid 116  and name HA  ))
   (( segid "    " and resid 116  and name HN  ))
      2.900     1.100     1.100 peak  2665 spectrum    1 weight  0.10000E+01 volume  0.15685E-02 ppm1      3.636 ppm2     10.642 CV     1
 ASSI { 2666}
   (( segid "    " and resid 28   and name HB2 ))
   (  segid "    " and resid 29   and name HE% )
      3.700     1.700     1.700 peak  2666 spectrum    1 weight  0.10000E+01 volume  0.77820E-03 ppm1      1.915 ppm2      6.703 CV     1
 ASSI { 2670}
   (( segid "    " and resid 28   and name HB1 ))
   (( segid "    " and resid 29   and name HN  ))
      3.800     1.800     1.800 peak  2670 spectrum    1 weight  0.10000E+01 volume  0.83586E-03 ppm1      1.333 ppm2      7.685 CV     1
 ASSI { 2671}
   (  segid "    " and resid 28   and name HD2%)
   (  segid "    " and resid 29   and name HE% )
      2.400     2.400     3.600 peak  2671 spectrum    1 weight  0.10000E+01 volume  0.11081E-02 ppm1      0.803 ppm2      6.684 CV     1
 ASSI { 2672}
   (  segid "    " and resid 69   and name HD2%)
   (( segid "    " and resid 69   and name HN  ))
      3.200     1.300     1.300 peak  2672 spectrum    1 weight  0.10000E+01 volume  0.11749E-02 ppm1      0.634 ppm2      8.250 CV     1
 ASSI { 2676}
   (  segid "    " and resid 28   and name HD2%)
   (( segid "    " and resid 28   and name HN  ))
      3.800     1.800     1.800 peak  2676 spectrum    1 weight  0.10000E+01 volume  0.11965E-02 ppm1      0.797 ppm2      7.926 CV     1
 ASSI { 2677}
   (( segid "    " and resid 43   and name HG  ))
   (( segid "    " and resid 45   and name HN  ))
      3.800     1.800     1.800 peak  2677 spectrum    1 weight  0.10000E+01 volume  0.83399E-03 ppm1      1.643 ppm2      7.359 CV     1
 ASSI { 2684}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HA  ))
      3.700     1.700     1.700 peak  2684 spectrum    1 weight  0.10000E+01 volume  0.10452E-02 ppm1      1.069 ppm2      5.608 CV     1
 ASSI { 2685}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 69   and name HA  ))
      3.500     1.600     1.600 peak  2685 spectrum    1 weight  0.10000E+01 volume  0.48697E-03 ppm1      1.069 ppm2      5.266 CV     1
 ASSI { 2688}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 86   and name HN  ))
      4.200     2.200     1.800 peak  2688 spectrum    1 weight  0.10000E+01 volume  0.73832E-03 ppm1      1.069 ppm2      9.171 CV     1
 ASSI { 2689}
   (  segid "    " and resid 86   and name HD1%)
   (( segid "    " and resid 64   and name HD2 ))
      3.400     1.500     1.500 peak  2689 spectrum    1 weight  0.10000E+01 volume  0.93774E-03 ppm1      1.067 ppm2      3.010 CV     1
 ASSI { 2691}
   (( segid "    " and resid 116  and name HB2 ))
   (  segid "    " and resid 62   and name HG2%)
      3.700     1.700     1.700 peak  2691 spectrum    1 weight  0.10000E+01 volume  0.78043E-03 ppm1      1.200 ppm2      0.012 CV     1
 ASSI { 2692}
   (( segid "    " and resid 113  and name HG12))
   (( segid "    " and resid 113  and name HA  ))
      3.000     1.100     1.100 peak  2692 spectrum    1 weight  0.10000E+01 volume  0.14094E-02 ppm1      1.295 ppm2      3.727 CV     1
 OR { 2692}
   (( segid "    " and resid 113  and name HG11))
   (( segid "    " and resid 113  and name HA  ))
 ASSI { 2695}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 85   and name HB  ))
      4.200     2.200     1.800 peak  2695 spectrum    1 weight  0.10000E+01 volume  0.53220E-03 ppm1      0.914 ppm2      3.976 CV     1
 OR { 2695}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 85   and name HB  ))
 ASSI { 2697}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 84   and name HN  ))
      3.900     1.900     1.900 peak  2697 spectrum    1 weight  0.10000E+01 volume  0.11630E-02 ppm1      0.917 ppm2      8.363 CV     1
 OR { 2697}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 84   and name HN  ))
 ASSI { 2698}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 85   and name HN  ))
      4.900     3.000     1.100 peak  2698 spectrum    1 weight  0.10000E+01 volume  0.54950E-03 ppm1      0.915 ppm2      9.811 CV     1
 OR { 2698}
   (  segid "    " and resid 84   and name HD1%)
   (( segid "    " and resid 85   and name HN  ))
 ASSI { 2701}
   (( segid "    " and resid 107  and name HD2 ))
   (  segid "    " and resid 156  and name HD% )
      3.400     1.400     1.400 peak  2701 spectrum    1 weight  0.10000E+01 volume  0.91918E-03 ppm1      1.527 ppm2      6.828 CV     1
 OR { 2701}
   (( segid "    " and resid 107  and name HD1 ))
   (  segid "    " and resid 156  and name HD% )
 ASSI { 2702}
   (( segid "    " and resid 69   and name HG  ))
   (( segid "    " and resid 69   and name HN  ))
      3.200     1.200     1.200 peak  2702 spectrum    1 weight  0.10000E+01 volume  0.10080E-02 ppm1      1.501 ppm2      8.277 CV     1
 ASSI { 2706}
   (  segid "    " and resid 38   and name HD2%)
   (  segid "    " and resid 29   and name HE% )
      3.300     1.400     1.400 peak  2706 spectrum    1 weight  0.10000E+01 volume  0.11861E-02 ppm1      0.182 ppm2      6.680 CV     1
 ASSI { 2707}
   (  segid "    " and resid 38   and name HD2%)
   (( segid "    " and resid 35   and name HB1 ))
      2.600     2.600     3.400 peak  2707 spectrum    1 weight  0.10000E+01 volume  0.74093E-03 ppm1      0.173 ppm2      2.435 CV     1
 ASSI { 2711}
   (  segid "    " and resid 38   and name HD2%)
   (( segid "    " and resid 73   and name HG1 ))
      2.700     2.700     3.300 peak  2711 spectrum    1 weight  0.10000E+01 volume  0.49932E-03 ppm1      0.182 ppm2      3.763 CV     1
 ASSI { 2719}
   (  segid "    " and resid 89   and name HD1%)
   (( segid "    " and resid 89   and name HA  ))
      3.500     1.600     1.600 peak  2719 spectrum    1 weight  0.10000E+01 volume  0.89065E-03 ppm1      0.568 ppm2      4.171 CV     1
 ASSI { 2722}
   (  segid "    " and resid 102  and name HD1%)
   (  segid "    " and resid 109  and name HE% )
      3.600     1.600     1.600 peak  2722 spectrum    1 weight  0.10000E+01 volume  0.11197E-02 ppm1      0.553 ppm2      6.860 CV     1
 ASSI { 2726}
   (  segid "    " and resid 84   and name HD2%)
   (( segid "    " and resid 72   and name HN  ))
      3.800     1.800     1.800 peak  2726 spectrum    1 weight  0.10000E+01 volume  0.68402E-03 ppm1      0.933 ppm2      6.651 CV     1
 ASSI { 2729}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 69   and name HN  ))
      4.300     2.300     1.700 peak  2729 spectrum    1 weight  0.10000E+01 volume  0.98183E-03 ppm1      0.704 ppm2      8.242 CV     1
 ASSI { 2732}
   (  segid "    " and resid 69   and name HD1%)
   (( segid "    " and resid 70   and name HN  ))
      4.100     2.100     1.900 peak  2732 spectrum    1 weight  0.10000E+01 volume  0.71779E-03 ppm1      0.703 ppm2      9.512 CV     1
 ASSI { 2734}
   (  segid "    " and resid 38   and name HD1%)
   (( segid "    " and resid 73   and name HG2 ))
      3.000     3.000     3.000 peak  2734 spectrum    1 weight  0.10000E+01 volume  0.60524E-02 ppm1      0.788 ppm2      3.741 CV     1
 OR { 2734}
   (  segid "    " and resid 38   and name HD1%)
   (( segid "    " and resid 73   and name HG1 ))
 ASSI { 2736}
   (  segid "    " and resid 38   and name HD1%)
   (( segid "    " and resid 35   and name HA  ))
      3.400     3.400     2.600 peak  2736 spectrum    1 weight  0.10000E+01 volume  0.16723E-02 ppm1      0.788 ppm2      4.274 CV     1
 ASSI { 2741}
   (  segid "    " and resid 38   and name HD1%)
   (( segid "    " and resid 41   and name HN  ))
      4.500     2.600     1.500 peak  2741 spectrum    1 weight  0.10000E+01 volume  0.60393E-03 ppm1      0.784 ppm2      8.584 CV     1
 ASSI { 2746}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 4    and name HB1 ))
      4.300     2.300     1.700 peak  2746 spectrum    1 weight  0.10000E+01 volume  0.56993E-03 ppm1      2.404 ppm2      4.709 CV     1
 OR { 2746}
   (( segid "    " and resid 137  and name HB2 ))
   (( segid "    " and resid 4    and name HB2 ))
 ASSI { 2750}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HG1 ))
      2.800     1.000     1.000 peak  2750 spectrum    1 weight  0.10000E+01 volume  0.10864E-02 ppm1      2.164 ppm2      3.734 CV     1
 OR { 2750}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HG2 ))
 OR { 2750}
   (( segid "    " and resid 73   and name HB2 ))
   (( segid "    " and resid 73   and name HG2 ))
 OR { 2750}
   (( segid "    " and resid 73   and name HB1 ))
   (( segid "    " and resid 73   and name HG1 ))
 ASSI { 2757}
   (( segid "    " and resid 139  and name HB1 ))
   (( segid "    " and resid 140  and name HN  ))
      2.900     1.000     1.000 peak  2757 spectrum    1 weight  0.10000E+01 volume  0.12000E-02 ppm1      1.869 ppm2      8.767 CV     1
 ASSI { 2759}
   (( segid "    " and resid 157  and name HB2 ))
   (( segid "    " and resid 156  and name HA  ))
      4.400     2.500     1.600 peak  2759 spectrum    1 weight  0.10000E+01 volume  0.59634E-03 ppm1      1.746 ppm2      4.171 CV     1
 ASSI { 2760}
   (( segid "    " and resid 157  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
      3.200     1.300     1.300 peak  2760 spectrum    1 weight  0.10000E+01 volume  0.87086E-03 ppm1      1.756 ppm2      4.930 CV     1
 ASSI { 2763}
   (( segid "    " and resid 157  and name HB1 ))
   (( segid "    " and resid 157  and name HN  ))
      3.400     1.400     1.400 peak  2763 spectrum    1 weight  0.10000E+01 volume  0.79026E-03 ppm1      1.629 ppm2      9.151 CV     1
 ASSI { 2764}
   (( segid "    " and resid 157  and name HB1 ))
   (( segid "    " and resid 158  and name HN  ))
      4.000     2.000     2.000 peak  2764 spectrum    1 weight  0.10000E+01 volume  0.10133E-02 ppm1      1.641 ppm2      8.145 CV     1
 ASSI { 2773}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 43   and name HA  ))
      4.300     2.300     1.700 peak  2773 spectrum    1 weight  0.10000E+01 volume  0.11093E-02 ppm1      2.346 ppm2      4.251 CV     1
 ASSI { 2774}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HD1 ))
      3.900     1.900     1.900 peak  2774 spectrum    1 weight  0.10000E+01 volume  0.75053E-03 ppm1      2.350 ppm2      3.678 CV     1
 OR { 2774}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI { 2776}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HG1 ))
      2.500     0.800     0.800 peak  2776 spectrum    1 weight  0.10000E+01 volume  0.34166E-02 ppm1      1.824 ppm2      2.076 CV     1
 OR { 2776}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HG2 ))
 ASSI { 2777}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 43   and name HA  ))
      3.700     1.800     1.800 peak  2777 spectrum    1 weight  0.10000E+01 volume  0.85963E-03 ppm1      1.824 ppm2      4.251 CV     1
 ASSI { 2778}
   (( segid "    " and resid 50   and name HB1 ))
   (( segid "    " and resid 50   and name HA  ))
      2.400     0.700     0.700 peak  2778 spectrum    1 weight  0.10000E+01 volume  0.26376E-02 ppm1      1.823 ppm2      4.370 CV     1
 ASSI { 2779}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 53   and name HE% )
      4.400     2.400     1.600 peak  2779 spectrum    1 weight  0.10000E+01 volume  0.55959E-03 ppm1      1.819 ppm2      6.530 CV     1
 ASSI { 2780}
   (( segid "    " and resid 50   and name HB1 ))
   (  segid "    " and resid 53   and name HD% )
      4.000     2.000     2.000 peak  2780 spectrum    1 weight  0.10000E+01 volume  0.98469E-03 ppm1      1.822 ppm2      6.827 CV     1
 ASSI { 2788}
   (( segid "    " and resid 68   and name HB1 ))
   (( segid "    " and resid 67   and name HN  ))
      4.400     2.500     1.600 peak  2788 spectrum    1 weight  0.10000E+01 volume  0.93362E-03 ppm1      1.972 ppm2      7.267 CV     1
 ASSI { 2792}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB1 ))
      2.700     0.900     0.900 peak  2792 spectrum    1 weight  0.10000E+01 volume  0.17119E-02 ppm1      4.951 ppm2      2.005 CV     1
 ASSI { 2793}
   (( segid "    " and resid 68   and name HA  ))
   (( segid "    " and resid 68   and name HB2 ))
      2.900     1.000     1.000 peak  2793 spectrum    1 weight  0.10000E+01 volume  0.40027E-02 ppm1      4.943 ppm2      2.094 CV     1
 ASSI { 2795}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 74   and name HN  ))
      2.400     0.700     0.700 peak  2795 spectrum    1 weight  0.10000E+01 volume  0.36303E-02 ppm1      4.877 ppm2      6.995 CV     1
 ASSI { 2798}
   (( segid "    " and resid 73   and name HA  ))
   (( segid "    " and resid 83   and name HB1 ))
      3.000     3.000     3.000 peak  2798 spectrum    1 weight  0.10000E+01 volume  0.33783E-02 ppm1      4.869 ppm2      2.112 CV     1
 ASSI { 2799}
   (( segid "    " and resid 31   and name HA1 ))
   (( segid "    " and resid 32   and name HN  ))
      3.900     1.900     1.900 peak  2799 spectrum    1 weight  0.10000E+01 volume  0.70745E-03 ppm1      3.809 ppm2      8.048 CV     1
 ASSI { 2801}
   (( segid "    " and resid 54   and name HD2 ))
   (( segid "    " and resid 54   and name HN  ))
      3.900     1.900     1.900 peak  2801 spectrum    1 weight  0.10000E+01 volume  0.93064E-03 ppm1      1.658 ppm2      7.432 CV     1
 OR { 2801}
   (( segid "    " and resid 54   and name HD1 ))
   (( segid "    " and resid 54   and name HN  ))
 ASSI { 2807}
   (  segid "    " and resid 89   and name HD2%)
   (( segid "    " and resid 93   and name HA  ))
      3.700     1.800     1.800 peak  2807 spectrum    1 weight  0.10000E+01 volume  0.20456E-02 ppm1      0.290 ppm2      3.760 CV     1
 ASSI { 2808}
   (( segid "    " and resid 135  and name HB  ))
   (( segid "    " and resid 135  and name HA  ))
      3.000     1.100     1.100 peak  2808 spectrum    1 weight  0.10000E+01 volume  0.10947E-02 ppm1      1.676 ppm2      3.651 CV     1
 ASSI { 2809}
   (( segid "    " and resid 25   and name HB  ))
   (( segid "    " and resid 25   and name HA  ))
      3.000     1.100     1.100 peak  2809 spectrum    1 weight  0.10000E+01 volume  0.11275E-02 ppm1      1.764 ppm2      3.495 CV     1
 ASSI { 2810}
   (( segid "    " and resid 15   and name HB  ))
   (( segid "    " and resid 15   and name HA  ))
      3.400     1.400     1.400 peak  2810 spectrum    1 weight  0.10000E+01 volume  0.89664E-03 ppm1      1.980 ppm2      3.477 CV     1
 ASSI { 2812}
   (( segid "    " and resid 49   and name HB  ))
   (( segid "    " and resid 49   and name HA  ))
      3.200     1.300     1.300 peak  2812 spectrum    1 weight  0.10000E+01 volume  0.12013E-02 ppm1      1.998 ppm2      4.670 CV     1
 ASSI { 2813}
   (( segid "    " and resid 108  and name HA2 ))
   (  segid "    " and resid 109  and name HD% )
      4.000     2.000     2.000 peak  2813 spectrum    1 weight  0.10000E+01 volume  0.99838E-03 ppm1      4.223 ppm2      7.024 CV     1
 ASSI { 2819}
   (( segid "    " and resid 28   and name HA  ))
   (( segid "    " and resid 29   and name HN  ))
      3.500     1.600     1.600 peak  2819 spectrum    1 weight  0.10000E+01 volume  0.76075E-03 ppm1      4.184 ppm2      7.678 CV     1
 ASSI { 2820}
   (( segid "    " and resid 156  and name HA  ))
   (( segid "    " and resid 84   and name HN  ))
      2.500     2.500     3.500 peak  2820 spectrum    1 weight  0.10000E+01 volume  0.79885E-03 ppm1      4.190 ppm2      8.380 CV     1
 ASSI { 2821}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 82   and name HE% )
      5.000     3.100     1.000 peak  2821 spectrum    1 weight  0.10000E+01 volume  0.50591E-03 ppm1      1.534 ppm2      6.483 CV     1
 OR { 2821}
   (( segid "    " and resid 84   and name HB1 ))
   (  segid "    " and resid 82   and name HD% )
 ASSI { 2826}
   (( segid "    " and resid 84   and name HB1 ))
   (( segid "    " and resid 70   and name HB1 ))
      3.900     3.900     2.100 peak  2826 spectrum    1 weight  0.10000E+01 volume  0.69834E-03 ppm1      1.534 ppm2      2.597 CV     1
 ASSI { 2831}
   (( segid "    " and resid 32   and name HG2 ))
   (  segid "    " and resid 29   and name HE% )
      4.400     2.400     1.600 peak  2831 spectrum    1 weight  0.10000E+01 volume  0.66073E-03 ppm1      2.239 ppm2      6.675 CV     1
 OR { 2831}
   (( segid "    " and resid 32   and name HG1 ))
   (  segid "    " and resid 29   and name HE% )
 ASSI { 2833}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 70   and name HD21))
      3.600     1.600     1.600 peak  2833 spectrum    1 weight  0.10000E+01 volume  0.97149E-03 ppm1      2.325 ppm2      7.321 CV     1
 ASSI { 2835}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 115  and name HN  ))
      4.400     2.500     1.600 peak  2835 spectrum    1 weight  0.10000E+01 volume  0.58688E-03 ppm1      2.326 ppm2      8.780 CV     1
 ASSI { 2837}
   (( segid "    " and resid 50   and name HB2 ))
   (( segid "    " and resid 49   and name HA  ))
      4.500     2.500     1.500 peak  2837 spectrum    1 weight  0.10000E+01 volume  0.10641E-02 ppm1      2.332 ppm2      4.680 CV     1
 ASSI { 2839}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 12   and name HE22))
      4.400     2.400     1.600 peak  2839 spectrum    1 weight  0.10000E+01 volume  0.61378E-03 ppm1      2.481 ppm2      6.853 CV     1
 OR { 2839}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 12   and name HE22))
 ASSI { 2841}
   (( segid "    " and resid 12   and name HG1 ))
   (( segid "    " and resid 13   and name HN  ))
      3.900     1.900     1.900 peak  2841 spectrum    1 weight  0.10000E+01 volume  0.79412E-03 ppm1      2.476 ppm2      8.351 CV     1
 OR { 2841}
   (( segid "    " and resid 12   and name HG2 ))
   (( segid "    " and resid 13   and name HN  ))
 ASSI { 2842}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 128  and name HN  ))
      3.600     1.600     1.600 peak  2842 spectrum    1 weight  0.10000E+01 volume  0.91941E-03 ppm1      2.621 ppm2      8.858 CV     1
 ASSI { 2843}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HN  ))
      3.300     1.300     1.300 peak  2843 spectrum    1 weight  0.10000E+01 volume  0.94009E-03 ppm1      2.487 ppm2      8.858 CV     1
 ASSI { 2844}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 128  and name HA  ))
      3.600     1.600     1.600 peak  2844 spectrum    1 weight  0.10000E+01 volume  0.11172E-02 ppm1      2.491 ppm2      3.802 CV     1
 ASSI { 2845}
   (( segid "    " and resid 128  and name HG1 ))
   (( segid "    " and resid 112  and name HB2 ))
      3.800     1.800     1.800 peak  2845 spectrum    1 weight  0.10000E+01 volume  0.93350E-03 ppm1      2.490 ppm2      3.498 CV     1
 ASSI { 2847}
   (( segid "    " and resid 128  and name HG2 ))
   (( segid "    " and resid 112  and name HB1 ))
      3.500     1.500     1.500 peak  2847 spectrum    1 weight  0.10000E+01 volume  0.77954E-03 ppm1      2.619 ppm2      3.021 CV     1
 ASSI { 2849}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 112  and name HD21))
      3.500     1.500     1.500 peak  2849 spectrum    1 weight  0.10000E+01 volume  0.67668E-03 ppm1      3.497 ppm2      7.587 CV     1
 ASSI { 2850}
   (( segid "    " and resid 112  and name HB2 ))
   (( segid "    " and resid 128  and name HG2 ))
      3.600     1.600     1.600 peak  2850 spectrum    1 weight  0.10000E+01 volume  0.83846E-03 ppm1      3.497 ppm2      2.599 CV     1
 ASSI { 2853}
   (( segid "    " and resid 112  and name HB1 ))
   (  segid "    " and resid 111  and name HG2%)
      4.400     2.500     1.600 peak  2853 spectrum    1 weight  0.10000E+01 volume  0.59920E-03 ppm1      3.026 ppm2      0.958 CV     1
 ASSI { 2855}
   (( segid "    " and resid 79   and name HA  ))
   (( segid "    " and resid 79   and name HN  ))
      2.700     0.900     0.900 peak  2855 spectrum    1 weight  0.10000E+01 volume  0.34811E-02 ppm1      4.416 ppm2      8.166 CV     1
 ASSI { 2856}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 134  and name HN  ))
      3.200     3.200     2.800 peak  2856 spectrum    1 weight  0.10000E+01 volume  0.34083E-02 ppm1      4.414 ppm2      7.821 CV     1
 ASSI { 2858}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB1 ))
      2.100     0.500     0.500 peak  2858 spectrum    1 weight  0.10000E+01 volume  0.13678E-01 ppm1      4.414 ppm2      1.658 CV     1
 OR { 2858}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HB2 ))
 ASSI { 2859}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 100  and name HD1%)
      2.000     2.000     4.000 peak  2859 spectrum    1 weight  0.10000E+01 volume  0.29661E-02 ppm1      4.416 ppm2      0.943 CV     1
 ASSI { 2862}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 102  and name HN  ))
      2.800     1.000     1.000 peak  2862 spectrum    1 weight  0.10000E+01 volume  0.16729E-02 ppm1      4.420 ppm2      8.794 CV     1
 ASSI { 2863}
   (( segid "    " and resid 102  and name HA  ))
   (( segid "    " and resid 101  and name HB2 ))
      3.500     3.500     2.500 peak  2863 spectrum    1 weight  0.10000E+01 volume  0.21435E-02 ppm1      4.404 ppm2      3.117 CV     1
 ASSI { 2864}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 131  and name HG1 ))
      3.400     1.400     1.400 peak  2864 spectrum    1 weight  0.10000E+01 volume  0.26128E-02 ppm1      5.039 ppm2      1.462 CV     1
 OR { 2864}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 131  and name HG2 ))
 ASSI { 2865}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 131  and name HB1 ))
      3.600     1.600     1.600 peak  2865 spectrum    1 weight  0.10000E+01 volume  0.18620E-02 ppm1      5.040 ppm2      1.628 CV     1
 ASSI { 2866}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HB2 ))
      2.500     0.800     0.800 peak  2866 spectrum    1 weight  0.10000E+01 volume  0.46512E-02 ppm1      5.036 ppm2      2.918 CV     1
 ASSI { 2867}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 125  and name HN  ))
      3.000     1.100     1.100 peak  2867 spectrum    1 weight  0.10000E+01 volume  0.15303E-02 ppm1      5.041 ppm2      8.097 CV     1
 ASSI { 2868}
   (( segid "    " and resid 124  and name HA  ))
   (( segid "    " and resid 124  and name HN  ))
      2.800     1.000     1.000 peak  2868 spectrum    1 weight  0.10000E+01 volume  0.20327E-02 ppm1      5.035 ppm2      8.624 CV     1
 ASSI { 2870}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HN  ))
      2.700     0.900     0.900 peak  2870 spectrum    1 weight  0.10000E+01 volume  0.31760E-02 ppm1      4.946 ppm2      7.368 CV     1
 ASSI { 2871}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 46   and name HN  ))
      2.900     1.000     1.000 peak  2871 spectrum    1 weight  0.10000E+01 volume  0.39279E-02 ppm1      4.944 ppm2      7.206 CV     1
 ASSI { 2873}
   (( segid "    " and resid 45   and name HA  ))
   (( segid "    " and resid 45   and name HB1 ))
      2.800     1.000     1.000 peak  2873 spectrum    1 weight  0.10000E+01 volume  0.45020E-02 ppm1      4.944 ppm2      2.735 CV     1
 ASSI { 2874}
   (( segid "    " and resid 157  and name HA  ))
   (( segid "    " and resid 157  and name HB2 ))
      2.300     0.700     0.700 peak  2874 spectrum    1 weight  0.10000E+01 volume  0.28527E-02 ppm1      4.928 ppm2      1.769 CV     1
 ASSI { 2875}
   (( segid "    " and resid 157  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      1.600     0.300     0.600 peak  2875 spectrum    1 weight  0.10000E+01 volume  0.32866E-02 ppm1      4.937 ppm2      9.379 CV     1
 ASSI { 2878}
   (( segid "    " and resid 61   and name HB  ))
   (( segid "    " and resid 86   and name HN  ))
      3.800     3.800     2.200 peak  2878 spectrum    1 weight  0.10000E+01 volume  0.62435E-03 ppm1      1.532 ppm2      9.166 CV     1
 ASSI { 2879}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 158  and name HN  ))
      3.600     1.600     1.600 peak  2879 spectrum    1 weight  0.10000E+01 volume  0.15834E-02 ppm1      1.126 ppm2      8.131 CV     1
 ASSI { 2880}
   (( segid "    " and resid 19   and name HB2 ))
   (( segid "    " and resid 20   and name HN  ))
      4.200     2.200     1.800 peak  2880 spectrum    1 weight  0.10000E+01 volume  0.71515E-03 ppm1      2.241 ppm2      8.780 CV     1
 ASSI { 2881}
   (( segid "    " and resid 19   and name HB1 ))
   (( segid "    " and resid 20   and name HN  ))
      3.000     1.100     1.100 peak  2881 spectrum    1 weight  0.10000E+01 volume  0.10396E-02 ppm1      2.180 ppm2      8.780 CV     1
 ASSI { 2883}
   (( segid "    " and resid 100  and name HG  ))
   (( segid "    " and resid 10   and name HN  ))
      2.700     2.700     3.300 peak  2883 spectrum    1 weight  0.10000E+01 volume  0.58786E-03 ppm1      1.513 ppm2      8.186 CV     1
 ASSI { 2887}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 85   and name HB  ))
      3.900     1.900     1.900 peak  2887 spectrum    1 weight  0.10000E+01 volume  0.72475E-03 ppm1      6.774 ppm2      3.997 CV     1
 ASSI { 2893}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 108  and name HN  ))
      3.900     1.900     1.900 peak  2893 spectrum    1 weight  0.10000E+01 volume  0.72813E-03 ppm1      1.028 ppm2      7.475 CV     1
 ASSI { 2894}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 106  and name HA  ))
      4.400     2.400     1.600 peak  2894 spectrum    1 weight  0.10000E+01 volume  0.83024E-03 ppm1      1.039 ppm2      4.876 CV     1
 OR { 2894}
   (( segid "    " and resid 107  and name HB1 ))
   (( segid "    " and resid 106  and name HA  ))
 ASSI { 2896}
   (( segid "    " and resid 107  and name HB2 ))
   (( segid "    " and resid 80   and name HB2 ))
      5.100     3.200     0.900 peak  2896 spectrum    1 weight  0.10000E+01 volume  0.61378E-03 ppm1      1.088 ppm2      3.509 CV     1
 ASSI { 2899}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HA  ))
      3.000     1.100     1.100 peak  2899 spectrum    1 weight  0.10000E+01 volume  0.10440E-02 ppm1      2.159 ppm2      4.424 CV     1
 ASSI { 2901}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HE2 ))
      4.600     2.700     1.400 peak  2901 spectrum    1 weight  0.10000E+01 volume  0.59422E-03 ppm1      2.174 ppm2      3.167 CV     1
 OR { 2901}
   (( segid "    " and resid 54   and name HB2 ))
   (( segid "    " and resid 54   and name HE1 ))
 ASSI { 2902}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HA  ))
      2.800     1.000     1.000 peak  2902 spectrum    1 weight  0.10000E+01 volume  0.11358E-02 ppm1      1.521 ppm2      4.387 CV     1
 ASSI { 2904}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HE1 ))
      4.500     2.600     1.500 peak  2904 spectrum    1 weight  0.10000E+01 volume  0.57081E-03 ppm1      1.515 ppm2      3.167 CV     1
 OR { 2904}
   (( segid "    " and resid 54   and name HB1 ))
   (( segid "    " and resid 54   and name HE2 ))
 ASSI { 2905}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 98   and name HN  ))
      4.000     2.000     2.000 peak  2905 spectrum    1 weight  0.10000E+01 volume  0.79375E-03 ppm1      1.030 ppm2      9.586 CV     1
 ASSI { 2906}
   (  segid "    " and resid 99   and name HG2%)
   (( segid "    " and resid 136  and name HN  ))
      4.000     2.000     2.000 peak  2906 spectrum    1 weight  0.10000E+01 volume  0.76187E-03 ppm1      1.031 ppm2      8.626 CV     1
 ASSI { 2909}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 55   and name HA  ))
      2.400     0.700     0.700 peak  2909 spectrum    1 weight  0.10000E+01 volume  0.35473E-02 ppm1      3.027 ppm2      4.977 CV     1
 ASSI { 2910}
   (( segid "    " and resid 55   and name HB2 ))
   (( segid "    " and resid 60   and name HA  ))
      3.300     1.300     1.300 peak  2910 spectrum    1 weight  0.10000E+01 volume  0.16595E-02 ppm1      3.022 ppm2      5.364 CV     1
 ASSI { 2912}
   (( segid "    " and resid 118  and name HB2 ))
   (( segid "    " and resid 118  and name HD22))
      4.100     2.100     1.900 peak  2912 spectrum    1 weight  0.10000E+01 volume  0.10826E-02 ppm1      3.022 ppm2      6.828 CV     1
 ASSI { 2913}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 60   and name HB2 ))
      3.300     1.400     1.400 peak  2913 spectrum    1 weight  0.10000E+01 volume  0.10477E-02 ppm1      2.497 ppm2      1.677 CV     1
 OR { 2913}
   (( segid "    " and resid 55   and name HB1 ))
   (( segid "    " and resid 60   and name HB1 ))
 ASSI { 2916}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 64   and name HD1 ))
      3.500     1.600     1.600 peak  2916 spectrum    1 weight  0.10000E+01 volume  0.80421E-03 ppm1      1.094 ppm2      3.021 CV     1
 OR { 2916}
   (( segid "    " and resid 61   and name HG11))
   (( segid "    " and resid 64   and name HD2 ))
 OR { 2916}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 64   and name HD1 ))
 OR { 2916}
   (( segid "    " and resid 61   and name HG12))
   (( segid "    " and resid 64   and name HD2 ))
 ASSI { 2917}
   (( segid "    " and resid 69   and name HG  ))
   (( segid "    " and resid 69   and name HA  ))
      2.900     1.100     1.100 peak  2917 spectrum    1 weight  0.10000E+01 volume  0.25914E-02 ppm1      1.479 ppm2      5.223 CV     1
 ASSI { 2918}
   (( segid "    " and resid 40   and name HA  ))
   (( segid "    " and resid 41   and name HN  ))
      3.500     1.500     1.500 peak  2918 spectrum    1 weight  0.10000E+01 volume  0.10438E-02 ppm1      4.109 ppm2      8.596 CV     1
 ASSI { 2921}
   (( segid "    " and resid 122  and name HB2 ))
   (( segid "    " and resid 122  and name HA  ))
      3.200     1.300     1.300 peak  2921 spectrum    1 weight  0.10000E+01 volume  0.19792E-02 ppm1      2.820 ppm2      4.554 CV     1
 ASSI { 2922}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 122  and name HB2 ))
      3.300     1.400     1.400 peak  2922 spectrum    1 weight  0.10000E+01 volume  0.11302E-02 ppm1      4.261 ppm2      2.795 CV     1
 ASSI { 2923}
   (( segid "    " and resid 132  and name HB2 ))
   (( segid "    " and resid 122  and name HB1 ))
      3.200     1.300     1.300 peak  2923 spectrum    1 weight  0.10000E+01 volume  0.10674E-02 ppm1      4.271 ppm2      2.514 CV     1
 ASSI { 2927}
   (( segid "    " and resid 70   and name HB2 ))
   (( segid "    " and resid 70   and name HD21))
      3.400     1.500     1.500 peak  2927 spectrum    1 weight  0.10000E+01 volume  0.10167E-02 ppm1      3.028 ppm2      7.316 CV     1
 ASSI { 2928}
   (( segid "    " and resid 70   and name HB1 ))
   (( segid "    " and resid 71   and name HN  ))
      3.900     1.900     1.900 peak  2928 spectrum    1 weight  0.10000E+01 volume  0.10656E-02 ppm1      2.589 ppm2      8.146 CV     1
 ASSI { 2930}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 44   and name HN  ))
      3.900     1.900     1.900 peak  2930 spectrum    1 weight  0.10000E+01 volume  0.77668E-03 ppm1      1.991 ppm2      8.004 CV     1
 ASSI { 2931}
   (( segid "    " and resid 43   and name HB2 ))
   (( segid "    " and resid 40   and name HA  ))
      3.500     3.500     2.500 peak  2931 spectrum    1 weight  0.10000E+01 volume  0.64317E-03 ppm1      1.995 ppm2      4.020 CV     1
 ASSI { 2932}
   (( segid "    " and resid 43   and name HB1 ))
   (( segid "    " and resid 40   and name HA  ))
      3.500     1.500     1.500 peak  2932 spectrum    1 weight  0.10000E+01 volume  0.57629E-03 ppm1      1.427 ppm2      4.081 CV     1
 ASSI { 2933}
   (( segid "    " and resid 69   and name HB2 ))
   (( segid "    " and resid 70   and name HN  ))
      3.500     1.600     1.600 peak  2933 spectrum    1 weight  0.10000E+01 volume  0.64366E-03 ppm1      1.631 ppm2      9.513 CV     1
 ASSI { 2935}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HN  ))
      2.000     0.500     0.500 peak  2935 spectrum    1 weight  0.10000E+01 volume  0.52822E-02 ppm1      4.571 ppm2      8.810 CV     1
 ASSI { 2936}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 152  and name HA  ))
      3.400     1.400     1.400 peak  2936 spectrum    1 weight  0.10000E+01 volume  0.24611E-02 ppm1      4.577 ppm2      4.811 CV     1
 ASSI { 2940}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 114  and name HN  ))
      4.900     3.000     1.100 peak  2940 spectrum    1 weight  0.10000E+01 volume  0.57904E-03 ppm1      0.648 ppm2      8.287 CV     1
 ASSI { 2941}
   (  segid "    " and resid 113  and name HD1%)
   (( segid "    " and resid 113  and name HN  ))
      3.700     1.700     1.700 peak  2941 spectrum    1 weight  0.10000E+01 volume  0.64231E-03 ppm1      0.652 ppm2      8.544 CV     1
 ASSI { 2950}
   (( segid "    " and resid 154  and name HB  ))
   (( segid "    " and resid 155  and name HN  ))
      2.700     0.900     0.900 peak  2950 spectrum    1 weight  0.10000E+01 volume  0.54220E-02 ppm1      4.572 ppm2      7.999 CV     1
 ASSI { 2954}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      3.000     3.000     3.000 peak  2954 spectrum    1 weight  0.10000E+01 volume  0.20072E-02 ppm1      4.574 ppm2      9.149 CV     1
 ASSI { 2955}
   (( segid "    " and resid 61   and name HA  ))
   (( segid "    " and resid 62   and name HA  ))
      2.800     2.800     3.200 peak  2955 spectrum    1 weight  0.10000E+01 volume  0.39133E-02 ppm1      4.579 ppm2      5.098 CV     1
 ASSI { 2968}
   (  segid "    " and resid 22   and name HG2%)
   (  segid "    " and resid 82   and name HE% )
      3.700     1.700     1.700 peak  2968 spectrum    1 weight  0.10000E+01 volume  0.70670E-03 ppm1      1.406 ppm2      6.492 CV     1
 ASSI { 2972}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 103  and name HA2 ))
      3.500     1.500     1.500 peak  2972 spectrum    1 weight  0.10000E+01 volume  0.69350E-03 ppm1      1.126 ppm2      4.211 CV     1
 ASSI { 2974}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 157  and name HG2 ))
      4.400     2.500     1.600 peak  2974 spectrum    1 weight  0.10000E+01 volume  0.71890E-03 ppm1      1.124 ppm2      2.142 CV     1
 OR { 2974}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 157  and name HG1 ))
 ASSI { 2975}
   (  segid "    " and resid 106  and name HB% )
   (( segid "    " and resid 103  and name HA1 ))
      3.800     3.800     2.200 peak  2975 spectrum    1 weight  0.10000E+01 volume  0.78802E-03 ppm1      1.128 ppm2      3.912 CV     1
 ASSI { 2976}
   (( segid "    " and resid 139  and name HA  ))
   (( segid "    " and resid 142  and name HN  ))
      3.200     1.300     1.300 peak  2976 spectrum    1 weight  0.10000E+01 volume  0.10340E-02 ppm1      3.978 ppm2      7.167 CV     1
 ASSI { 2977}
   (( segid "    " and resid 139  and name HA  ))
   (  segid "    " and resid 142  and name HG2%)
      4.200     2.200     1.800 peak  2977 spectrum    1 weight  0.10000E+01 volume  0.88206E-03 ppm1      3.980 ppm2      1.215 CV     1
 ASSI { 2981}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 20   and name HN  ))
      3.400     1.500     1.500 peak  2981 spectrum    1 weight  0.10000E+01 volume  0.11740E-02 ppm1      4.096 ppm2      8.805 CV     1
 ASSI { 2982}
   (( segid "    " and resid 19   and name HA  ))
   (( segid "    " and resid 22   and name HN  ))
      3.300     1.300     1.300 peak  2982 spectrum    1 weight  0.10000E+01 volume  0.91692E-03 ppm1      4.090 ppm2      8.384 CV     1
 ASSI { 2983}
   (( segid "    " and resid 19   and name HA  ))
   (  segid "    " and resid 22   and name HG2%)
      3.300     3.300     2.700 peak  2983 spectrum    1 weight  0.10000E+01 volume  0.11107E-02 ppm1      4.095 ppm2      1.403 CV     1
 ASSI { 2987}
   (( segid "    " and resid 102  and name HA  ))
   (  segid "    " and resid 106  and name HB% )
      2.900     1.100     1.100 peak  2987 spectrum    1 weight  0.10000E+01 volume  0.15621E-02 ppm1      4.414 ppm2      1.133 CV     1
 ASSI { 2988}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 107  and name HN  ))
      2.400     0.700     0.700 peak  2988 spectrum    1 weight  0.10000E+01 volume  0.45764E-02 ppm1      4.895 ppm2      9.366 CV     1
 ASSI { 2989}
   (( segid "    " and resid 106  and name HA  ))
   (( segid "    " and resid 157  and name HB1 ))
      3.400     1.500     1.500 peak  2989 spectrum    1 weight  0.10000E+01 volume  0.24255E-02 ppm1      4.889 ppm2      1.605 CV     1
 ASSI { 2990}
   (( segid "    " and resid 106  and name HA  ))
   (  segid "    " and resid 106  and name HB% )
      2.200     0.600     0.600 peak  2990 spectrum    1 weight  0.10000E+01 volume  0.45698E-02 ppm1      4.895 ppm2      1.117 CV     1
 ASSI { 2992}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HB1 ))
      2.600     0.800     0.800 peak  2992 spectrum    1 weight  0.10000E+01 volume  0.41657E-02 ppm1      5.020 ppm2      2.482 CV     1
 ASSI { 2996}
   (( segid "    " and resid 55   and name HA  ))
   (( segid "    " and resid 55   and name HN  ))
      2.800     0.900     0.900 peak  2996 spectrum    1 weight  0.10000E+01 volume  0.16086E-02 ppm1      5.017 ppm2      8.634 CV     1
 ASSI { 2998}
   (  segid "    " and resid 79   and name HB% )
   (( segid "    " and resid 75   and name HD21))
      2.600     2.600     3.400 peak  2998 spectrum    1 weight  0.10000E+01 volume  0.75477E-03 ppm1      1.679 ppm2      7.598 CV     1
 ASSI { 3001}
   (  segid "    " and resid 25   and name HD1%)
   (  segid "    " and resid 35   and name HD% )
      3.000     3.000     3.000 peak  3001 spectrum    1 weight  0.10000E+01 volume  0.24196E-02 ppm1      0.161 ppm2      6.170 CV     1
 ASSI { 3007}
   (  segid "    " and resid 25   and name HD1%)
   (( segid "    " and resid 82   and name HB2 ))
      3.500     3.500     2.500 peak  3007 spectrum    1 weight  0.10000E+01 volume  0.95516E-03 ppm1      0.161 ppm2      2.653 CV     1
 ASSI { 3008}
   (  segid "    " and resid 82   and name HD% )
   (  segid "    " and resid 25   and name HD1%)
      3.700     1.700     1.700 peak  3008 spectrum    1 weight  0.10000E+01 volume  0.55337E-03 ppm1      6.461 ppm2      0.188 CV     1
 ASSI { 3016}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 116  and name HG2 ))
      3.900     1.900     1.900 peak  3016 spectrum    1 weight  0.10000E+01 volume  0.54564E-03 ppm1      6.777 ppm2      1.465 CV     1
 ASSI { 3024}
   (  segid "    " and resid 83   and name HD% )
   (( segid "    " and resid 84   and name HN  ))
      3.600     1.700     1.700 peak  3024 spectrum    1 weight  0.10000E+01 volume  0.62051E-03 ppm1      6.779 ppm2      8.372 CV     1
 ASSI { 3030}
   (  segid "    " and resid 29   and name HD% )
   (  segid "    " and resid 25   and name HG2%)
      4.300     2.300     1.700 peak  3030 spectrum    1 weight  0.10000E+01 volume  0.50840E-03 ppm1      7.333 ppm2      0.600 CV     1
 ASSI { 3038}
   (  segid "    " and resid 29   and name HE% )
   (( segid "    " and resid 38   and name HA  ))
      4.600     2.600     1.400 peak  3038 spectrum    1 weight  0.10000E+01 volume  0.59995E-03 ppm1      6.697 ppm2      4.124 CV     1
 ASSI { 3043}
   (  segid "    " and resid 109  and name HE% )
   (( segid "    " and resid 134  and name HA  ))
      3.900     1.900     1.900 peak  3043 spectrum    1 weight  0.10000E+01 volume  0.55300E-03 ppm1      6.863 ppm2      3.365 CV     1
 ASSI { 3046}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 69   and name HA  ))
      3.000     1.100     1.100 peak  3046 spectrum    1 weight  0.10000E+01 volume  0.10996E-02 ppm1      5.588 ppm2      5.235 CV     1
 ASSI { 3047}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 88   and name HH12))
      4.500     2.500     1.500 peak  3047 spectrum    1 weight  0.10000E+01 volume  0.11507E-02 ppm1      5.585 ppm2      6.628 CV     1
 OR { 3047}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 88   and name HH11))
 ASSI { 3048}
   (( segid "    " and resid 86   and name HA  ))
   (( segid "    " and resid 86   and name HN  ))
      2.900     1.100     1.100 peak  3048 spectrum    1 weight  0.10000E+01 volume  0.11049E-02 ppm1      5.590 ppm2      9.157 CV     1
 ASSI { 3052}
   (( segid "    " and resid 126  and name HA  ))
   (  segid "    " and resid 111  and name HG1%)
      3.500     1.600     1.600 peak  3052 spectrum    1 weight  0.10000E+01 volume  0.11949E-02 ppm1      5.204 ppm2      0.834 CV     1
 ASSI { 3053}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 131  and name HE1 ))
      3.400     1.400     1.400 peak  3053 spectrum    1 weight  0.10000E+01 volume  0.76038E-03 ppm1      5.198 ppm2      2.107 CV     1
 OR { 3053}
   (( segid "    " and resid 126  and name HA  ))
   (( segid "    " and resid 131  and name HE2 ))
 ASSI { 3056}
   (  segid "    " and resid 35   and name HE% )
   (( segid "    " and resid 81   and name HN  ))
      4.100     2.100     1.900 peak  3056 spectrum    1 weight  0.10000E+01 volume  0.85055E-03 ppm1      6.837 ppm2      8.780 CV     1
 ASSI { 3061}
   (( segid "    " and resid 70   and name HA  ))
   (( segid "    " and resid 70   and name HB2 ))
      2.400     0.700     0.700 peak  3061 spectrum    1 weight  0.10000E+01 volume  0.36040E-02 ppm1      5.365 ppm2      3.021 CV     1
 ASSI { 3069}
   (( segid "    " and resid 123  and name HA2 ))
   (( segid "    " and resid 132  and name HB1 ))
      2.700     2.700     3.300 peak  3069 spectrum    1 weight  0.10000E+01 volume  0.36249E-02 ppm1      4.706 ppm2      3.802 CV     1
 ASSI { 3070}
   (( segid "    " and resid 33   and name HA  ))
   (( segid "    " and resid 34   and name HN  ))
      3.100     1.200     1.200 peak  3070 spectrum    1 weight  0.10000E+01 volume  0.13511E-02 ppm1      4.301 ppm2      7.623 CV     1
 ASSI { 3072}
   (( segid "    " and resid 59   and name HB2 ))
   (( segid "    " and resid 59   and name HA  ))
      2.900     1.000     1.000 peak  3072 spectrum    1 weight  0.10000E+01 volume  0.13009E-02 ppm1      2.184 ppm2      3.722 CV     1
 ASSI { 3073}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HD1 ))
      2.600     0.800     0.800 peak  3073 spectrum    1 weight  0.10000E+01 volume  0.24881E-02 ppm1      2.117 ppm2      3.671 CV     1
 OR { 3073}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HD2 ))
 ASSI { 3074}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HD1 ))
      2.800     1.000     1.000 peak  3074 spectrum    1 weight  0.10000E+01 volume  0.17117E-02 ppm1      2.060 ppm2      3.681 CV     1
 OR { 3074}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HD2 ))
 OR { 3074}
   (( segid "    " and resid 50   and name HG2 ))
   (( segid "    " and resid 50   and name HD2 ))
 OR { 3074}
   (( segid "    " and resid 50   and name HG1 ))
   (( segid "    " and resid 50   and name HD1 ))
 ASSI { 3075}
   (( segid "    " and resid 50   and name HG2 ))
   (  segid "    " and resid 53   and name HE% )
      3.000     1.200     1.200 peak  3075 spectrum    1 weight  0.10000E+01 volume  0.82712E-03 ppm1      2.119 ppm2      6.543 CV     1
 ASSI { 3076}
   (( segid "    " and resid 50   and name HG2 ))
   (  segid "    " and resid 53   and name HD% )
      3.800     1.800     1.800 peak  3076 spectrum    1 weight  0.10000E+01 volume  0.70756E-03 ppm1      2.119 ppm2      6.828 CV     1
 ASSI { 3077}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 91   and name HA  ))
      3.100     1.200     1.200 peak  3077 spectrum    1 weight  0.10000E+01 volume  0.11253E-02 ppm1      2.496 ppm2      3.603 CV     1
 ASSI { 3078}
   (( segid "    " and resid 94   and name HB1 ))
   (( segid "    " and resid 92   and name HA  ))
      3.700     1.700     1.700 peak  3078 spectrum    1 weight  0.10000E+01 volume  0.75651E-03 ppm1      2.508 ppm2      4.045 CV     1
 ASSI { 3082}
   (  segid "    " and resid 122  and name HD% )
   (( segid "    " and resid 109  and name HN  ))
      3.600     1.700     1.700 peak  3082 spectrum    1 weight  0.10000E+01 volume  0.57580E-03 ppm1      6.774 ppm2      8.780 CV     1
 ASSI { 3085}
   (( segid "    " and resid 69   and name HA  ))
   (( segid "    " and resid 69   and name HB2 ))
      2.500     0.800     0.800 peak  3085 spectrum    1 weight  0.10000E+01 volume  0.19707E-02 ppm1      5.254 ppm2      1.634 CV     1
!assign (resid 112 and name HN) (resid 152 and name HN) 5.500 3.7 0.0 ! beta2.beta3 
assign (resid 112 and name HN) (resid 153 and name HA) 5.500 3.7 0.0 ! beta2.beta3
assign (resid 154 and name HN) (resid 111 and name HA) 5.500 3.7 0.0 ! beta2.beta3
!assign (resid 154 and name HN) (resid 110 and name HN) 5.500 3.7 0.0 ! beta2.beta3
assign (resid 110 and name HN) (resid 155 and name HA) 5.500 3.7 0.0 ! beta2.beta3
assign (resid 156 and name HN) (resid 109 and name HA) 5.500 3.7 0.0 ! beta2.beta3
assign (resid 108 and name HN) (resid 156 and name HA) 5.500 3.7 0.0 ! beta2.beta3
!assign (resid 111 and name HN) (resid 128 and name HA) 5.500 3.7 0.0 ! beta3.beta4
!assign (resid 111 and name HN) (resid 129 and name HN) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 111 and name HN) (resid 130 and name HA) 5.500 3.7 0.0 ! beta3.beta4
!assign (resid 129 and name HN) (resid 110 and name HA1) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 129 and name HN) (resid 110 and name HA2) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 131 and name HN) (resid 110 and name HA1) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 131 and name HN) (resid 110 and name HA2) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 109 and name HN) (resid 130 and name HA) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 109 and name HN) (resid 131 and name HN) 5.500 3.7 0.0 ! beta3.beta4
assign (resid 109 and name HN) (resid 132 and name HA) 5.500 3.7 0.0 ! beta3.beta4
!assign (resid 131 and name HN) (resid 108 and name HA1) 5.500 3.7 0.0 ! beta3.beta4
!assign (resid 131 and name HN) (resid 108 and name HA2) 5.500 3.7 0.0 ! beta3.beta4
!assign (resid 59 and name HN) (resid 89 and name HN) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 88 and name HN) (resid 60 and name HA) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 87 and name HA) (resid 61 and name HN) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 61 and name HN) (resid 86 and name HN) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 86 and name HN) (resid 62 and name HA) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 86 and name HN) (resid 63 and name HN) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 63 and name HN) (resid 85 and name HA) 5.500 3.7 0.0 ! beta1.beta5
!assign (resid 84 and name HN) (resid 63 and name HA) 5.500 3.7 0.0 ! beta1.beta5
assign (resid 74 and name HN) (resid 82 and name HA) 5.500 3.7 0.0 ! beta5.beta6
assign (resid 83 and name HN) (resid 72 and name HA1) 5.500 3.7 0.0 ! beta5.beta6
assign (resid 83 and name HN) (resid 72 and name HA2) 5.500 3.7 0.0 ! beta5.beta6
assign (resid 71 and name HN) (resid 84 and name HA) 5.500 3.7 0.0 ! beta5.beta6
assign (resid 71 and name HN) (resid 85 and name HN) 5.500 3.7 0.0 ! beta5.beta6
assign (resid 85 and name HN) (resid 70 and name HA) 5.500 3.7 0.0 ! beta5.beta6
assign (resid 25 and name HG2#) (resid 82 and name HE1) 5.500 3.7 0.0 !long-range NOE
assign (resid 25 and name HG2#) (resid 82 and name HE2) 5.500 3.7 0.0 !long-range NOE

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1 -23.211  -4.040  -5.454
    2   2H    MET   1          2HT       MET   1 -22.428  -3.428  -4.089
    3   3H    MET   1          3HT       MET   1 -23.375  -2.405  -5.048
    4    HA   MET   1           HA       MET   1 -24.558  -2.953  -3.061
    5   1HB   MET   1          2HB       MET   1 -26.603  -3.822  -4.030
    6   2HB   MET   1          1HB       MET   1 -25.839  -2.728  -5.171
    7   1HG   MET   1          2HG       MET   1 -25.703  -5.734  -5.286
    8   2HG   MET   1          1HG       MET   1 -26.779  -4.721  -6.246
    9   1HE   MET   1          1HE       MET   1 -25.915  -5.855  -8.479
   10   2HE   MET   1          2HE       MET   1 -24.852  -6.894  -7.529
   11   3HE   MET   1          3HE       MET   1 -24.210  -6.000  -8.907
   12    H    GLU   2           H        GLU   2 -25.430  -4.470  -1.646
   13    HA   GLU   2           HA       GLU   2 -25.374  -6.275  -0.314
   14   1HB   GLU   2          2HB       GLU   2 -25.342  -7.562  -3.013
   15   2HB   GLU   2          1HB       GLU   2 -25.222  -8.549  -1.561
   16   1HG   GLU   2          2HG       GLU   2 -27.453  -6.676  -2.302
   17   2HG   GLU   2          1HG       GLU   2 -27.509  -8.439  -2.250
   18    H    GLN   3           H        GLN   3 -23.518  -5.761   0.756
   19    HA   GLN   3           HA       GLN   3 -21.612  -6.374   1.810
   20   1HB   GLN   3          2HB       GLN   3 -21.720  -8.787  -0.011
   21   2HB   GLN   3          1HB       GLN   3 -20.710  -8.627   1.421
   22   1HG   GLN   3          2HG       GLN   3 -22.557  -8.682   2.865
   23   2HG   GLN   3          1HG       GLN   3 -23.697  -8.387   1.554
   24   1HE2  GLN   3          1HE2      GLN   3 -24.922 -10.176   2.040
   25   2HE2  GLN   3          2HE2      GLN   3 -24.378 -11.794   1.729
   26    H    SER   4           H        SER   4 -19.236  -7.355   1.094
   27    HA   SER   4           HA       SER   4 -18.209  -5.312  -0.630
   28   1HB   SER   4          2HB       SER   4 -16.144  -7.112  -0.037
   29   2HB   SER   4          1HB       SER   4 -16.523  -5.610   0.813
   30    HG   SER   4           HG       SER   4 -16.780  -8.162   1.677
   31    H    ALA   5           H        ALA   5 -18.572  -8.821  -0.781
   32    HA   ALA   5           HA       ALA   5 -18.805 -10.262  -2.515
   33   1HB   ALA   5          1HB       ALA   5 -19.297  -9.450  -4.751
   34   2HB   ALA   5          2HB       ALA   5 -18.801  -7.823  -4.285
   35   3HB   ALA   5          3HB       ALA   5 -20.223  -8.557  -3.544
   36    H    SER   6           H        SER   6 -16.540  -7.693  -3.487
   37    HA   SER   6           HA       SER   6 -14.873  -9.423  -5.013
   38   1HB   SER   6          2HB       SER   6 -14.161  -6.753  -3.781
   39   2HB   SER   6          1HB       SER   6 -13.391  -7.520  -5.171
   40    HG   SER   6           HG       SER   6 -15.983  -6.395  -4.989
   41    H    ASP   7           H        ASP   7 -15.321  -9.065  -1.747
   42    HA   ASP   7           HA       ASP   7 -12.636  -9.209  -0.810
   43   1HB   ASP   7          2HB       ASP   7 -13.641  -9.422   1.392
   44   2HB   ASP   7          1HB       ASP   7 -14.468  -8.173   0.484
   45    H    SER   8           H        SER   8 -14.854 -11.466  -2.007
   46    HA   SER   8           HA       SER   8 -13.296 -13.682  -0.858
   47   1HB   SER   8          2HB       SER   8 -16.050 -13.858  -2.081
   48   2HB   SER   8          1HB       SER   8 -15.228 -15.073  -1.103
   49    HG   SER   8           HG       SER   8 -15.854 -12.483  -0.118
   50    H    ASN   9           H        ASN   9 -14.602 -12.296  -3.814
   51    HA   ASN   9           HA       ASN   9 -13.656 -14.516  -5.423
   52   1HB   ASN   9          2HB       ASN   9 -15.028 -11.936  -6.195
   53   2HB   ASN   9          1HB       ASN   9 -14.616 -13.226  -7.320
   54   1HD2  ASN   9          1HD2      ASN   9 -15.849 -15.066  -7.381
   55   2HD2  ASN   9          2HD2      ASN   9 -17.346 -15.222  -6.519
   56    H    LYS  10           H        LYS  10 -13.111 -10.986  -5.431
   57    HA   LYS  10           HA       LYS  10 -11.055 -11.146  -7.384
   58   1HB   LYS  10          2HB       LYS  10 -12.507  -9.154  -7.021
   59   2HB   LYS  10          1HB       LYS  10 -11.681  -8.866  -5.497
   60   1HG   LYS  10          2HG       LYS  10  -9.558  -8.628  -6.762
   61   2HG   LYS  10          1HG       LYS  10 -10.481  -8.768  -8.257
   62   1HD   LYS  10          2HD       LYS  10 -11.825  -6.795  -7.531
   63   2HD   LYS  10          1HD       LYS  10 -10.739  -6.621  -6.151
   64   1HE   LYS  10          2HE       LYS  10 -10.065  -5.111  -7.909
   65   2HE   LYS  10          1HE       LYS  10  -8.845  -6.368  -7.706
   66   1HZ   LYS  10          1HZ       LYS  10  -9.719  -7.513  -9.628
   67   2HZ   LYS  10          2HZ       LYS  10  -9.330  -5.915 -10.043
   68   3HZ   LYS  10          3HZ       LYS  10 -10.950  -6.358  -9.804
   69    H    SER  11           H        SER  11 -11.118 -11.149  -3.906
   70    HA   SER  11           HA       SER  11  -8.516 -10.392  -3.319
   71   1HB   SER  11          2HB       SER  11  -8.871 -11.829  -1.237
   72   2HB   SER  11          1HB       SER  11 -10.061 -10.560  -1.534
   73    HG   SER  11           HG       SER  11 -11.248 -12.341  -1.108
   74    H    GLN  12           H        GLN  12  -9.795 -13.617  -4.043
   75    HA   GLN  12           HA       GLN  12  -7.509 -15.099  -3.457
   76   1HB   GLN  12          2HB       GLN  12  -9.610 -15.673  -5.547
   77   2HB   GLN  12          1HB       GLN  12  -8.468 -16.841  -4.900
   78   1HG   GLN  12          2HG       GLN  12 -10.605 -15.414  -3.332
   79   2HG   GLN  12          1HG       GLN  12 -10.685 -17.075  -3.911
   80   1HE2  GLN  12          1HE2      GLN  12  -9.385 -18.644  -2.940
   81   2HE2  GLN  12          2HE2      GLN  12  -8.676 -18.401  -1.379
   82    H    ASN  13           H        ASN  13  -8.295 -13.187  -6.261
   83    HA   ASN  13           HA       ASN  13  -6.162 -14.348  -7.851
   84   1HB   ASN  13          2HB       ASN  13  -8.155 -12.144  -8.364
   85   2HB   ASN  13          1HB       ASN  13  -6.827 -12.474  -9.471
   86   1HD2  ASN  13          1HD2      ASN  13  -8.535 -14.945  -7.670
   87   2HD2  ASN  13          2HD2      ASN  13  -9.293 -15.691  -9.037
   88    H    ALA  14           H        ALA  14  -6.819 -11.411  -6.050
   89    HA   ALA  14           HA       ALA  14  -4.577  -9.923  -6.886
   90   1HB   ALA  14          1HB       ALA  14  -6.063  -9.732  -4.268
   91   2HB   ALA  14          2HB       ALA  14  -6.536  -8.936  -5.769
   92   3HB   ALA  14          3HB       ALA  14  -5.023  -8.496  -4.976
   93    H    ILE  15           H        ILE  15  -5.086 -12.145  -4.191
   94    HA   ILE  15           HA       ILE  15  -2.758 -11.888  -2.754
   95    HB   ILE  15           HB       ILE  15  -4.124 -14.489  -3.467
   96   1HG1  ILE  15          2HG1      ILE  15  -4.512 -12.736  -1.035
   97   2HG1  ILE  15          1HG1      ILE  15  -5.584 -12.732  -2.431
   98   1HG2  ILE  15          1HG2      ILE  15  -2.277 -13.820  -1.178
   99   2HG2  ILE  15          2HG2      ILE  15  -1.904 -14.863  -2.552
  100   3HG2  ILE  15          3HG2      ILE  15  -3.140 -15.345  -1.390
  101   1HD1  ILE  15          1HD1      ILE  15  -5.043 -15.081  -0.627
  102   2HD1  ILE  15          2HD1      ILE  15  -6.122 -15.077  -2.023
  103   3HD1  ILE  15          3HD1      ILE  15  -6.488 -14.070  -0.623
  104    H    SER  16           H        SER  16  -3.252 -13.892  -5.651
  105    HA   SER  16           HA       SER  16  -0.747 -15.091  -5.742
  106   1HB   SER  16          2HB       SER  16  -2.542 -14.334  -8.058
  107   2HB   SER  16          1HB       SER  16  -1.224 -15.505  -8.120
  108    HG   SER  16           HG       SER  16  -2.424 -16.562  -6.311
  109    H    GLU  17           H        GLU  17  -1.787 -11.970  -7.072
  110    HA   GLU  17           HA       GLU  17   0.553 -11.514  -8.595
  111   1HB   GLU  17          2HB       GLU  17  -1.467  -9.560  -7.488
  112   2HB   GLU  17          1HB       GLU  17  -0.207  -9.141  -8.641
  113   1HG   GLU  17          2HG       GLU  17  -1.192 -10.865 -10.184
  114   2HG   GLU  17          1HG       GLU  17  -2.544 -10.985  -9.058
  115    H    VAL  18           H        VAL  18  -0.421 -10.369  -5.367
  116    HA   VAL  18           HA       VAL  18   1.931  -8.784  -5.055
  117    HB   VAL  18           HB       VAL  18   0.037  -9.680  -2.885
  118   1HG1  VAL  18          1HG1      VAL  18   0.793  -7.652  -1.743
  119   2HG1  VAL  18          2HG1      VAL  18   1.891  -7.305  -3.078
  120   3HG1  VAL  18          3HG1      VAL  18   2.141  -8.737  -2.079
  121   1HG2  VAL  18          1HG2      VAL  18  -0.105  -7.271  -4.699
  122   2HG2  VAL  18          2HG2      VAL  18  -1.136  -7.552  -3.297
  123   3HG2  VAL  18          3HG2      VAL  18  -1.217  -8.639  -4.681
  124    H    MET  19           H        MET  19   0.913 -11.935  -3.742
  125    HA   MET  19           HA       MET  19   3.186 -12.418  -2.186
  126   1HB   MET  19          2HB       MET  19   1.178 -14.201  -3.507
  127   2HB   MET  19          1HB       MET  19   2.600 -14.907  -2.753
  128   1HG   MET  19          2HG       MET  19   0.667 -13.086  -1.342
  129   2HG   MET  19          1HG       MET  19   0.592 -14.846  -1.298
  130   1HE   MET  19          1HE       MET  19   4.011 -15.704   0.484
  131   2HE   MET  19          2HE       MET  19   3.746 -15.551  -1.254
  132   3HE   MET  19          3HE       MET  19   2.551 -16.371  -0.247
  133    H    SER  20           H        SER  20   2.737 -12.591  -5.628
  134    HA   SER  20           HA       SER  20   5.210 -13.998  -6.089
  135   1HB   SER  20          2HB       SER  20   3.431 -12.465  -8.002
  136   2HB   SER  20          1HB       SER  20   4.803 -13.471  -8.471
  137    HG   SER  20           HG       SER  20   2.419 -14.298  -7.165
  138    H    ALA  21           H        ALA  21   4.122 -10.690  -5.890
  139    HA   ALA  21           HA       ALA  21   6.397  -9.454  -7.024
  140   1HB   ALA  21          1HB       ALA  21   4.263  -8.293  -6.750
  141   2HB   ALA  21          2HB       ALA  21   5.578  -7.410  -5.973
  142   3HB   ALA  21          3HB       ALA  21   4.451  -8.353  -4.997
  143    H    THR  22           H        THR  22   5.480 -10.053  -3.628
  144    HA   THR  22           HA       THR  22   7.869  -9.024  -2.543
  145    HB   THR  22           HB       THR  22   5.892  -9.269  -1.149
  146    HG1  THR  22           1HG      THR  22   8.353 -10.182  -0.490
  147   1HG2  THR  22          1HG2      THR  22   4.971 -11.329  -2.096
  148   2HG2  THR  22          2HG2      THR  22   5.146 -11.462  -0.346
  149   3HG2  THR  22          3HG2      THR  22   6.309 -12.251  -1.411
  150    H    SER  23           H        SER  23   7.056 -12.140  -3.875
  151    HA   SER  23           HA       SER  23   9.325 -13.514  -2.820
  152   1HB   SER  23          2HB       SER  23   7.303 -14.714  -3.562
  153   2HB   SER  23          1HB       SER  23   7.590 -14.176  -5.216
  154    HG   SER  23           HG       SER  23   9.201 -15.916  -3.646
  155    H    ALA  24           H        ALA  24   8.580 -11.919  -5.896
  156    HA   ALA  24           HA       ALA  24  10.967 -12.604  -7.222
  157   1HB   ALA  24          1HB       ALA  24  10.376 -10.843  -8.805
  158   2HB   ALA  24          2HB       ALA  24   9.160 -10.237  -7.680
  159   3HB   ALA  24          3HB       ALA  24   8.977 -11.837  -8.401
  160    H    ILE  25           H        ILE  25  10.049  -9.627  -5.477
  161    HA   ILE  25           HA       ILE  25  12.496  -8.305  -5.965
  162    HB   ILE  25           HB       ILE  25  10.457  -7.095  -5.300
  163   1HG1  ILE  25          2HG1      ILE  25  12.737  -6.699  -3.349
  164   2HG1  ILE  25          1HG1      ILE  25  12.694  -6.071  -4.993
  165   1HG2  ILE  25          1HG2      ILE  25   9.548  -8.619  -3.669
  166   2HG2  ILE  25          2HG2      ILE  25   9.778  -7.032  -2.935
  167   3HG2  ILE  25          3HG2      ILE  25  10.917  -8.334  -2.593
  168   1HD1  ILE  25          1HD1      ILE  25  12.144  -4.353  -3.373
  169   2HD1  ILE  25          2HD1      ILE  25  10.805  -5.329  -2.772
  170   3HD1  ILE  25          3HD1      ILE  25  10.765  -4.695  -4.415
  171    H    ASN  26           H        ASN  26  11.453 -10.510  -3.437
  172    HA   ASN  26           HA       ASN  26  13.683 -10.093  -1.727
  173   1HB   ASN  26          2HB       ASN  26  11.604 -11.151  -0.944
  174   2HB   ASN  26          1HB       ASN  26  11.911 -12.530  -1.996
  175   1HD2  ASN  26          1HD2      ASN  26  12.113 -14.058  -0.456
  176   2HD2  ASN  26          2HD2      ASN  26  13.381 -14.091   0.718
  177    H    GLY  27           H        GLY  27  13.000 -12.340  -4.366
  178   1HA   GLY  27          2HA       GLY  27  15.254 -13.999  -4.001
  179   2HA   GLY  27          1HA       GLY  27  14.322 -13.844  -5.482
  180    H    LEU  28           H        LEU  28  14.967 -10.855  -5.382
  181    HA   LEU  28           HA       LEU  28  17.445 -11.086  -6.880
  182   1HB   LEU  28          2HB       LEU  28  15.696  -8.671  -6.405
  183   2HB   LEU  28          1HB       LEU  28  17.020  -8.779  -7.549
  184    HG   LEU  28           HG       LEU  28  14.428 -10.321  -7.684
  185   1HD1  LEU  28          1HD1      LEU  28  14.143  -7.986  -8.250
  186   2HD1  LEU  28          2HD1      LEU  28  14.040  -8.979  -9.704
  187   3HD1  LEU  28          3HD1      LEU  28  15.510  -8.063  -9.363
  188   1HD2  LEU  28          1HD2      LEU  28  16.289 -11.641  -8.542
  189   2HD2  LEU  28          2HD2      LEU  28  16.772 -10.299  -9.581
  190   3HD2  LEU  28          3HD2      LEU  28  15.229 -11.113  -9.849
  191    H    TYR  29           H        TYR  29  16.390 -10.040  -3.772
  192    HA   TYR  29           HA       TYR  29  18.873  -8.525  -3.341
  193   1HB   TYR  29          2HB       TYR  29  16.219  -8.527  -1.924
  194   2HB   TYR  29          1HB       TYR  29  17.653  -7.818  -1.194
  195    HD1  TYR  29           1HD      TYR  29  15.886  -7.693  -4.501
  196    HD2  TYR  29           2HD      TYR  29  17.863  -5.552  -1.403
  197    HE1  TYR  29           1HE      TYR  29  15.435  -5.586  -5.680
  198    HE2  TYR  29           2HE      TYR  29  17.420  -3.436  -2.572
  199    HH   TYR  29           HH       TYR  29  16.969  -2.716  -4.999
  200    H    ILE  30           H        ILE  30  17.007 -11.235  -2.167
  201    HA   ILE  30           HA       ILE  30  17.426 -12.932  -0.744
  202    HB   ILE  30           HB       ILE  30  20.322 -12.061  -0.720
  203   1HG1  ILE  30          2HG1      ILE  30  19.556 -12.462  -3.021
  204   2HG1  ILE  30          1HG1      ILE  30  20.668 -13.721  -2.499
  205   1HG2  ILE  30          1HG2      ILE  30  20.753 -14.411  -0.132
  206   2HG2  ILE  30          2HG2      ILE  30  19.015 -14.704  -0.077
  207   3HG2  ILE  30          3HG2      ILE  30  19.758 -13.598   1.078
  208   1HD1  ILE  30          1HD1      ILE  30  18.769 -15.209  -2.083
  209   2HD1  ILE  30          2HD1      ILE  30  18.827 -14.657  -3.758
  210   3HD1  ILE  30          3HD1      ILE  30  17.669 -13.944  -2.635
  211    H    GLY  31           H        GLY  31  16.164 -11.166   0.463
  212   1HA   GLY  31          2HA       GLY  31  15.560 -10.625   2.608
  213   2HA   GLY  31          1HA       GLY  31  17.072 -11.319   3.164
  214    H    GLN  32           H        GLN  32  19.028  -9.972   2.591
  215    HA   GLN  32           HA       GLN  32  20.239  -8.158   3.275
  216   1HB   GLN  32          2HB       GLN  32  17.975  -6.677   1.924
  217   2HB   GLN  32          1HB       GLN  32  19.512  -5.970   2.396
  218   1HG   GLN  32          2HG       GLN  32  19.134  -8.181   0.396
  219   2HG   GLN  32          1HG       GLN  32  19.438  -6.486   0.020
  220   1HE2  GLN  32          1HE2      GLN  32  20.967  -8.930  -0.597
  221   2HE2  GLN  32          2HE2      GLN  32  22.557  -8.656   0.032
  222    H    THR  33           H        THR  33  18.535  -9.243   5.191
  223    HA   THR  33           HA       THR  33  17.604  -8.869   7.231
  224    HB   THR  33           HB       THR  33  18.316  -5.949   6.830
  225    HG1  THR  33           1HG      THR  33  20.203  -7.192   6.817
  226   1HG2  THR  33          1HG2      THR  33  17.668  -7.502   9.340
  227   2HG2  THR  33          2HG2      THR  33  16.621  -6.314   8.565
  228   3HG2  THR  33          3HG2      THR  33  18.156  -5.808   9.269
  229    H    SER  34           H        SER  34  16.845  -6.054   5.207
  230    HA   SER  34           HA       SER  34  14.227  -6.937   4.616
  231   1HB   SER  34          2HB       SER  34  13.969  -6.155   7.033
  232   2HB   SER  34          1HB       SER  34  14.329  -4.529   6.453
  233    HG   SER  34           HG       SER  34  12.497  -4.623   5.153
  234    H    TYR  35           H        TYR  35  16.193  -6.296   2.950
  235    HA   TYR  35           HA       TYR  35  16.791  -5.002   1.161
  236   1HB   TYR  35          2HB       TYR  35  14.246  -3.446   1.684
  237   2HB   TYR  35          1HB       TYR  35  15.128  -3.567   0.163
  238    HD1  TYR  35           1HD      TYR  35  15.170  -5.783  -1.042
  239    HD2  TYR  35           2HD      TYR  35  12.621  -5.064   2.288
  240    HE1  TYR  35           1HE      TYR  35  13.800  -7.725  -1.677
  241    HE2  TYR  35           2HE      TYR  35  11.245  -7.000   1.662
  242    HH   TYR  35           HH       TYR  35  12.240  -9.316  -0.575
  243    H    SER  36           H        SER  36  17.498  -4.318   3.924
  244    HA   SER  36           HA       SER  36  17.567  -1.557   4.347
  245   1HB   SER  36          2HB       SER  36  19.596  -3.619   5.237
  246   2HB   SER  36          1HB       SER  36  19.318  -2.035   5.967
  247    HG   SER  36           HG       SER  36  17.011  -2.956   6.135
  248    H    GLY  37           H        GLY  37  19.218  -0.028   3.997
  249   1HA   GLY  37          2HA       GLY  37  21.283   0.596   2.889
  250   2HA   GLY  37          1HA       GLY  37  21.019  -0.735   1.769
  251    H    LEU  38           H        LEU  38  18.358  -0.399   1.121
  252    HA   LEU  38           HA       LEU  38  18.454   1.688  -0.788
  253   1HB   LEU  38          2HB       LEU  38  16.069   0.192   0.306
  254   2HB   LEU  38          1HB       LEU  38  16.030   1.244  -1.095
  255    HG   LEU  38           HG       LEU  38  17.602  -1.323  -0.872
  256   1HD1  LEU  38          1HD1      LEU  38  15.982  -2.168  -2.501
  257   2HD1  LEU  38          2HD1      LEU  38  15.096  -0.648  -2.407
  258   3HD1  LEU  38          3HD1      LEU  38  15.200  -1.696  -0.993
  259   1HD2  LEU  38          1HD2      LEU  38  17.192   0.507  -3.235
  260   2HD2  LEU  38          2HD2      LEU  38  18.073  -1.019  -3.232
  261   3HD2  LEU  38          3HD2      LEU  38  18.685   0.353  -2.311
  262    H    ASP  39           H        ASP  39  17.218   1.503   2.463
  263    HA   ASP  39           HA       ASP  39  15.465   3.635   2.566
  264   1HB   ASP  39          2HB       ASP  39  15.659   2.104   4.409
  265   2HB   ASP  39          1HB       ASP  39  17.340   2.554   4.668
  266    H    SER  40           H        SER  40  18.889   3.712   3.522
  267    HA   SER  40           HA       SER  40  19.015   6.436   4.060
  268   1HB   SER  40          2HB       SER  40  21.291   4.699   3.089
  269   2HB   SER  40          1HB       SER  40  21.407   6.145   4.092
  270    HG   SER  40           HG       SER  40  20.417   5.047   5.768
  271    H    THR  41           H        THR  41  19.400   4.701   1.021
  272    HA   THR  41           HA       THR  41  20.489   6.937  -0.399
  273    HB   THR  41           HB       THR  41  19.130   4.558  -1.661
  274    HG1  THR  41           1HG      THR  41  21.718   4.744  -0.468
  275   1HG2  THR  41          1HG2      THR  41  19.822   6.343  -3.169
  276   2HG2  THR  41          2HG2      THR  41  20.832   4.916  -3.405
  277   3HG2  THR  41          3HG2      THR  41  21.453   6.297  -2.501
  278    H    ILE  42           H        ILE  42  17.294   5.372  -0.295
  279    HA   ILE  42           HA       ILE  42  16.195   7.110  -2.281
  280    HB   ILE  42           HB       ILE  42  14.855   5.162  -0.406
  281   1HG1  ILE  42          2HG1      ILE  42  16.400   4.107  -1.976
  282   2HG1  ILE  42          1HG1      ILE  42  14.736   3.730  -2.411
  283   1HG2  ILE  42          1HG2      ILE  42  12.913   5.310  -1.887
  284   2HG2  ILE  42          2HG2      ILE  42  13.712   6.582  -2.808
  285   3HG2  ILE  42          3HG2      ILE  42  13.266   6.861  -1.126
  286   1HD1  ILE  42          1HD1      ILE  42  16.473   5.804  -3.733
  287   2HD1  ILE  42          2HD1      ILE  42  14.811   5.407  -4.176
  288   3HD1  ILE  42          3HD1      ILE  42  16.088   4.206  -4.373
  289    H    LEU  43           H        LEU  43  16.170   7.051   1.237
  290    HA   LEU  43           HA       LEU  43  14.070   8.794   1.748
  291   1HB   LEU  43          2HB       LEU  43  15.340   7.517   3.453
  292   2HB   LEU  43          1HB       LEU  43  16.685   8.627   3.239
  293    HG   LEU  43           HG       LEU  43  15.203  10.486   4.005
  294   1HD1  LEU  43          1HD1      LEU  43  13.054   9.484   3.455
  295   2HD1  LEU  43          2HD1      LEU  43  13.130   9.919   5.162
  296   3HD1  LEU  43          3HD1      LEU  43  13.312   8.234   4.671
  297   1HD2  LEU  43          1HD2      LEU  43  15.556   8.178   5.913
  298   2HD2  LEU  43          2HD2      LEU  43  15.264   9.857   6.371
  299   3HD2  LEU  43          3HD2      LEU  43  16.755   9.417   5.537
  300    H    LEU  44           H        LEU  44  17.527   9.636   1.405
  301    HA   LEU  44           HA       LEU  44  16.869  12.444   1.329
  302   1HB   LEU  44          2HB       LEU  44  19.336  12.739   0.945
  303   2HB   LEU  44          1HB       LEU  44  18.874  11.972   2.449
  304    HG   LEU  44           HG       LEU  44  19.395   9.754   1.272
  305   1HD1  LEU  44          1HD1      LEU  44  19.483  10.537  -1.013
  306   2HD1  LEU  44          2HD1      LEU  44  21.064   9.918  -0.531
  307   3HD1  LEU  44          3HD1      LEU  44  20.783  11.658  -0.607
  308   1HD2  LEU  44          1HD2      LEU  44  21.774   9.971   1.788
  309   2HD2  LEU  44          2HD2      LEU  44  20.770  10.718   3.030
  310   3HD2  LEU  44          3HD2      LEU  44  21.601  11.725   1.844
  311    H    ASN  45           H        ASN  45  16.898  10.006  -0.942
  312    HA   ASN  45           HA       ASN  45  17.927  11.258  -3.233
  313   1HB   ASN  45          2HB       ASN  45  17.466   8.880  -3.235
  314   2HB   ASN  45          1HB       ASN  45  15.754   9.173  -2.948
  315   1HD2  ASN  45          1HD2      ASN  45  14.436   9.751  -4.644
  316   2HD2  ASN  45          2HD2      ASN  45  14.956   9.708  -6.298
  317    H    THR  46           H        THR  46  14.717  11.329  -1.770
  318    HA   THR  46           HA       THR  46  13.941  13.312  -3.795
  319    HB   THR  46           HB       THR  46  12.147  11.507  -2.160
  320    HG1  THR  46           1HG      THR  46  12.848  11.442  -4.930
  321   1HG2  THR  46          1HG2      THR  46  10.365  12.286  -3.655
  322   2HG2  THR  46          2HG2      THR  46  11.499  13.383  -4.442
  323   3HG2  THR  46          3HG2      THR  46  11.064  13.629  -2.750
  324    H    SER  47           H        SER  47  14.687  15.113  -2.775
  325    HA   SER  47           HA       SER  47  14.468  17.008  -1.558
  326   1HB   SER  47          2HB       SER  47  12.063  16.566  -2.278
  327   2HB   SER  47          1HB       SER  47  11.797  15.937  -0.652
  328    HG   SER  47           HG       SER  47  11.434  17.943  -0.166
  329    H    ALA  48           H        ALA  48  15.309  14.331  -0.227
  330    HA   ALA  48           HA       ALA  48  16.045  13.580   1.781
  331   1HB   ALA  48          1HB       ALA  48  16.385  15.123   3.639
  332   2HB   ALA  48          2HB       ALA  48  15.433  16.350   2.806
  333   3HB   ALA  48          3HB       ALA  48  16.967  15.814   2.124
  334    H    ILE  49           H        ILE  49  13.029  15.366   1.843
  335    HA   ILE  49           HA       ILE  49  11.884  13.285   3.588
  336    HB   ILE  49           HB       ILE  49  10.750  16.034   3.025
  337   1HG1  ILE  49          2HG1      ILE  49  12.116  15.012   5.528
  338   2HG1  ILE  49          1HG1      ILE  49  12.827  16.138   4.377
  339   1HG2  ILE  49          1HG2      ILE  49   9.206  15.499   4.868
  340   2HG2  ILE  49          2HG2      ILE  49   9.908  13.884   4.965
  341   3HG2  ILE  49          3HG2      ILE  49   9.044  14.383   3.510
  342   1HD1  ILE  49          1HD1      ILE  49  11.079  17.763   4.894
  343   2HD1  ILE  49          2HD1      ILE  49  11.991  17.298   6.332
  344   3HD1  ILE  49          3HD1      ILE  49  10.379  16.634   6.054
  345    HA   PRO  50           HA       PRO  50  10.500  12.115  -0.523
  346   1HB   PRO  50          2HB       PRO  50   9.268   9.888   0.995
  347   2HB   PRO  50          1HB       PRO  50  10.390   9.846  -0.369
  348   1HG   PRO  50          2HG       PRO  50  11.221   9.232   2.084
  349   2HG   PRO  50          1HG       PRO  50  12.254  10.150   0.970
  350   1HD   PRO  50          2HD       PRO  50  10.590  11.137   3.259
  351   2HD   PRO  50          1HD       PRO  50  12.243  11.592   2.790
  352    H    ASP  51           H        ASP  51   8.980  13.668  -0.952
  353    HA   ASP  51           HA       ASP  51   6.403  13.756   0.248
  354   1HB   ASP  51          2HB       ASP  51   7.694  15.056  -2.104
  355   2HB   ASP  51          1HB       ASP  51   5.935  15.035  -2.049
  356    H    ASN  52           H        ASN  52   7.774  11.588  -1.883
  357    HA   ASN  52           HA       ASN  52   5.612  11.104  -3.657
  358   1HB   ASN  52          2HB       ASN  52   6.814   8.965  -4.150
  359   2HB   ASN  52          1HB       ASN  52   7.815  10.405  -4.315
  360   1HD2  ASN  52          1HD2      ASN  52   7.247   7.494  -2.514
  361   2HD2  ASN  52          2HD2      ASN  52   8.689   7.562  -1.562
  362    H    TYR  53           H        TYR  53   6.149  10.300  -0.401
  363    HA   TYR  53           HA       TYR  53   4.698   7.909  -0.096
  364   1HB   TYR  53          2HB       TYR  53   5.040  10.255   1.788
  365   2HB   TYR  53          1HB       TYR  53   4.365   8.698   2.245
  366    HD1  TYR  53           1HD      TYR  53   6.609   7.538   0.082
  367    HD2  TYR  53           2HD      TYR  53   6.608   9.697   3.747
  368    HE1  TYR  53           1HE      TYR  53   8.858   6.680   0.578
  369    HE2  TYR  53           2HE      TYR  53   8.860   8.846   4.252
  370    HH   TYR  53           HH       TYR  53  10.239   6.746   3.560
  371    H    LYS  54           H        LYS  54   3.647  10.895  -1.179
  372    HA   LYS  54           HA       LYS  54   0.872  10.030  -0.998
  373   1HB   LYS  54          2HB       LYS  54   0.218  12.376  -0.298
  374   2HB   LYS  54          1HB       LYS  54   1.002  11.403   0.938
  375   1HG   LYS  54          2HG       LYS  54   3.116  12.541   0.505
  376   2HG   LYS  54          1HG       LYS  54   2.338  13.515  -0.740
  377   1HD   LYS  54          2HD       LYS  54   0.913  14.553   0.896
  378   2HD   LYS  54          1HD       LYS  54   1.523  13.482   2.161
  379   1HE   LYS  54          2HE       LYS  54   2.578  15.673   2.305
  380   2HE   LYS  54          1HE       LYS  54   3.762  14.435   1.886
  381   1HZ   LYS  54          1HZ       LYS  54   4.220  16.217   0.470
  382   2HZ   LYS  54          2HZ       LYS  54   2.583  16.513   0.141
  383   3HZ   LYS  54          3HZ       LYS  54   3.339  15.145  -0.504
  384    H    ASP  55           H        ASP  55  -0.345  10.755  -2.760
  385    HA   ASP  55           HA       ASP  55   1.061  12.378  -4.756
  386   1HB   ASP  55          2HB       ASP  55   0.108  10.222  -5.543
  387   2HB   ASP  55          1HB       ASP  55  -1.490  10.770  -5.047
  388    H    THR  56           H        THR  56   0.027  14.230  -5.651
  389    HA   THR  56           HA       THR  56  -1.703  15.527  -3.675
  390    HB   THR  56           HB       THR  56  -1.029  17.632  -4.900
  391    HG1  THR  56           1HG      THR  56   1.214  16.839  -6.001
  392   1HG2  THR  56          1HG2      THR  56   1.195  15.965  -3.718
  393   2HG2  THR  56          2HG2      THR  56   0.040  16.934  -2.805
  394   3HG2  THR  56          3HG2      THR  56   1.194  17.722  -3.882
  395    H    THR  57           H        THR  57  -1.969  13.995  -6.626
  396    HA   THR  57           HA       THR  57  -4.030  15.824  -7.628
  397    HB   THR  57           HB       THR  57  -2.955  13.370  -9.015
  398    HG1  THR  57           1HG      THR  57  -1.199  14.723  -8.648
  399   1HG2  THR  57          1HG2      THR  57  -3.720  14.503 -11.036
  400   2HG2  THR  57          2HG2      THR  57  -4.256  15.884 -10.080
  401   3HG2  THR  57          3HG2      THR  57  -5.054  14.322  -9.896
  402    H    ASN  58           H        ASN  58  -3.546  12.324  -7.136
  403    HA   ASN  58           HA       ASN  58  -5.624  11.613  -5.596
  404   1HB   ASN  58          2HB       ASN  58  -7.561  11.065  -6.900
  405   2HB   ASN  58          1HB       ASN  58  -7.165  12.743  -7.230
  406   1HD2  ASN  58          1HD2      ASN  58  -5.020  12.205  -9.057
  407   2HD2  ASN  58          2HD2      ASN  58  -5.730  11.588 -10.507
  408    H    LYS  59           H        LYS  59  -3.043  10.735  -7.142
  409    HA   LYS  59           HA       LYS  59  -3.864   7.958  -7.374
  410   1HB   LYS  59          2HB       LYS  59  -2.335   8.057  -9.612
  411   2HB   LYS  59          1HB       LYS  59  -4.086   8.096  -9.587
  412   1HG   LYS  59          2HG       LYS  59  -3.275   9.774 -11.088
  413   2HG   LYS  59          1HG       LYS  59  -4.013  10.556  -9.694
  414   1HD   LYS  59          2HD       LYS  59  -2.002  11.728 -10.279
  415   2HD   LYS  59          1HD       LYS  59  -1.751  10.896  -8.746
  416   1HE   LYS  59          2HE       LYS  59  -0.570   9.100  -9.941
  417   2HE   LYS  59          1HE       LYS  59  -0.790   9.979 -11.455
  418   1HZ   LYS  59          1HZ       LYS  59   1.416  10.294 -10.314
  419   2HZ   LYS  59          2HZ       LYS  59   0.591  11.160  -9.105
  420   3HZ   LYS  59          3HZ       LYS  59   0.591  11.718 -10.710
  421    H    LYS  60           H        LYS  60  -2.546   7.704  -5.477
  422    HA   LYS  60           HA       LYS  60  -0.035   6.625  -6.418
  423   1HB   LYS  60          2HB       LYS  60   0.530   8.940  -5.589
  424   2HB   LYS  60          1HB       LYS  60   0.030   8.422  -3.989
  425   1HG   LYS  60          2HG       LYS  60   2.226   7.024  -5.520
  426   2HG   LYS  60          1HG       LYS  60   2.516   8.410  -4.467
  427   1HD   LYS  60          2HD       LYS  60   1.215   5.842  -3.596
  428   2HD   LYS  60          1HD       LYS  60   2.920   6.240  -3.368
  429   1HE   LYS  60          2HE       LYS  60   2.290   8.196  -2.057
  430   2HE   LYS  60          1HE       LYS  60   0.586   7.801  -2.289
  431   1HZ   LYS  60          1HZ       LYS  60   2.479   5.906  -1.039
  432   2HZ   LYS  60          2HZ       LYS  60   0.786   5.905  -0.973
  433   3HZ   LYS  60          3HZ       LYS  60   1.665   7.087  -0.135
  434    H    ILE  61           H        ILE  61   0.069   4.622  -5.737
  435    HA   ILE  61           HA       ILE  61  -0.833   4.017  -2.999
  436    HB   ILE  61           HB       ILE  61  -1.350   1.690  -3.782
  437   1HG1  ILE  61          2HG1      ILE  61  -1.091   2.969  -6.513
  438   2HG1  ILE  61          1HG1      ILE  61  -0.168   1.604  -5.884
  439   1HG2  ILE  61          1HG2      ILE  61  -3.122   3.241  -3.302
  440   2HG2  ILE  61          2HG2      ILE  61  -3.555   2.260  -4.702
  441   3HG2  ILE  61          3HG2      ILE  61  -3.009   3.923  -4.923
  442   1HD1  ILE  61          1HD1      ILE  61  -3.120   1.603  -6.464
  443   2HD1  ILE  61          2HD1      ILE  61  -2.176   0.241  -5.858
  444   3HD1  ILE  61          3HD1      ILE  61  -1.859   0.885  -7.469
  445    H    THR  62           H        THR  62   0.811   3.311  -1.763
  446    HA   THR  62           HA       THR  62   3.294   2.549  -3.067
  447    HB   THR  62           HB       THR  62   2.701   2.664  -0.101
  448    HG1  THR  62           1HG      THR  62   4.016   4.740  -0.465
  449   1HG2  THR  62          1HG2      THR  62   4.679   1.364  -0.738
  450   2HG2  THR  62          2HG2      THR  62   5.123   2.843   0.112
  451   3HG2  THR  62          3HG2      THR  62   5.294   2.747  -1.641
  452    H    ASN  63           H        ASN  63   3.458   0.552  -3.757
  453    HA   ASN  63           HA       ASN  63   3.386  -1.775  -2.318
  454   1HB   ASN  63          2HB       ASN  63   1.034  -1.472  -1.862
  455   2HB   ASN  63          1HB       ASN  63   0.695  -1.183  -3.565
  456   1HD2  ASN  63          1HD2      ASN  63   1.463  -3.562  -1.161
  457   2HD2  ASN  63          2HD2      ASN  63   1.052  -4.947  -2.112
  458    HA   PRO  64           HA       PRO  64   3.037  -3.052  -6.835
  459   1HB   PRO  64          2HB       PRO  64   1.852  -1.277  -8.628
  460   2HB   PRO  64          1HB       PRO  64   1.012  -2.530  -7.714
  461   1HG   PRO  64          2HG       PRO  64   0.729   0.279  -7.442
  462   2HG   PRO  64          1HG       PRO  64   0.009  -0.970  -6.415
  463   1HD   PRO  64          2HD       PRO  64   2.455   0.659  -5.999
  464   2HD   PRO  64          1HD       PRO  64   1.324  -0.009  -4.793
  465    H    PHE  65           H        PHE  65   3.767  -2.549  -9.218
  466    HA   PHE  65           HA       PHE  65   5.786  -0.440  -9.313
  467   1HB   PHE  65          2HB       PHE  65   7.492  -2.152 -10.092
  468   2HB   PHE  65          1HB       PHE  65   7.097  -2.186  -8.378
  469    HD1  PHE  65           1HD      PHE  65   6.025  -4.074  -7.390
  470    HD2  PHE  65           2HD      PHE  65   6.684  -3.925 -11.592
  471    HE1  PHE  65           1HE      PHE  65   5.496  -6.470  -7.555
  472    HE2  PHE  65           2HE      PHE  65   6.152  -6.319 -11.764
  473    HZ   PHE  65           HZ       PHE  65   5.558  -7.596  -9.743
  474    H    GLY  66           H        GLY  66   3.282  -0.955 -10.706
  475   1HA   GLY  66          2HA       GLY  66   4.025  -2.047 -13.303
  476   2HA   GLY  66          1HA       GLY  66   2.413  -1.581 -12.783
  477    H    GLY  67           H        GLY  67   4.160   0.965 -11.903
  478   1HA   GLY  67          2HA       GLY  67   4.073   2.266 -14.532
  479   2HA   GLY  67          1HA       GLY  67   3.099   2.928 -13.224
  480    H    GLU  68           H        GLU  68   3.999   4.564 -12.195
  481    HA   GLU  68           HA       GLU  68   6.876   4.956 -12.306
  482   1HB   GLU  68          2HB       GLU  68   5.352   6.860 -12.637
  483   2HB   GLU  68          1HB       GLU  68   4.667   6.588 -11.039
  484   1HG   GLU  68          2HG       GLU  68   6.739   7.191  -9.991
  485   2HG   GLU  68          1HG       GLU  68   7.545   7.303 -11.556
  486    H    LEU  69           H        LEU  69   7.861   3.540 -10.981
  487    HA   LEU  69           HA       LEU  69   6.844   3.207  -8.254
  488   1HB   LEU  69          2HB       LEU  69   8.215   1.189  -8.142
  489   2HB   LEU  69          1HB       LEU  69   7.092   1.140  -9.486
  490    HG   LEU  69           HG       LEU  69   9.788   2.145 -10.151
  491   1HD1  LEU  69          1HD1      LEU  69   9.334  -0.750  -9.442
  492   2HD1  LEU  69          2HD1      LEU  69  10.338   0.387  -8.541
  493   3HD1  LEU  69          3HD1      LEU  69  10.784  -0.073 -10.184
  494   1HD2  LEU  69          1HD2      LEU  69   7.945   0.094 -11.382
  495   2HD2  LEU  69          2HD2      LEU  69   9.439   0.696 -12.100
  496   3HD2  LEU  69          3HD2      LEU  69   8.077   1.788 -11.855
  497    H    ASN  70           H        ASN  70   7.986   3.662  -6.493
  498    HA   ASN  70           HA       ASN  70  10.848   4.307  -6.773
  499   1HB   ASN  70          2HB       ASN  70   9.561   6.331  -6.174
  500   2HB   ASN  70          1HB       ASN  70   8.881   5.487  -4.786
  501   1HD2  ASN  70          1HD2      ASN  70   9.728   6.954  -3.313
  502   2HD2  ASN  70          2HD2      ASN  70  11.415   7.032  -2.951
  503    H    VAL  71           H        VAL  71  12.133   2.939  -5.656
  504    HA   VAL  71           HA       VAL  71  10.819   0.864  -4.104
  505    HB   VAL  71           HB       VAL  71  13.017  -0.268  -4.105
  506   1HG1  VAL  71          1HG1      VAL  71  11.412  -0.691  -5.889
  507   2HG1  VAL  71          2HG1      VAL  71  13.068  -0.777  -6.494
  508   3HG1  VAL  71          3HG1      VAL  71  12.084   0.649  -6.820
  509   1HG2  VAL  71          1HG2      VAL  71  14.838   0.617  -5.492
  510   2HG2  VAL  71          2HG2      VAL  71  14.473   1.684  -4.137
  511   3HG2  VAL  71          3HG2      VAL  71  13.912   2.094  -5.756
  512    H    GLY  72           H        GLY  72  11.073   0.452  -1.966
  513   1HA   GLY  72          2HA       GLY  72  13.158   1.747  -0.440
  514   2HA   GLY  72          1HA       GLY  72  11.534   2.321  -0.088
  515    HA   PRO  73           HA       PRO  73  12.181  -1.776   2.122
  516   1HB   PRO  73          2HB       PRO  73  14.163  -1.531   3.870
  517   2HB   PRO  73          1HB       PRO  73  14.505  -1.870   2.169
  518   1HG   PRO  73          2HG       PRO  73  14.791   0.668   3.689
  519   2HG   PRO  73          1HG       PRO  73  15.767   0.042   2.352
  520   1HD   PRO  73          2HD       PRO  73  13.675   1.944   2.188
  521   2HD   PRO  73          1HD       PRO  73  14.500   1.147   0.833
  522    H    ALA  74           H        ALA  74  11.427  -2.304   4.231
  523    HA   ALA  74           HA       ALA  74  10.406   0.006   5.723
  524   1HB   ALA  74          1HB       ALA  74   8.752  -1.621   4.933
  525   2HB   ALA  74          2HB       ALA  74   8.796  -1.527   6.694
  526   3HB   ALA  74          3HB       ALA  74   9.561  -2.881   5.864
  527    H    ASN  75           H        ASN  75   9.994  -0.842   8.155
  528    HA   ASN  75           HA       ASN  75  12.439  -0.654   9.456
  529   1HB   ASN  75          2HB       ASN  75  10.450   0.016  10.582
  530   2HB   ASN  75          1HB       ASN  75   9.730  -1.578  10.409
  531   1HD2  ASN  75          1HD2      ASN  75   9.343  -1.696  12.601
  532   2HD2  ASN  75          2HD2      ASN  75  10.608  -2.018  13.743
  533    H    ASN  76           H        ASN  76  10.343  -3.569   9.590
  534    HA   ASN  76           HA       ASN  76  12.775  -5.199   9.542
  535   1HB   ASN  76          2HB       ASN  76  12.025  -4.703  11.942
  536   2HB   ASN  76          1HB       ASN  76  10.621  -5.708  11.591
  537   1HD2  ASN  76          1HD2      ASN  76  13.891  -6.198  10.403
  538   2HD2  ASN  76          2HD2      ASN  76  14.169  -7.697  11.228
  539    H    ASN  77           H        ASN  77  12.566  -6.966   8.359
  540    HA   ASN  77           HA       ASN  77  10.716  -7.223   6.409
  541   1HB   ASN  77          2HB       ASN  77  12.863  -8.386   6.412
  542   2HB   ASN  77          1HB       ASN  77  12.292  -9.462   7.683
  543   1HD2  ASN  77          1HD2      ASN  77  12.051  -8.628   4.316
  544   2HD2  ASN  77          2HD2      ASN  77  11.248 -10.071   3.813
  545    H    THR  78           H        THR  78  10.601  -9.024   9.476
  546    HA   THR  78           HA       THR  78   8.436 -10.666   8.827
  547    HB   THR  78           HB       THR  78   8.169 -10.796  11.377
  548    HG1  THR  78           1HG      THR  78  10.538  -9.912  12.053
  549   1HG2  THR  78          1HG2      THR  78   9.433 -12.435  10.070
  550   2HG2  THR  78          2HG2      THR  78  10.227 -12.113  11.611
  551   3HG2  THR  78          3HG2      THR  78  10.855 -11.394  10.127
  552    H    ALA  79           H        ALA  79   8.532  -7.512  10.424
  553    HA   ALA  79           HA       ALA  79   5.693  -7.391  10.819
  554   1HB   ALA  79          1HB       ALA  79   6.095  -5.116  11.573
  555   2HB   ALA  79          2HB       ALA  79   7.742  -5.179  10.949
  556   3HB   ALA  79          3HB       ALA  79   7.271  -6.212  12.298
  557    H    PHE  80           H        PHE  80   7.994  -5.721   8.689
  558    HA   PHE  80           HA       PHE  80   6.028  -5.622   6.553
  559   1HB   PHE  80          2HB       PHE  80   7.355  -3.081   7.533
  560   2HB   PHE  80          1HB       PHE  80   6.267  -3.227   6.161
  561    HD1  PHE  80           1HD      PHE  80   6.546  -2.810   9.726
  562    HD2  PHE  80           2HD      PHE  80   3.868  -3.759   6.557
  563    HE1  PHE  80           1HE      PHE  80   4.639  -2.360  11.211
  564    HE2  PHE  80           2HE      PHE  80   1.956  -3.311   8.038
  565    HZ   PHE  80           HZ       PHE  80   2.341  -2.613  10.368
  566    H    GLY  81           H        GLY  81   7.045  -5.830   4.588
  567   1HA   GLY  81          2HA       GLY  81   9.902  -6.376   4.798
  568   2HA   GLY  81          1HA       GLY  81   8.847  -6.864   3.482
  569    H    TYR  82           H        TYR  82   8.015  -5.035   2.125
  570    HA   TYR  82           HA       TYR  82  10.053  -2.957   1.763
  571   1HB   TYR  82          2HB       TYR  82  10.283  -3.469  -0.589
  572   2HB   TYR  82          1HB       TYR  82  10.598  -4.947   0.317
  573    HD1  TYR  82           1HD      TYR  82   8.824  -6.721   0.419
  574    HD2  TYR  82           2HD      TYR  82   8.492  -3.337  -2.140
  575    HE1  TYR  82           1HE      TYR  82   7.077  -7.871  -0.872
  576    HE2  TYR  82           2HE      TYR  82   6.747  -4.481  -3.435
  577    HH   TYR  82           HH       TYR  82   5.879  -6.617  -3.870
  578    H    TYR  83           H        TYR  83   9.326  -1.228   0.325
  579    HA   TYR  83           HA       TYR  83   6.494  -1.314  -0.375
  580   1HB   TYR  83          2HB       TYR  83   6.042   0.886   0.483
  581   2HB   TYR  83          1HB       TYR  83   6.710  -0.081   1.788
  582    HD1  TYR  83           1HD      TYR  83   8.843   0.474   2.773
  583    HD2  TYR  83           2HD      TYR  83   7.340   2.711  -0.518
  584    HE1  TYR  83           1HE      TYR  83  10.522   2.218   3.191
  585    HE2  TYR  83           2HE      TYR  83   9.019   4.455  -0.114
  586    HH   TYR  83           HH       TYR  83  11.684   4.008   1.837
  587    H    LEU  84           H        LEU  84   6.108  -0.560  -2.365
  588    HA   LEU  84           HA       LEU  84   8.199   1.080  -3.629
  589   1HB   LEU  84          2HB       LEU  84   6.602  -1.194  -4.692
  590   2HB   LEU  84          1HB       LEU  84   6.946   0.131  -5.786
  591    HG   LEU  84           HG       LEU  84   9.381  -0.183  -5.318
  592   1HD1  LEU  84          1HD1      LEU  84   8.451  -2.682  -3.918
  593   2HD1  LEU  84          2HD1      LEU  84   9.206  -1.284  -3.155
  594   3HD1  LEU  84          3HD1      LEU  84  10.122  -2.266  -4.297
  595   1HD2  LEU  84          1HD2      LEU  84   7.897  -2.557  -6.430
  596   2HD2  LEU  84          2HD2      LEU  84   9.608  -2.208  -6.681
  597   3HD2  LEU  84          3HD2      LEU  84   8.381  -1.110  -7.317
  598    H    THR  85           H        THR  85   7.572   3.093  -4.003
  599    HA   THR  85           HA       THR  85   4.814   3.794  -3.609
  600    HB   THR  85           HB       THR  85   7.182   5.556  -4.271
  601    HG1  THR  85           1HG      THR  85   6.034   5.097  -1.701
  602   1HG2  THR  85          1HG2      THR  85   5.817   7.344  -3.348
  603   2HG2  THR  85          2HG2      THR  85   4.500   6.206  -3.065
  604   3HG2  THR  85          3HG2      THR  85   5.005   6.579  -4.713
  605    H    LEU  86           H        LEU  86   3.604   3.250  -5.314
  606    HA   LEU  86           HA       LEU  86   4.497   3.977  -8.014
  607   1HB   LEU  86          2HB       LEU  86   3.531   1.632  -7.155
  608   2HB   LEU  86          1HB       LEU  86   2.008   2.435  -7.465
  609    HG   LEU  86           HG       LEU  86   2.592   1.070  -9.351
  610   1HD1  LEU  86          1HD1      LEU  86   1.440   3.109  -9.894
  611   2HD1  LEU  86          2HD1      LEU  86   2.626   2.747 -11.149
  612   3HD1  LEU  86          3HD1      LEU  86   2.965   3.993  -9.949
  613   1HD2  LEU  86          1HD2      LEU  86   4.608   1.461 -10.660
  614   2HD2  LEU  86          2HD2      LEU  86   4.987   0.962  -9.012
  615   3HD2  LEU  86          3HD2      LEU  86   5.143   2.655  -9.479
  616    H    THR  87           H        THR  87   3.650   5.867  -8.826
  617    HA   THR  87           HA       THR  87   1.235   6.918  -7.632
  618    HB   THR  87           HB       THR  87   1.438   8.659  -9.476
  619    HG1  THR  87           1HG      THR  87   3.987   8.384 -10.058
  620   1HG2  THR  87          1HG2      THR  87   3.305   9.813  -8.403
  621   2HG2  THR  87          2HG2      THR  87   3.811   8.305  -7.642
  622   3HG2  THR  87          3HG2      THR  87   2.271   9.042  -7.201
  623    H    ARG  88           H        ARG  88  -0.724   6.424  -8.256
  624    HA   ARG  88           HA       ARG  88  -1.867   5.978 -10.662
  625   1HB   ARG  88          2HB       ARG  88  -0.123   4.141 -10.957
  626   2HB   ARG  88          1HB       ARG  88  -0.889   3.308  -9.613
  627   1HG   ARG  88          2HG       ARG  88  -2.891   2.978 -10.828
  628   2HG   ARG  88          1HG       ARG  88  -2.376   4.081 -12.105
  629   1HD   ARG  88          2HD       ARG  88  -2.087   1.873 -12.927
  630   2HD   ARG  88          1HD       ARG  88  -0.483   2.511 -12.571
  631    HE   ARG  88           HE       ARG  88  -1.902   0.703 -10.717
  632   1HH1  ARG  88          1HH1      ARG  88   0.964   1.656 -12.493
  633   2HH1  ARG  88          2HH1      ARG  88   1.916   0.329 -11.921
  634   1HH2  ARG  88          1HH2      ARG  88  -0.667  -1.068  -9.970
  635   2HH2  ARG  88          2HH2      ARG  88   0.972  -1.263 -10.518
  636    H    LEU  89           H        LEU  89  -3.986   5.943 -10.222
  637    HA   LEU  89           HA       LEU  89  -5.186   4.198  -8.347
  638   1HB   LEU  89          2HB       LEU  89  -4.327   6.775  -7.324
  639   2HB   LEU  89          1HB       LEU  89  -6.063   6.578  -7.191
  640    HG   LEU  89           HG       LEU  89  -3.951   4.777  -6.006
  641   1HD1  LEU  89          1HD1      LEU  89  -4.879   5.529  -3.881
  642   2HD1  LEU  89          2HD1      LEU  89  -6.016   6.571  -4.737
  643   3HD1  LEU  89          3HD1      LEU  89  -4.283   6.892  -4.829
  644   1HD2  LEU  89          1HD2      LEU  89  -5.800   3.524  -5.026
  645   2HD2  LEU  89          2HD2      LEU  89  -5.868   3.470  -6.787
  646   3HD2  LEU  89          3HD2      LEU  89  -6.957   4.531  -5.895
  647    H    ASP  90           H        ASP  90  -7.501   4.916  -7.917
  648    HA   ASP  90           HA       ASP  90  -8.779   6.724  -9.694
  649   1HB   ASP  90          2HB       ASP  90  -8.354   4.884 -11.297
  650   2HB   ASP  90          1HB       ASP  90  -9.160   3.756 -10.211
  651    H    LYS  91           H        LYS  91 -11.090   6.836  -9.192
  652    HA   LYS  91           HA       LYS  91 -11.628   6.492  -6.468
  653   1HB   LYS  91          2HB       LYS  91 -12.773   8.111  -7.981
  654   2HB   LYS  91          1HB       LYS  91 -13.646   6.771  -8.705
  655   1HG   LYS  91          2HG       LYS  91 -13.825   7.191  -5.761
  656   2HG   LYS  91          1HG       LYS  91 -14.742   8.239  -6.844
  657   1HD   LYS  91          2HD       LYS  91 -15.906   6.373  -7.778
  658   2HD   LYS  91          1HD       LYS  91 -14.853   5.231  -6.940
  659   1HE   LYS  91          2HE       LYS  91 -15.710   6.011  -4.793
  660   2HE   LYS  91          1HE       LYS  91 -16.760   7.158  -5.628
  661   1HZ   LYS  91          1HZ       LYS  91 -16.896   4.249  -6.149
  662   2HZ   LYS  91          2HZ       LYS  91 -18.053   5.436  -6.506
  663   3HZ   LYS  91          3HZ       LYS  91 -17.778   4.974  -4.897
  664    H    ALA  92           H        ALA  92 -12.218   4.378  -9.218
  665    HA   ALA  92           HA       ALA  92 -13.933   2.557  -7.862
  666   1HB   ALA  92          1HB       ALA  92 -13.810   2.669 -10.306
  667   2HB   ALA  92          2HB       ALA  92 -13.496   1.039  -9.709
  668   3HB   ALA  92          3HB       ALA  92 -12.157   2.054 -10.247
  669    H    ALA  93           H        ALA  93 -10.445   2.842  -8.165
  670    HA   ALA  93           HA       ALA  93  -9.823   0.258  -7.145
  671   1HB   ALA  93          1HB       ALA  93  -8.233   1.555  -8.487
  672   2HB   ALA  93          2HB       ALA  93  -7.544   1.100  -6.930
  673   3HB   ALA  93          3HB       ALA  93  -8.115   2.748  -7.194
  674    H    CYS  94           H        CYS  94 -10.361   3.412  -5.736
  675    HA   CYS  94           HA       CYS  94  -9.562   2.994  -3.109
  676   1HB   CYS  94          2HB       CYS  94 -10.233   5.182  -3.868
  677   2HB   CYS  94          1HB       CYS  94 -11.852   4.613  -4.249
  678    H    VAL  95           H        VAL  95 -12.720   2.326  -4.613
  679    HA   VAL  95           HA       VAL  95 -13.803   1.139  -2.253
  680    HB   VAL  95           HB       VAL  95 -14.804   0.859  -5.089
  681   1HG1  VAL  95          1HG1      VAL  95 -16.962   0.401  -4.070
  682   2HG1  VAL  95          2HG1      VAL  95 -16.258   0.571  -2.461
  683   3HG1  VAL  95          3HG1      VAL  95 -15.753  -0.756  -3.507
  684   1HG2  VAL  95          1HG2      VAL  95 -14.590   3.209  -4.496
  685   2HG2  VAL  95          2HG2      VAL  95 -15.519   2.933  -3.022
  686   3HG2  VAL  95          3HG2      VAL  95 -16.285   2.736  -4.597
  687    H    SER  96           H        SER  96 -12.135  -0.023  -5.078
  688    HA   SER  96           HA       SER  96 -12.865  -2.710  -4.998
  689   1HB   SER  96          2HB       SER  96 -11.610  -1.441  -6.815
  690   2HB   SER  96          1HB       SER  96 -10.155  -1.709  -5.853
  691    HG   SER  96           HG       SER  96 -11.878  -3.821  -6.623
  692    H    LEU  97           H        LEU  97 -10.128  -1.056  -3.451
  693    HA   LEU  97           HA       LEU  97  -9.069  -3.452  -2.312
  694   1HB   LEU  97          2HB       LEU  97  -8.553  -0.542  -1.720
  695   2HB   LEU  97          1HB       LEU  97  -7.658  -1.864  -0.992
  696    HG   LEU  97           HG       LEU  97  -7.795  -1.421  -3.976
  697   1HD1  LEU  97          1HD1      LEU  97  -5.676  -0.521  -2.028
  698   2HD1  LEU  97          2HD1      LEU  97  -6.758   0.521  -2.954
  699   3HD1  LEU  97          3HD1      LEU  97  -5.552  -0.459  -3.785
  700   1HD2  LEU  97          1HD2      LEU  97  -5.952  -3.067  -2.247
  701   2HD2  LEU  97          2HD2      LEU  97  -5.832  -2.879  -3.996
  702   3HD2  LEU  97          3HD2      LEU  97  -7.233  -3.686  -3.292
  703    H    ALA  98           H        ALA  98 -11.338  -1.020  -1.292
  704    HA   ALA  98           HA       ALA  98 -11.376  -1.853   1.457
  705   1HB   ALA  98          1HB       ALA  98 -13.254  -0.314   1.675
  706   2HB   ALA  98          2HB       ALA  98 -13.317  -0.130  -0.077
  707   3HB   ALA  98          3HB       ALA  98 -11.911   0.443   0.820
  708    H    THR  99           H        THR  99 -12.922  -2.829  -1.460
  709    HA   THR  99           HA       THR  99 -14.817  -4.496   0.023
  710    HB   THR  99           HB       THR  99 -15.680  -5.113  -2.271
  711    HG1  THR  99           1HG      THR  99 -14.092  -2.892  -3.095
  712   1HG2  THR  99          1HG2      THR  99 -16.898  -3.016  -2.582
  713   2HG2  THR  99          2HG2      THR  99 -15.749  -2.186  -1.534
  714   3HG2  THR  99          3HG2      THR  99 -16.797  -3.442  -0.875
  715    H    LEU 100           H        LEU 100 -11.722  -4.649  -0.784
  716    HA   LEU 100           HA       LEU 100 -11.685  -7.486  -1.476
  717   1HB   LEU 100          2HB       LEU 100 -10.006  -5.449  -2.156
  718   2HB   LEU 100          1HB       LEU 100  -9.185  -6.065  -0.738
  719    HG   LEU 100           HG       LEU 100  -9.127  -8.323  -1.815
  720   1HD1  LEU 100          1HD1      LEU 100 -11.035  -8.034  -3.309
  721   2HD1  LEU 100          2HD1      LEU 100  -9.580  -8.475  -4.203
  722   3HD1  LEU 100          3HD1      LEU 100 -10.146  -6.805  -4.210
  723   1HD2  LEU 100          1HD2      LEU 100  -7.869  -6.087  -3.401
  724   2HD2  LEU 100          2HD2      LEU 100  -7.352  -7.773  -3.385
  725   3HD2  LEU 100          3HD2      LEU 100  -7.215  -6.796  -1.924
  726    H    ASN 101           H        ASN 101  -9.659  -8.497   0.053
  727    HA   ASN 101           HA       ASN 101 -10.265  -7.640   2.791
  728   1HB   ASN 101          2HB       ASN 101 -11.145  -9.893   2.479
  729   2HB   ASN 101          1HB       ASN 101  -9.564 -10.452   1.930
  730   1HD2  ASN 101          1HD2      ASN 101 -11.321  -9.123   4.663
  731   2HD2  ASN 101          2HD2      ASN 101 -10.276  -9.759   5.892
  732    H    LEU 102           H        LEU 102  -8.650  -6.216   2.928
  733    HA   LEU 102           HA       LEU 102  -5.920  -7.161   2.497
  734   1HB   LEU 102          2HB       LEU 102  -6.936  -4.404   3.209
  735   2HB   LEU 102          1HB       LEU 102  -5.268  -4.819   2.856
  736    HG   LEU 102           HG       LEU 102  -7.563  -5.011   0.904
  737   1HD1  LEU 102          1HD1      LEU 102  -6.426  -3.138  -0.223
  738   2HD1  LEU 102          2HD1      LEU 102  -5.316  -3.023   1.143
  739   3HD1  LEU 102          3HD1      LEU 102  -7.035  -2.710   1.376
  740   1HD2  LEU 102          1HD2      LEU 102  -4.604  -5.435   0.516
  741   2HD2  LEU 102          2HD2      LEU 102  -5.822  -5.431  -0.759
  742   3HD2  LEU 102          3HD2      LEU 102  -5.847  -6.685   0.479
  743    H    GLY 103           H        GLY 103  -6.331  -8.659   4.278
  744   1HA   GLY 103          2HA       GLY 103  -5.147  -7.535   6.685
  745   2HA   GLY 103          1HA       GLY 103  -6.712  -8.319   6.890
  746    H    THR 104           H        THR 104  -6.736 -10.502   5.512
  747    HA   THR 104           HA       THR 104  -4.845 -12.252   6.691
  748    HB   THR 104           HB       THR 104  -6.698 -12.761   4.352
  749    HG1  THR 104           1HG      THR 104  -7.074 -13.229   7.150
  750   1HG2  THR 104          1HG2      THR 104  -4.956 -14.467   4.551
  751   2HG2  THR 104          2HG2      THR 104  -6.531 -15.120   5.011
  752   3HG2  THR 104          3HG2      THR 104  -5.356 -14.686   6.256
  753    H    SER 105           H        SER 105  -5.146 -10.764   3.513
  754    HA   SER 105           HA       SER 105  -2.466 -11.771   2.847
  755   1HB   SER 105          2HB       SER 105  -4.722 -11.043   0.964
  756   2HB   SER 105          1HB       SER 105  -3.125 -11.619   0.483
  757    HG   SER 105           HG       SER 105  -4.021 -13.509   0.627
  758    H    ALA 106           H        ALA 106  -2.740  -9.492   4.397
  759    HA   ALA 106           HA       ALA 106  -1.251  -7.668   2.702
  760   1HB   ALA 106          1HB       ALA 106  -2.512  -5.688   3.469
  761   2HB   ALA 106          2HB       ALA 106  -3.682  -6.757   4.244
  762   3HB   ALA 106          3HB       ALA 106  -3.501  -6.772   2.491
  763    H    LYS 107           H        LYS 107  -0.061  -6.051   4.054
  764    HA   LYS 107           HA       LYS 107   0.491  -7.209   6.684
  765   1HB   LYS 107          2HB       LYS 107   2.046  -5.017   5.310
  766   2HB   LYS 107          1HB       LYS 107   2.537  -5.942   6.710
  767   1HG   LYS 107          2HG       LYS 107   2.135  -7.122   3.978
  768   2HG   LYS 107          1HG       LYS 107   3.683  -6.565   4.609
  769   1HD   LYS 107          2HD       LYS 107   1.975  -8.722   5.844
  770   2HD   LYS 107          1HD       LYS 107   3.393  -8.990   4.831
  771   1HE   LYS 107          2HE       LYS 107   4.821  -7.929   6.448
  772   2HE   LYS 107          1HE       LYS 107   3.435  -7.450   7.423
  773   1HZ   LYS 107          1HZ       LYS 107   4.348 -10.238   6.935
  774   2HZ   LYS 107          2HZ       LYS 107   2.969  -9.805   7.818
  775   3HZ   LYS 107          3HZ       LYS 107   4.507  -9.365   8.377
  776    H    GLY 108           H        GLY 108  -0.945  -4.534   5.106
  777   1HA   GLY 108          2HA       GLY 108  -2.403  -3.540   7.180
  778   2HA   GLY 108          1HA       GLY 108  -0.873  -2.688   7.297
  779    H    TYR 109           H        TYR 109  -3.489  -1.574   6.691
  780    HA   TYR 109           HA       TYR 109  -2.879  -0.512   4.008
  781   1HB   TYR 109          2HB       TYR 109  -4.690  -2.228   3.947
  782   2HB   TYR 109          1HB       TYR 109  -5.626  -1.229   5.051
  783    HD1  TYR 109           1HD      TYR 109  -3.816  -0.796   1.817
  784    HD2  TYR 109           2HD      TYR 109  -7.311  -0.018   4.088
  785    HE1  TYR 109           1HE      TYR 109  -4.809   0.357  -0.123
  786    HE2  TYR 109           2HE      TYR 109  -8.321   1.142   2.170
  787    HH   TYR 109           HH       TYR 109  -7.043   0.955  -0.969
  788    H    GLY 110           H        GLY 110  -2.721   1.684   4.021
  789   1HA   GLY 110          2HA       GLY 110  -4.127   3.149   6.162
  790   2HA   GLY 110          1HA       GLY 110  -2.396   3.352   5.951
  791    H    VAL 111           H        VAL 111  -5.354   4.644   5.247
  792    HA   VAL 111           HA       VAL 111  -4.589   5.765   2.654
  793    HB   VAL 111           HB       VAL 111  -7.180   6.112   4.182
  794   1HG1  VAL 111          1HG1      VAL 111  -6.498   6.712   1.308
  795   2HG1  VAL 111          2HG1      VAL 111  -6.742   7.903   2.585
  796   3HG1  VAL 111          3HG1      VAL 111  -8.085   6.890   2.056
  797   1HG2  VAL 111          1HG2      VAL 111  -8.125   4.489   2.615
  798   2HG2  VAL 111          2HG2      VAL 111  -6.839   3.779   3.590
  799   3HG2  VAL 111          3HG2      VAL 111  -6.525   4.234   1.916
  800    H    ASN 112           H        ASN 112  -4.003   7.845   2.362
  801    HA   ASN 112           HA       ASN 112  -3.295   9.948   2.807
  802   1HB   ASN 112          2HB       ASN 112  -5.509   9.715   4.802
  803   2HB   ASN 112          1HB       ASN 112  -4.399  11.074   4.928
  804   1HD2  ASN 112          1HD2      ASN 112  -7.031   9.709   3.208
  805   2HD2  ASN 112          2HD2      ASN 112  -7.239  10.997   2.080
  806    H    ILE 113           H        ILE 113  -2.053   7.568   4.045
  807    HA   ILE 113           HA       ILE 113  -0.722   8.848   6.323
  808    HB   ILE 113           HB       ILE 113  -0.493   5.987   5.365
  809   1HG1  ILE 113          2HG1      ILE 113  -2.746   6.465   6.209
  810   2HG1  ILE 113          1HG1      ILE 113  -1.874   5.403   7.307
  811   1HG2  ILE 113          1HG2      ILE 113   1.487   6.739   6.554
  812   2HG2  ILE 113          2HG2      ILE 113   0.581   5.587   7.536
  813   3HG2  ILE 113          3HG2      ILE 113   0.488   7.311   7.889
  814   1HD1  ILE 113          1HD1      ILE 113  -1.434   7.282   8.788
  815   2HD1  ILE 113          2HD1      ILE 113  -3.164   7.091   8.501
  816   3HD1  ILE 113          3HD1      ILE 113  -2.270   8.367   7.676
  817    H    SER 114           H        SER 114   1.474   9.226   6.305
  818    HA   SER 114           HA       SER 114   2.935   8.616   3.833
  819   1HB   SER 114          2HB       SER 114   4.039  10.944   4.222
  820   2HB   SER 114          1HB       SER 114   2.443  10.885   3.475
  821    HG   SER 114           HG       SER 114   2.441  10.987   6.236
  822    H    GLY 115           H        GLY 115   4.747   7.513   4.278
  823   1HA   GLY 115          2HA       GLY 115   6.866   7.686   5.661
  824   2HA   GLY 115          1HA       GLY 115   5.781   7.688   7.046
  825    H    GLU 116           H        GLU 116   6.038   5.797   4.059
  826    HA   GLU 116           HA       GLU 116   5.009   3.435   4.994
  827   1HB   GLU 116          2HB       GLU 116   7.016   4.007   2.828
  828   2HB   GLU 116          1HB       GLU 116   6.353   2.407   3.106
  829   1HG   GLU 116          2HG       GLU 116   4.954   3.143   1.489
  830   2HG   GLU 116          1HG       GLU 116   4.070   3.682   2.914
  831    H    ASN 117           H        ASN 117   8.245   4.661   5.400
  832    HA   ASN 117           HA       ASN 117   9.647   2.336   5.994
  833   1HB   ASN 117          2HB       ASN 117  10.001   5.021   7.343
  834   2HB   ASN 117          1HB       ASN 117  11.201   3.739   7.236
  835   1HD2  ASN 117          1HD2      ASN 117  12.253   3.374   5.285
  836   2HD2  ASN 117          2HD2      ASN 117  12.224   4.528   4.002
  837    H    ASN 118           H        ASN 118   7.509   4.265   8.009
  838    HA   ASN 118           HA       ASN 118   7.253   2.023   9.836
  839   1HB   ASN 118          2HB       ASN 118   9.060   3.444  10.816
  840   2HB   ASN 118          1HB       ASN 118   7.920   4.783  10.890
  841   1HD2  ASN 118          1HD2      ASN 118   6.291   4.759  12.415
  842   2HD2  ASN 118          2HD2      ASN 118   6.286   3.665  13.759
  843    H    ILE 119           H        ILE 119   5.278   1.929   8.770
  844    HA   ILE 119           HA       ILE 119   3.367   3.924   8.510
  845    HB   ILE 119           HB       ILE 119   3.263   1.809   7.322
  846   1HG1  ILE 119          2HG1      ILE 119   0.836   1.189   7.788
  847   2HG1  ILE 119          1HG1      ILE 119   0.879   2.387   9.078
  848   1HG2  ILE 119          1HG2      ILE 119   4.122   0.336   9.008
  849   2HG2  ILE 119          2HG2      ILE 119   2.555  -0.254   8.450
  850   3HG2  ILE 119          3HG2      ILE 119   2.684   0.576  10.001
  851   1HD1  ILE 119          1HD1      ILE 119   1.433   4.113   7.443
  852   2HD1  ILE 119          2HD1      ILE 119  -0.092   3.311   7.066
  853   3HD1  ILE 119          3HD1      ILE 119   1.365   2.910   6.157
  854    H    THR 120           H        THR 120   1.483   4.429   9.672
  855    HA   THR 120           HA       THR 120   1.777   4.591  12.487
  856    HB   THR 120           HB       THR 120  -0.909   5.088  11.384
  857    HG1  THR 120           1HG      THR 120   0.658   7.094  10.503
  858   1HG2  THR 120          1HG2      THR 120  -0.208   5.949  13.558
  859   2HG2  THR 120          2HG2      THR 120  -0.538   7.280  12.448
  860   3HG2  THR 120          3HG2      THR 120   1.126   6.816  12.799
  861    H    SER 121           H        SER 121  -0.140   3.990  13.967
  862    HA   SER 121           HA       SER 121  -0.346   1.191  14.073
  863   1HB   SER 121          2HB       SER 121  -2.098   3.205  15.496
  864   2HB   SER 121          1HB       SER 121  -1.789   1.541  15.986
  865    HG   SER 121           HG       SER 121  -0.201   3.808  16.234
  866    H    PHE 122           H        PHE 122  -2.124  -0.207  13.798
  867    HA   PHE 122           HA       PHE 122  -3.905   0.713  11.656
  868   1HB   PHE 122          2HB       PHE 122  -3.129  -2.086  12.489
  869   2HB   PHE 122          1HB       PHE 122  -4.167  -1.680  11.129
  870    HD1  PHE 122           1HD      PHE 122  -3.180  -0.328   9.233
  871    HD2  PHE 122           2HD      PHE 122  -0.823  -2.152  12.265
  872    HE1  PHE 122           1HE      PHE 122  -1.203  -0.193   7.771
  873    HE2  PHE 122           2HE      PHE 122   1.155  -2.016  10.816
  874    HZ   PHE 122           HZ       PHE 122   0.966  -1.034   8.568
  875    H    GLY 123           H        GLY 123  -5.986   0.993  12.017
  876   1HA   GLY 123          2HA       GLY 123  -7.265  -0.465  14.246
  877   2HA   GLY 123          1HA       GLY 123  -7.862   1.040  13.558
  878    H    ASN 124           H        ASN 124  -9.734   0.656  12.519
  879    HA   ASN 124           HA       ASN 124  -9.708  -1.384  10.427
  880   1HB   ASN 124          2HB       ASN 124 -11.486  -1.404  12.791
  881   2HB   ASN 124          1HB       ASN 124 -12.260  -1.721  11.241
  882   1HD2  ASN 124          1HD2      ASN 124 -11.788  -3.492  13.532
  883   2HD2  ASN 124          2HD2      ASN 124 -10.904  -4.842  12.902
  884    H    SER 125           H        SER 125  -9.767   1.653  10.764
  885    HA   SER 125           HA       SER 125 -11.874   2.059   8.752
  886   1HB   SER 125          2HB       SER 125 -11.158   3.985  10.986
  887   2HB   SER 125          1HB       SER 125 -12.332   4.286   9.705
  888    HG   SER 125           HG       SER 125 -12.467   2.265  11.706
  889    H    ALA 126           H        ALA 126 -11.396   4.417   7.730
  890    HA   ALA 126           HA       ALA 126  -8.528   4.413   7.055
  891   1HB   ALA 126          1HB       ALA 126 -10.827   4.740   5.134
  892   2HB   ALA 126          2HB       ALA 126  -9.811   3.307   5.301
  893   3HB   ALA 126          3HB       ALA 126  -9.113   4.821   4.725
  894    H    ASP 127           H        ASP 127  -8.212   6.422   5.463
  895    HA   ASP 127           HA       ASP 127  -8.069   8.647   5.135
  896   1HB   ASP 127          2HB       ASP 127 -10.445   8.759   4.862
  897   2HB   ASP 127          1HB       ASP 127 -10.705   8.684   6.602
  898    H    GLN 128           H        GLN 128  -6.312   9.298   6.131
  899    HA   GLN 128           HA       GLN 128  -4.888  10.121   7.680
  900   1HB   GLN 128          2HB       GLN 128  -7.485  11.064   8.908
  901   2HB   GLN 128          1HB       GLN 128  -5.897  11.538   9.505
  902   1HG   GLN 128          2HG       GLN 128  -5.368  12.579   7.390
  903   2HG   GLN 128          1HG       GLN 128  -6.888  12.020   6.701
  904   1HE2  GLN 128          1HE2      GLN 128  -8.402  12.583   9.116
  905   2HE2  GLN 128          2HE2      GLN 128  -8.586  14.301   9.177
  906    H    ALA 129           H        ALA 129  -5.987   7.444   7.859
  907    HA   ALA 129           HA       ALA 129  -4.860   6.687  10.373
  908   1HB   ALA 129          1HB       ALA 129  -7.802   6.179   9.906
  909   2HB   ALA 129          2HB       ALA 129  -7.115   7.252  11.124
  910   3HB   ALA 129          3HB       ALA 129  -6.841   5.513  11.226
  911    H    ALA 130           H        ALA 130  -4.408   4.464  10.451
  912    HA   ALA 130           HA       ALA 130  -4.749   3.064   7.890
  913   1HB   ALA 130          1HB       ALA 130  -2.795   1.734   8.523
  914   2HB   ALA 130          2HB       ALA 130  -2.683   2.610  10.050
  915   3HB   ALA 130          3HB       ALA 130  -2.415   3.456   8.526
  916    H    LYS 131           H        LYS 131  -5.186   0.739   8.015
  917    HA   LYS 131           HA       LYS 131  -6.358  -0.105  10.563
  918   1HB   LYS 131          2HB       LYS 131  -8.406  -0.683   9.701
  919   2HB   LYS 131          1HB       LYS 131  -8.048   0.738   8.729
  920   1HG   LYS 131          2HG       LYS 131  -7.244  -1.933   7.690
  921   2HG   LYS 131          1HG       LYS 131  -8.948  -1.482   7.650
  922   1HD   LYS 131          2HD       LYS 131  -6.669   0.067   6.432
  923   2HD   LYS 131          1HD       LYS 131  -7.846  -0.918   5.557
  924   1HE   LYS 131          2HE       LYS 131  -9.619   0.574   6.633
  925   2HE   LYS 131          1HE       LYS 131  -8.285   1.652   7.044
  926   1HZ   LYS 131          1HZ       LYS 131  -9.141   0.808   4.326
  927   2HZ   LYS 131          2HZ       LYS 131  -7.740   1.710   4.647
  928   3HZ   LYS 131          3HZ       LYS 131  -9.264   2.354   5.003
  929    H    SER 132           H        SER 132  -6.580  -2.402  10.791
  930    HA   SER 132           HA       SER 132  -4.280  -3.751   9.704
  931   1HB   SER 132          2HB       SER 132  -4.905  -4.008  12.066
  932   2HB   SER 132          1HB       SER 132  -6.438  -4.733  11.589
  933    HG   SER 132           HG       SER 132  -3.903  -5.827  11.674
  934    H    THR 133           H        THR 133  -7.802  -4.148   9.553
  935    HA   THR 133           HA       THR 133  -7.377  -5.842   7.195
  936    HB   THR 133           HB       THR 133  -9.511  -6.995   7.746
  937    HG1  THR 133           1HG      THR 133  -9.790  -5.106   9.527
  938   1HG2  THR 133          1HG2      THR 133  -7.326  -7.231   9.819
  939   2HG2  THR 133          2HG2      THR 133  -7.370  -8.043   8.254
  940   3HG2  THR 133          3HG2      THR 133  -8.563  -8.444   9.488
  941    H    ALA 134           H        ALA 134  -8.472  -5.365   5.429
  942    HA   ALA 134           HA       ALA 134 -10.457  -3.196   5.581
  943   1HB   ALA 134          1HB       ALA 134  -8.674  -3.932   3.255
  944   2HB   ALA 134          2HB       ALA 134  -8.450  -2.548   4.326
  945   3HB   ALA 134          3HB       ALA 134  -9.865  -2.631   3.276
  946    H    ILE 135           H        ILE 135 -12.462  -3.668   4.940
  947    HA   ILE 135           HA       ILE 135 -13.243  -5.509   2.997
  948    HB   ILE 135           HB       ILE 135 -12.249  -7.137   4.648
  949   1HG1  ILE 135          2HG1      ILE 135 -15.229  -7.421   4.195
  950   2HG1  ILE 135          1HG1      ILE 135 -13.980  -7.815   3.019
  951   1HG2  ILE 135          1HG2      ILE 135 -14.570  -6.286   6.367
  952   2HG2  ILE 135          2HG2      ILE 135 -12.864  -5.987   6.699
  953   3HG2  ILE 135          3HG2      ILE 135 -13.485  -7.638   6.693
  954   1HD1  ILE 135          1HD1      ILE 135 -14.379  -9.152   5.683
  955   2HD1  ILE 135          2HD1      ILE 135 -13.126  -9.550   4.506
  956   3HD1  ILE 135          3HD1      ILE 135 -14.826  -9.808   4.109
  957    H    THR 136           H        THR 136 -15.605  -5.923   3.111
  958    HA   THR 136           HA       THR 136 -17.756  -5.346   3.347
  959    HB   THR 136           HB       THR 136 -18.667  -4.606   5.438
  960    HG1  THR 136           1HG      THR 136 -16.015  -3.804   5.969
  961   1HG2  THR 136          1HG2      THR 136 -17.770  -6.308   6.962
  962   2HG2  THR 136          2HG2      THR 136 -16.373  -6.510   5.904
  963   3HG2  THR 136          3HG2      THR 136 -17.984  -6.941   5.329
  964    HA   PRO 137           HA       PRO 137 -18.490  -1.345   1.675
  965   1HB   PRO 137          2HB       PRO 137 -20.920  -1.336   3.405
  966   2HB   PRO 137          1HB       PRO 137 -20.767  -1.045   1.674
  967   1HG   PRO 137          2HG       PRO 137 -21.721  -3.353   2.560
  968   2HG   PRO 137          1HG       PRO 137 -20.622  -3.305   1.166
  969   1HD   PRO 137          2HD       PRO 137 -20.065  -4.098   3.991
  970   2HD   PRO 137          1HD       PRO 137 -19.418  -4.771   2.479
  971    H    ALA 138           H        ALA 138 -18.709  -1.811   5.136
  972    HA   ALA 138           HA       ALA 138 -18.848   0.823   6.018
  973   1HB   ALA 138          1HB       ALA 138 -17.373  -1.469   7.309
  974   2HB   ALA 138          2HB       ALA 138 -19.087  -1.100   7.502
  975   3HB   ALA 138          3HB       ALA 138 -17.870   0.024   8.105
  976    H    GLU 139           H        GLU 139 -15.926  -1.142   5.436
  977    HA   GLU 139           HA       GLU 139 -14.032   0.872   5.822
  978   1HB   GLU 139          2HB       GLU 139 -13.920  -1.773   5.228
  979   2HB   GLU 139          1HB       GLU 139 -13.501  -1.083   3.666
  980   1HG   GLU 139          2HG       GLU 139 -12.095  -0.604   6.276
  981   2HG   GLU 139          1HG       GLU 139 -11.514  -1.582   4.930
  982    H    ALA 140           H        ALA 140 -15.649  -0.225   2.852
  983    HA   ALA 140           HA       ALA 140 -14.429   1.444   1.016
  984   1HB   ALA 140          1HB       ALA 140 -16.394   1.127  -0.393
  985   2HB   ALA 140          2HB       ALA 140 -17.307   0.538   0.998
  986   3HB   ALA 140          3HB       ALA 140 -15.929  -0.382   0.390
  987    H    ALA 141           H        ALA 141 -17.169   2.123   3.131
  988    HA   ALA 141           HA       ALA 141 -17.764   4.676   2.036
  989   1HB   ALA 141          1HB       ALA 141 -18.397   3.566   4.766
  990   2HB   ALA 141          2HB       ALA 141 -19.396   3.401   3.324
  991   3HB   ALA 141          3HB       ALA 141 -19.131   4.992   4.034
  992    H    THR 142           H        THR 142 -15.485   3.537   4.416
  993    HA   THR 142           HA       THR 142 -15.034   6.210   5.465
  994    HB   THR 142           HB       THR 142 -13.480   3.727   6.177
  995    HG1  THR 142           1HG      THR 142 -15.533   3.102   6.633
  996   1HG2  THR 142          1HG2      THR 142 -14.147   6.258   7.692
  997   2HG2  THR 142          2HG2      THR 142 -12.577   5.844   7.001
  998   3HG2  THR 142          3HG2      THR 142 -13.230   4.895   8.334
  999    H    ALA 143           H        ALA 143 -13.428   3.827   3.427
 1000    HA   ALA 143           HA       ALA 143 -10.948   5.169   3.193
 1001   1HB   ALA 143          1HB       ALA 143 -10.546   3.708   1.286
 1002   2HB   ALA 143          2HB       ALA 143 -12.251   3.256   1.258
 1003   3HB   ALA 143          3HB       ALA 143 -11.240   2.803   2.630
 1004    H    CYS 144           H        CYS 144 -13.719   5.018   0.958
 1005    HA   CYS 144           HA       CYS 144 -12.675   7.301  -0.496
 1006   1HB   CYS 144          2HB       CYS 144 -15.331   5.943  -0.937
 1007   2HB   CYS 144          1HB       CYS 144 -14.415   6.917  -2.077
 1008    H    LYS 145           H        LYS 145 -12.780   8.698   1.360
 1009    HA   LYS 145           HA       LYS 145 -15.395   9.952   1.682
 1010   1HB   LYS 145          2HB       LYS 145 -15.364   8.394   3.515
 1011   2HB   LYS 145          1HB       LYS 145 -13.721   8.846   3.943
 1012   1HG   LYS 145          2HG       LYS 145 -14.482  11.041   4.640
 1013   2HG   LYS 145          1HG       LYS 145 -16.133  10.637   4.161
 1014   1HD   LYS 145          2HD       LYS 145 -16.289   8.956   5.842
 1015   2HD   LYS 145          1HD       LYS 145 -14.566   9.066   6.198
 1016   1HE   LYS 145          2HE       LYS 145 -16.536  11.312   6.612
 1017   2HE   LYS 145          1HE       LYS 145 -16.028  10.188   7.874
 1018   1HZ   LYS 145          1HZ       LYS 145 -13.781  10.946   7.660
 1019   2HZ   LYS 145          2HZ       LYS 145 -14.780  12.298   7.886
 1020   3HZ   LYS 145          3HZ       LYS 145 -14.176  11.941   6.346
 1021    H    ASN 146           H        ASN 146 -14.867  11.861   0.850
 1022    HA   ASN 146           HA       ASN 146 -13.973  13.926   0.608
 1023   1HB   ASN 146          2HB       ASN 146 -12.570  13.307   3.218
 1024   2HB   ASN 146          1HB       ASN 146 -12.568  14.881   2.429
 1025   1HD2  ASN 146          1HD2      ASN 146 -14.436  16.112   2.421
 1026   2HD2  ASN 146          2HD2      ASN 146 -15.772  15.767   3.462
 1027    H    THR 147           H        THR 147 -12.406  11.181   0.182
 1028    HA   THR 147           HA       THR 147  -9.724  12.183  -0.162
 1029    HB   THR 147           HB       THR 147  -9.416   9.794  -1.144
 1030    HG1  THR 147           1HG      THR 147 -11.032   8.342  -0.336
 1031   1HG2  THR 147          1HG2      THR 147  -9.181   8.872   1.107
 1032   2HG2  THR 147          2HG2      THR 147 -10.163  10.186   1.757
 1033   3HG2  THR 147          3HG2      THR 147  -8.585  10.530   1.045
 1034    H    ASP 148           H        ASP 148  -9.955  13.747  -1.765
 1035    HA   ASP 148           HA       ASP 148 -10.268  12.588  -4.453
 1036   1HB   ASP 148          2HB       ASP 148 -12.152  14.098  -3.948
 1037   2HB   ASP 148          1HB       ASP 148 -11.012  15.399  -3.615
 1038    H    SER 149           H        SER 149  -9.094  15.710  -3.158
 1039    HA   SER 149           HA       SER 149  -6.724  15.586  -4.778
 1040   1HB   SER 149          2HB       SER 149  -7.309  17.411  -2.430
 1041   2HB   SER 149          1HB       SER 149  -6.120  17.677  -3.705
 1042    HG   SER 149           HG       SER 149  -7.913  17.714  -5.192
 1043    H    THR 150           H        THR 150  -7.686  14.481  -1.709
 1044    HA   THR 150           HA       THR 150  -4.936  14.042  -0.803
 1045    HB   THR 150           HB       THR 150  -6.157  13.352   1.338
 1046    HG1  THR 150           1HG      THR 150  -8.317  14.241   1.464
 1047   1HG2  THR 150          1HG2      THR 150  -6.519  15.689   2.026
 1048   2HG2  THR 150          2HG2      THR 150  -6.432  16.189   0.337
 1049   3HG2  THR 150          3HG2      THR 150  -5.015  15.496   1.124
 1050    H    ASN 151           H        ASN 151  -6.520  12.480  -2.904
 1051    HA   ASN 151           HA       ASN 151  -7.004   9.938  -1.630
 1052   1HB   ASN 151          2HB       ASN 151  -8.393  10.766  -3.537
 1053   2HB   ASN 151          1HB       ASN 151  -6.990  10.573  -4.585
 1054   1HD2  ASN 151          1HD2      ASN 151  -7.946   9.031  -5.874
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.280   7.429  -5.324
 1056    H    LYS 152           H        LYS 152  -4.988   9.373  -0.811
 1057    HA   LYS 152           HA       LYS 152  -3.468   7.846  -2.723
 1058   1HB   LYS 152          2HB       LYS 152  -1.292   8.660  -2.189
 1059   2HB   LYS 152          1HB       LYS 152  -2.263  10.026  -2.681
 1060   1HG   LYS 152          2HG       LYS 152  -1.768   9.322   0.196
 1061   2HG   LYS 152          1HG       LYS 152  -0.726  10.402  -0.727
 1062   1HD   LYS 152          2HD       LYS 152  -2.628  11.894  -1.116
 1063   2HD   LYS 152          1HD       LYS 152  -3.664  10.808  -0.184
 1064   1HE   LYS 152          2HE       LYS 152  -2.339  11.187   1.799
 1065   2HE   LYS 152          1HE       LYS 152  -1.200  12.175   0.887
 1066   1HZ   LYS 152          1HZ       LYS 152  -4.047  12.807   1.440
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.034  13.730   0.437
 1068   3HZ   LYS 152          3HZ       LYS 152  -2.691  13.586   2.094
 1069    H    VAL 153           H        VAL 153  -2.469   6.113  -1.836
 1070    HA   VAL 153           HA       VAL 153  -2.674   5.786   1.059
 1071    HB   VAL 153           HB       VAL 153  -4.778   4.921   0.428
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.118   3.244  -1.301
 1073   2HG1  VAL 153          2HG1      VAL 153  -3.395   3.274  -1.680
 1074   3HG1  VAL 153          3HG1      VAL 153  -4.388   4.705  -1.969
 1075   1HG2  VAL 153          1HG2      VAL 153  -2.872   2.606   0.732
 1076   2HG2  VAL 153          2HG2      VAL 153  -4.614   2.540   0.993
 1077   3HG2  VAL 153          3HG2      VAL 153  -3.604   3.537   2.038
 1078    H    THR 154           H        THR 154  -0.621   5.327   1.617
 1079    HA   THR 154           HA       THR 154   0.953   3.361   0.235
 1080    HB   THR 154           HB       THR 154   2.520   3.631   1.959
 1081    HG1  THR 154           1HG      THR 154   0.393   3.522   3.553
 1082   1HG2  THR 154          1HG2      THR 154   2.616   6.011   2.486
 1083   2HG2  THR 154          2HG2      THR 154   0.927   6.190   2.011
 1084   3HG2  THR 154          3HG2      THR 154   2.142   5.757   0.806
 1085    H    TYR 155           H        TYR 155   0.704   1.092   0.399
 1086    HA   TYR 155           HA       TYR 155  -0.224   0.116   2.977
 1087   1HB   TYR 155          2HB       TYR 155  -2.072  -1.144   2.212
 1088   2HB   TYR 155          1HB       TYR 155  -2.279   0.487   1.600
 1089    HD1  TYR 155           1HD      TYR 155  -2.528  -2.884   0.816
 1090    HD2  TYR 155           2HD      TYR 155  -1.298   0.817  -0.890
 1091    HE1  TYR 155           1HE      TYR 155  -2.891  -3.816  -1.429
 1092    HE2  TYR 155           2HE      TYR 155  -1.649  -0.104  -3.145
 1093    HH   TYR 155           HH       TYR 155  -1.664  -2.452  -4.190
 1094    H    PHE 156           H        PHE 156   0.862  -1.542   3.630
 1095    HA   PHE 156           HA       PHE 156   2.534  -3.050   1.806
 1096   1HB   PHE 156          2HB       PHE 156   2.112  -3.116   4.793
 1097   2HB   PHE 156          1HB       PHE 156   3.064  -4.338   3.958
 1098    HD1  PHE 156           1HD      PHE 156   5.292  -4.054   3.725
 1099    HD2  PHE 156           2HD      PHE 156   2.827  -0.629   4.318
 1100    HE1  PHE 156           1HE      PHE 156   7.300  -2.627   3.870
 1101    HE2  PHE 156           2HE      PHE 156   4.831   0.797   4.461
 1102    HZ   PHE 156           HZ       PHE 156   7.068  -0.202   4.238
 1103    H    MET 157           H        MET 157   2.125  -5.117   1.112
 1104    HA   MET 157           HA       MET 157  -0.322  -6.392   2.089
 1105   1HB   MET 157          2HB       MET 157  -0.921  -5.000   0.137
 1106   2HB   MET 157          1HB       MET 157   0.268  -5.861  -0.832
 1107   1HG   MET 157          2HG       MET 157  -0.979  -7.899  -0.651
 1108   2HG   MET 157          1HG       MET 157  -2.100  -7.158   0.487
 1109   1HE   MET 157          1HE       MET 157  -2.951  -8.744  -2.212
 1110   2HE   MET 157          2HE       MET 157  -4.278  -7.709  -2.740
 1111   3HE   MET 157          3HE       MET 157  -4.086  -8.092  -1.028
 1112    H    LYS 158           H        LYS 158  -0.172  -8.536   2.258
 1113    HA   LYS 158           HA       LYS 158   2.251  -9.842   1.262
 1114   1HB   LYS 158          2HB       LYS 158   1.620 -10.025   3.683
 1115   2HB   LYS 158          1HB       LYS 158   0.164 -10.874   3.192
 1116   1HG   LYS 158          2HG       LYS 158   1.959 -12.409   1.961
 1117   2HG   LYS 158          1HG       LYS 158   2.965 -11.806   3.281
 1118   1HD   LYS 158          2HD       LYS 158   1.947 -13.844   4.012
 1119   2HD   LYS 158          1HD       LYS 158   1.154 -12.513   4.864
 1120   1HE   LYS 158          2HE       LYS 158  -0.639 -12.569   3.131
 1121   2HE   LYS 158          1HE       LYS 158   0.120 -14.014   2.466
 1122   1HZ   LYS 158          1HZ       LYS 158  -1.585 -14.752   3.869
 1123   2HZ   LYS 158          2HZ       LYS 158  -1.162 -13.686   5.111
 1124   3HZ   LYS 158          3HZ       LYS 158  -0.158 -14.999   4.754
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1 -19.377  -9.201   8.139
    2   2H    MET   1          2HT       MET   1 -18.900  -8.741   6.579
    3   3H    MET   1          3HT       MET   1 -18.762 -10.358   7.058
    4    HA   MET   1           HA       MET   1 -21.179 -10.489   7.295
    5   1HB   MET   1          2HB       MET   1 -20.979  -7.689   6.197
    6   2HB   MET   1          1HB       MET   1 -22.442  -8.652   6.047
    7   1HG   MET   1          2HG       MET   1 -21.108  -7.879   8.632
    8   2HG   MET   1          1HG       MET   1 -22.544  -7.124   7.941
    9   1HE   MET   1          1HE       MET   1 -23.800  -7.538  10.269
   10   2HE   MET   1          2HE       MET   1 -22.363  -8.327  10.920
   11   3HE   MET   1          3HE       MET   1 -23.933  -9.121  11.036
   12    H    GLU   2           H        GLU   2 -18.820  -9.631   4.991
   13    HA   GLU   2           HA       GLU   2 -18.250 -10.469   2.978
   14   1HB   GLU   2          2HB       GLU   2 -20.318 -12.625   3.102
   15   2HB   GLU   2          1HB       GLU   2 -18.660 -12.700   2.529
   16   1HG   GLU   2          2HG       GLU   2 -19.673 -12.798   5.350
   17   2HG   GLU   2          1HG       GLU   2 -18.729 -14.000   4.479
   18    H    GLN   3           H        GLN   3 -19.117  -8.586   2.022
   19    HA   GLN   3           HA       GLN   3 -21.375  -9.029   0.248
   20   1HB   GLN   3          2HB       GLN   3 -22.316  -8.283   2.479
   21   2HB   GLN   3          1HB       GLN   3 -21.463  -6.766   2.253
   22   1HG   GLN   3          2HG       GLN   3 -22.765  -6.369   0.198
   23   2HG   GLN   3          1HG       GLN   3 -23.658  -7.860   0.511
   24   1HE2  GLN   3          1HE2      GLN   3 -23.101  -4.584   1.512
   25   2HE2  GLN   3          2HE2      GLN   3 -24.453  -4.465   2.587
   26    H    SER   4           H        SER   4 -18.433  -8.349   0.222
   27    HA   SER   4           HA       SER   4 -18.468  -5.595  -0.764
   28   1HB   SER   4          2HB       SER   4 -16.096  -7.392  -0.210
   29   2HB   SER   4          1HB       SER   4 -16.050  -5.656  -0.536
   30    HG   SER   4           HG       SER   4 -16.874  -7.029   1.762
   31    H    ALA   5           H        ALA   5 -18.643  -8.713  -1.957
   32    HA   ALA   5           HA       ALA   5 -18.934  -9.485  -4.070
   33   1HB   ALA   5          1HB       ALA   5 -18.365  -6.685  -5.018
   34   2HB   ALA   5          2HB       ALA   5 -19.951  -7.302  -4.559
   35   3HB   ALA   5          3HB       ALA   5 -19.108  -7.985  -5.949
   36    H    SER   6           H        SER   6 -16.220  -7.156  -4.134
   37    HA   SER   6           HA       SER   6 -14.663  -9.020  -5.752
   38   1HB   SER   6          2HB       SER   6 -13.813  -6.351  -4.607
   39   2HB   SER   6          1HB       SER   6 -13.029  -7.253  -5.904
   40    HG   SER   6           HG       SER   6 -15.660  -6.187  -6.010
   41    H    ASP   7           H        ASP   7 -15.482  -9.014  -2.728
   42    HA   ASP   7           HA       ASP   7 -13.069  -8.880  -1.246
   43   1HB   ASP   7          2HB       ASP   7 -14.469  -9.818   0.592
   44   2HB   ASP   7          1HB       ASP   7 -15.142  -8.387  -0.160
   45    H    SER   8           H        SER   8 -14.243 -11.177  -3.310
   46    HA   SER   8           HA       SER   8 -12.561 -13.242  -2.081
   47   1HB   SER   8          2HB       SER   8 -14.332 -14.646  -3.623
   48   2HB   SER   8          1HB       SER   8 -14.508 -14.370  -1.889
   49    HG   SER   8           HG       SER   8 -15.777 -12.533  -2.358
   50    H    ASN   9           H        ASN   9 -13.988 -12.198  -5.197
   51    HA   ASN   9           HA       ASN   9 -12.333 -13.895  -6.743
   52   1HB   ASN   9          2HB       ASN   9 -13.882 -11.440  -7.583
   53   2HB   ASN   9          1HB       ASN   9 -13.133 -12.583  -8.692
   54   1HD2  ASN   9          1HD2      ASN   9 -15.866 -11.903  -8.635
   55   2HD2  ASN   9          2HD2      ASN   9 -16.755 -13.334  -8.224
   56    H    LYS  10           H        LYS  10 -12.267 -10.322  -6.493
   57    HA   LYS  10           HA       LYS  10  -9.793 -10.157  -7.882
   58   1HB   LYS  10          2HB       LYS  10 -11.443  -8.313  -7.857
   59   2HB   LYS  10          1HB       LYS  10 -11.127  -8.069  -6.142
   60   1HG   LYS  10          2HG       LYS  10  -8.847  -7.444  -6.604
   61   2HG   LYS  10          1HG       LYS  10  -9.060  -7.813  -8.315
   62   1HD   LYS  10          2HD       LYS  10 -10.718  -6.028  -8.496
   63   2HD   LYS  10          1HD       LYS  10 -10.522  -5.667  -6.779
   64   1HE   LYS  10          2HE       LYS  10  -8.184  -5.095  -7.151
   65   2HE   LYS  10          1HE       LYS  10  -8.343  -5.506  -8.858
   66   1HZ   LYS  10          1HZ       LYS  10  -8.467  -3.093  -8.337
   67   2HZ   LYS  10          2HZ       LYS  10  -9.937  -3.380  -7.539
   68   3HZ   LYS  10          3HZ       LYS  10  -9.798  -3.687  -9.201
   69    H    SER  11           H        SER  11 -10.707 -10.472  -4.547
   70    HA   SER  11           HA       SER  11  -8.323  -9.668  -3.327
   71   1HB   SER  11          2HB       SER  11 -10.497 -10.135  -2.159
   72   2HB   SER  11          1HB       SER  11 -10.176 -11.856  -2.359
   73    HG   SER  11           HG       SER  11  -8.028 -10.635  -1.291
   74    H    GLN  12           H        GLN  12  -9.356 -12.937  -4.366
   75    HA   GLN  12           HA       GLN  12  -6.957 -14.208  -3.596
   76   1HB   GLN  12          2HB       GLN  12  -9.015 -15.013  -5.652
   77   2HB   GLN  12          1HB       GLN  12  -7.707 -16.051  -5.099
   78   1HG   GLN  12          2HG       GLN  12  -8.604 -15.878  -2.798
   79   2HG   GLN  12          1HG       GLN  12  -9.963 -14.951  -3.433
   80   1HE2  GLN  12          1HE2      GLN  12  -8.453 -17.645  -5.083
   81   2HE2  GLN  12          2HE2      GLN  12  -9.804 -18.720  -4.951
   82    H    ASN  13           H        ASN  13  -7.921 -12.570  -6.542
   83    HA   ASN  13           HA       ASN  13  -5.739 -13.344  -8.155
   84   1HB   ASN  13          2HB       ASN  13  -7.647 -11.035  -8.193
   85   2HB   ASN  13          1HB       ASN  13  -6.223 -10.985  -9.228
   86   1HD2  ASN  13          1HD2      ASN  13  -9.260 -12.586  -8.591
   87   2HD2  ASN  13          2HD2      ASN  13  -9.348 -13.421 -10.109
   88    H    ALA  14           H        ALA  14  -6.204 -10.603  -5.955
   89    HA   ALA  14           HA       ALA  14  -3.672  -9.431  -6.354
   90   1HB   ALA  14          1HB       ALA  14  -4.088  -8.232  -4.274
   91   2HB   ALA  14          2HB       ALA  14  -5.415  -9.329  -3.891
   92   3HB   ALA  14          3HB       ALA  14  -5.534  -8.251  -5.282
   93    H    ILE  15           H        ILE  15  -4.845 -11.821  -4.012
   94    HA   ILE  15           HA       ILE  15  -2.570 -12.181  -2.465
   95    HB   ILE  15           HB       ILE  15  -4.507 -14.320  -3.389
   96   1HG1  ILE  15          2HG1      ILE  15  -4.491 -12.626  -0.878
   97   2HG1  ILE  15          1HG1      ILE  15  -5.596 -12.438  -2.235
   98   1HG2  ILE  15          1HG2      ILE  15  -3.785 -15.561  -1.395
   99   2HG2  ILE  15          2HG2      ILE  15  -2.584 -14.312  -1.060
  100   3HG2  ILE  15          3HG2      ILE  15  -2.452 -15.293  -2.520
  101   1HD1  ILE  15          1HD1      ILE  15  -6.677 -13.597  -0.416
  102   2HD1  ILE  15          2HD1      ILE  15  -5.404 -14.819  -0.410
  103   3HD1  ILE  15          3HD1      ILE  15  -6.485 -14.677  -1.797
  104    H    SER  16           H        SER  16  -3.445 -13.765  -5.511
  105    HA   SER  16           HA       SER  16  -1.272 -15.501  -5.708
  106   1HB   SER  16          2HB       SER  16  -2.801 -14.185  -7.966
  107   2HB   SER  16          1HB       SER  16  -1.843 -15.661  -8.080
  108    HG   SER  16           HG       SER  16  -4.199 -15.278  -6.523
  109    H    GLU  17           H        GLU  17  -1.628 -12.149  -6.799
  110    HA   GLU  17           HA       GLU  17   0.817 -12.074  -8.239
  111   1HB   GLU  17          2HB       GLU  17  -0.905  -9.856  -7.132
  112   2HB   GLU  17          1HB       GLU  17   0.495  -9.589  -8.160
  113   1HG   GLU  17          2HG       GLU  17  -0.620 -10.994  -9.900
  114   2HG   GLU  17          1HG       GLU  17  -2.057 -11.003  -8.877
  115    H    VAL  18           H        VAL  18  -0.077 -10.715  -5.048
  116    HA   VAL  18           HA       VAL  18   2.520  -9.679  -4.601
  117    HB   VAL  18           HB       VAL  18   1.827  -9.314  -2.264
  118   1HG1  VAL  18          1HG1      VAL  18  -0.014  -7.756  -2.786
  119   2HG1  VAL  18          2HG1      VAL  18  -0.158  -8.500  -4.378
  120   3HG1  VAL  18          3HG1      VAL  18   1.323  -7.651  -3.933
  121   1HG2  VAL  18          1HG2      VAL  18  -0.452  -9.839  -1.560
  122   2HG2  VAL  18          2HG2      VAL  18   0.436 -11.310  -1.962
  123   3HG2  VAL  18          3HG2      VAL  18  -0.746 -10.653  -3.096
  124    H    MET  19           H        MET  19   1.010 -12.742  -3.727
  125    HA   MET  19           HA       MET  19   2.911 -13.631  -1.878
  126   1HB   MET  19          2HB       MET  19   0.767 -14.772  -2.290
  127   2HB   MET  19          1HB       MET  19   1.339 -15.270  -3.878
  128   1HG   MET  19          2HG       MET  19   3.054 -16.636  -2.868
  129   2HG   MET  19          1HG       MET  19   2.587 -16.081  -1.262
  130   1HE   MET  19          1HE       MET  19  -0.162 -18.623  -3.964
  131   2HE   MET  19          2HE       MET  19   1.464 -18.133  -4.433
  132   3HE   MET  19          3HE       MET  19   0.197 -16.920  -4.254
  133    H    SER  20           H        SER  20   2.897 -13.716  -5.395
  134    HA   SER  20           HA       SER  20   5.333 -15.181  -5.635
  135   1HB   SER  20          2HB       SER  20   3.937 -13.384  -7.636
  136   2HB   SER  20          1HB       SER  20   5.214 -14.547  -8.003
  137    HG   SER  20           HG       SER  20   3.420 -15.917  -6.702
  138    H    ALA  21           H        ALA  21   4.453 -11.803  -5.381
  139    HA   ALA  21           HA       ALA  21   6.932 -10.720  -6.214
  140   1HB   ALA  21          1HB       ALA  21   4.831  -9.484  -4.440
  141   2HB   ALA  21          2HB       ALA  21   4.861  -9.419  -6.203
  142   3HB   ALA  21          3HB       ALA  21   6.131  -8.628  -5.270
  143    H    THR  22           H        THR  22   5.559 -11.256  -2.950
  144    HA   THR  22           HA       THR  22   7.711 -10.321  -1.465
  145    HB   THR  22           HB       THR  22   6.245 -12.705  -0.448
  146    HG1  THR  22           1HG      THR  22   4.845 -10.279  -0.367
  147   1HG2  THR  22          1HG2      THR  22   6.829  -9.969   0.680
  148   2HG2  THR  22          2HG2      THR  22   7.758 -11.434   0.995
  149   3HG2  THR  22          3HG2      THR  22   6.091 -11.308   1.556
  150    H    SER  23           H        SER  23   7.217 -13.454  -2.983
  151    HA   SER  23           HA       SER  23   9.504 -14.598  -1.645
  152   1HB   SER  23          2HB       SER  23   8.971 -16.554  -3.233
  153   2HB   SER  23          1HB       SER  23   7.786 -16.151  -1.991
  154    HG   SER  23           HG       SER  23   6.468 -15.280  -3.493
  155    H    ALA  24           H        ALA  24   8.796 -13.136  -4.745
  156    HA   ALA  24           HA       ALA  24  11.168 -14.096  -6.028
  157   1HB   ALA  24          1HB       ALA  24   9.395 -11.792  -6.821
  158   2HB   ALA  24          2HB       ALA  24   9.156 -13.475  -7.293
  159   3HB   ALA  24          3HB       ALA  24  10.589 -12.600  -7.839
  160    H    ILE  25           H        ILE  25  10.269 -11.087  -4.378
  161    HA   ILE  25           HA       ILE  25  12.521  -9.612  -5.215
  162    HB   ILE  25           HB       ILE  25  10.532  -8.505  -4.338
  163   1HG1  ILE  25          2HG1      ILE  25  12.986  -7.949  -2.653
  164   2HG1  ILE  25          1HG1      ILE  25  12.719  -7.351  -4.285
  165   1HG2  ILE  25          1HG2      ILE  25   9.932 -10.096  -2.591
  166   2HG2  ILE  25          2HG2      ILE  25  10.045  -8.460  -1.943
  167   3HG2  ILE  25          3HG2      ILE  25  11.346  -9.614  -1.655
  168   1HD1  ILE  25          1HD1      ILE  25  11.035  -6.684  -1.884
  169   2HD1  ILE  25          2HD1      ILE  25  10.817  -6.057  -3.519
  170   3HD1  ILE  25          3HD1      ILE  25  12.270  -5.651  -2.604
  171    H    ASN  26           H        ASN  26  12.040 -11.811  -2.518
  172    HA   ASN  26           HA       ASN  26  14.353 -11.259  -1.056
  173   1HB   ASN  26          2HB       ASN  26  12.825 -13.818  -1.485
  174   2HB   ASN  26          1HB       ASN  26  14.285 -13.779  -0.504
  175   1HD2  ASN  26          1HD2      ASN  26  13.376 -14.233   1.417
  176   2HD2  ASN  26          2HD2      ASN  26  12.239 -13.206   2.227
  177    H    GLY  27           H        GLY  27  13.865 -13.262  -3.917
  178   1HA   GLY  27          2HA       GLY  27  16.580 -14.221  -3.937
  179   2HA   GLY  27          1HA       GLY  27  15.367 -14.484  -5.182
  180    H    LEU  28           H        LEU  28  15.027 -11.396  -5.039
  181    HA   LEU  28           HA       LEU  28  16.839 -10.838  -7.199
  182   1HB   LEU  28          2HB       LEU  28  14.983  -8.988  -5.694
  183   2HB   LEU  28          1HB       LEU  28  15.819  -8.598  -7.185
  184    HG   LEU  28           HG       LEU  28  13.654 -10.677  -6.842
  185   1HD1  LEU  28          1HD1      LEU  28  13.683  -8.044  -8.313
  186   2HD1  LEU  28          2HD1      LEU  28  12.830  -8.384  -6.807
  187   3HD1  LEU  28          3HD1      LEU  28  12.356  -9.206  -8.294
  188   1HD2  LEU  28          1HD2      LEU  28  13.801 -10.935  -9.279
  189   2HD2  LEU  28          2HD2      LEU  28  15.293 -11.421  -8.472
  190   3HD2  LEU  28          3HD2      LEU  28  15.202  -9.865  -9.299
  191    H    TYR  29           H        TYR  29  16.660 -10.194  -3.790
  192    HA   TYR  29           HA       TYR  29  19.029  -8.465  -3.935
  193   1HB   TYR  29          2HB       TYR  29  16.894  -8.858  -1.854
  194   2HB   TYR  29          1HB       TYR  29  18.414  -8.063  -1.466
  195    HD1  TYR  29           1HD      TYR  29  15.744  -7.863  -4.089
  196    HD2  TYR  29           2HD      TYR  29  18.427  -5.778  -1.534
  197    HE1  TYR  29           1HE      TYR  29  14.815  -5.724  -4.866
  198    HE2  TYR  29           2HE      TYR  29  17.511  -3.637  -2.288
  199    HH   TYR  29           HH       TYR  29  16.310  -2.764  -4.326
  200    H    ILE  30           H        ILE  30  17.735 -11.019  -1.826
  201    HA   ILE  30           HA       ILE  30  18.675 -12.777  -0.770
  202    HB   ILE  30           HB       ILE  30  21.019 -12.314  -2.619
  203   1HG1  ILE  30          2HG1      ILE  30  18.704 -14.259  -2.754
  204   2HG1  ILE  30          1HG1      ILE  30  18.908 -12.838  -3.772
  205   1HG2  ILE  30          1HG2      ILE  30  20.361 -14.667  -0.850
  206   2HG2  ILE  30          2HG2      ILE  30  21.719 -13.558  -0.657
  207   3HG2  ILE  30          3HG2      ILE  30  21.645 -14.629  -2.058
  208   1HD1  ILE  30          1HD1      ILE  30  20.929 -13.821  -4.727
  209   2HD1  ILE  30          2HD1      ILE  30  19.523 -14.862  -4.952
  210   3HD1  ILE  30          3HD1      ILE  30  20.714 -15.244  -3.709
  211    H    GLY  31           H        GLY  31  18.973 -12.276   1.293
  212   1HA   GLY  31          2HA       GLY  31  20.214 -11.992   3.210
  213   2HA   GLY  31          1HA       GLY  31  21.649 -11.884   2.204
  214    H    GLN  32           H        GLN  32  18.717  -9.884   2.606
  215    HA   GLN  32           HA       GLN  32  20.517  -7.573   3.007
  216   1HB   GLN  32          2HB       GLN  32  17.667  -7.554   2.006
  217   2HB   GLN  32          1HB       GLN  32  18.745  -6.169   2.124
  218   1HG   GLN  32          2HG       GLN  32  19.222  -8.564   0.382
  219   2HG   GLN  32          1HG       GLN  32  18.495  -7.053  -0.155
  220   1HE2  GLN  32          1HE2      GLN  32  20.985  -8.425  -0.970
  221   2HE2  GLN  32          2HE2      GLN  32  22.240  -7.259  -0.751
  222    H    THR  33           H        THR  33  18.421  -9.634   4.549
  223    HA   THR  33           HA       THR  33  17.487  -9.668   6.619
  224    HB   THR  33           HB       THR  33  18.776  -6.954   6.968
  225    HG1  THR  33           1HG      THR  33  19.705  -9.552   7.077
  226   1HG2  THR  33          1HG2      THR  33  17.662  -8.856   9.038
  227   2HG2  THR  33          2HG2      THR  33  16.931  -7.326   8.552
  228   3HG2  THR  33          3HG2      THR  33  18.495  -7.338   9.368
  229    H    SER  34           H        SER  34  17.241  -6.319   5.433
  230    HA   SER  34           HA       SER  34  14.365  -6.589   5.203
  231   1HB   SER  34          2HB       SER  34  15.588  -4.524   7.056
  232   2HB   SER  34          1HB       SER  34  13.875  -4.675   6.661
  233    HG   SER  34           HG       SER  34  14.929  -7.027   7.542
  234    H    TYR  35           H        TYR  35  16.708  -6.096   3.462
  235    HA   TYR  35           HA       TYR  35  17.329  -4.800   1.684
  236   1HB   TYR  35          2HB       TYR  35  14.642  -3.454   2.062
  237   2HB   TYR  35          1HB       TYR  35  15.610  -3.495   0.588
  238    HD1  TYR  35           1HD      TYR  35  16.217  -5.939  -0.234
  239    HD2  TYR  35           2HD      TYR  35  12.885  -4.985   2.249
  240    HE1  TYR  35           1HE      TYR  35  15.126  -8.035  -0.902
  241    HE2  TYR  35           2HE      TYR  35  11.795  -7.086   1.586
  242    HH   TYR  35           HH       TYR  35  11.844  -8.744  -0.082
  243    H    SER  36           H        SER  36  17.889  -4.080   4.426
  244    HA   SER  36           HA       SER  36  17.775  -1.377   4.989
  245   1HB   SER  36          2HB       SER  36  20.014  -3.298   5.679
  246   2HB   SER  36          1HB       SER  36  19.617  -1.803   6.526
  247    HG   SER  36           HG       SER  36  18.366  -3.012   7.692
  248    H    GLY  37           H        GLY  37  18.850   0.369   4.321
  249   1HA   GLY  37          2HA       GLY  37  20.989   1.273   3.413
  250   2HA   GLY  37          1HA       GLY  37  20.931  -0.059   2.260
  251    H    LEU  38           H        LEU  38  18.274  -0.083   1.574
  252    HA   LEU  38           HA       LEU  38  18.099   2.102  -0.247
  253   1HB   LEU  38          2HB       LEU  38  15.925   0.196   0.608
  254   2HB   LEU  38          1HB       LEU  38  15.898   1.217  -0.813
  255    HG   LEU  38           HG       LEU  38  17.686  -1.159  -0.326
  256   1HD1  LEU  38          1HD1      LEU  38  15.420  -0.629  -2.237
  257   2HD1  LEU  38          2HD1      LEU  38  15.443  -1.781  -0.902
  258   3HD1  LEU  38          3HD1      LEU  38  16.479  -2.034  -2.304
  259   1HD2  LEU  38          1HD2      LEU  38  18.928   0.566  -1.519
  260   2HD2  LEU  38          2HD2      LEU  38  17.604   0.744  -2.671
  261   3HD2  LEU  38          3HD2      LEU  38  18.521  -0.762  -2.605
  262    H    ASP  39           H        ASP  39  16.834   1.419   2.913
  263    HA   ASP  39           HA       ASP  39  14.656   3.196   2.951
  264   1HB   ASP  39          2HB       ASP  39  14.765   2.933   5.421
  265   2HB   ASP  39          1HB       ASP  39  14.800   1.399   4.559
  266    H    SER  40           H        SER  40  17.931   3.579   4.290
  267    HA   SER  40           HA       SER  40  17.547   6.256   5.089
  268   1HB   SER  40          2HB       SER  40  20.091   6.281   5.138
  269   2HB   SER  40          1HB       SER  40  19.313   5.036   6.115
  270    HG   SER  40           HG       SER  40  20.490   3.696   5.030
  271    H    THR  41           H        THR  41  18.771   4.777   2.143
  272    HA   THR  41           HA       THR  41  19.770   7.093   0.927
  273    HB   THR  41           HB       THR  41  18.658   4.616  -0.398
  274    HG1  THR  41           1HG      THR  41  20.349   3.904   0.770
  275   1HG2  THR  41          1HG2      THR  41  20.110   5.250  -2.291
  276   2HG2  THR  41          2HG2      THR  41  20.511   6.753  -1.463
  277   3HG2  THR  41          3HG2      THR  41  18.856   6.453  -1.990
  278    H    ILE  42           H        ILE  42  16.576   5.503   0.493
  279    HA   ILE  42           HA       ILE  42  15.604   7.347  -1.388
  280    HB   ILE  42           HB       ILE  42  14.063   5.633   0.566
  281   1HG1  ILE  42          2HG1      ILE  42  15.439   4.334  -0.967
  282   2HG1  ILE  42          1HG1      ILE  42  13.743   4.158  -1.392
  283   1HG2  ILE  42          1HG2      ILE  42  12.143   5.940  -0.944
  284   2HG2  ILE  42          2HG2      ILE  42  13.077   7.115  -1.868
  285   3HG2  ILE  42          3HG2      ILE  42  12.651   7.452  -0.191
  286   1HD1  ILE  42          1HD1      ILE  42  15.744   5.920  -2.785
  287   2HD1  ILE  42          2HD1      ILE  42  14.038   5.769  -3.211
  288   3HD1  ILE  42          3HD1      ILE  42  15.115   4.380  -3.372
  289    H    LEU  43           H        LEU  43  15.484   7.357   2.130
  290    HA   LEU  43           HA       LEU  43  13.657   9.417   2.545
  291   1HB   LEU  43          2HB       LEU  43  14.487   7.950   4.314
  292   2HB   LEU  43          1HB       LEU  43  16.082   8.667   4.179
  293    HG   LEU  43           HG       LEU  43  15.101  10.846   4.904
  294   1HD1  LEU  43          1HD1      LEU  43  12.886  10.848   5.930
  295   2HD1  LEU  43          2HD1      LEU  43  12.652   9.169   5.442
  296   3HD1  LEU  43          3HD1      LEU  43  12.794  10.431   4.219
  297   1HD2  LEU  43          1HD2      LEU  43  14.753   8.506   6.775
  298   2HD2  LEU  43          2HD2      LEU  43  14.860  10.197   7.263
  299   3HD2  LEU  43          3HD2      LEU  43  16.239   9.413   6.494
  300    H    LEU  44           H        LEU  44  17.229   9.698   2.593
  301    HA   LEU  44           HA       LEU  44  17.066  12.555   2.592
  302   1HB   LEU  44          2HB       LEU  44  19.584  12.402   2.301
  303   2HB   LEU  44          1HB       LEU  44  18.898  11.745   3.769
  304    HG   LEU  44           HG       LEU  44  19.021   9.460   2.587
  305   1HD1  LEU  44          1HD1      LEU  44  19.437  10.256   0.329
  306   2HD1  LEU  44          2HD1      LEU  44  20.777   9.261   0.899
  307   3HD1  LEU  44          3HD1      LEU  44  20.937  11.017   0.859
  308   1HD2  LEU  44          1HD2      LEU  44  21.535  10.927   3.364
  309   2HD2  LEU  44          2HD2      LEU  44  21.354   9.176   3.272
  310   3HD2  LEU  44          3HD2      LEU  44  20.429  10.097   4.459
  311    H    ASN  45           H        ASN  45  17.077  10.190   0.158
  312    HA   ASN  45           HA       ASN  45  18.229  11.666  -1.968
  313   1HB   ASN  45          2HB       ASN  45  17.866   9.229  -2.067
  314   2HB   ASN  45          1HB       ASN  45  16.125   9.497  -2.049
  315   1HD2  ASN  45          1HD2      ASN  45  15.763   8.523  -4.001
  316   2HD2  ASN  45          2HD2      ASN  45  16.259   9.213  -5.506
  317    H    THR  46           H        THR  46  14.931  11.361  -0.731
  318    HA   THR  46           HA       THR  46  14.005  13.152  -2.860
  319    HB   THR  46           HB       THR  46  12.190  11.722  -0.946
  320    HG1  THR  46           1HG      THR  46  13.453  10.063  -1.750
  321   1HG2  THR  46          1HG2      THR  46  11.918  12.571  -3.834
  322   2HG2  THR  46          2HG2      THR  46  11.202  13.383  -2.441
  323   3HG2  THR  46          3HG2      THR  46  10.673  11.759  -2.885
  324    H    SER  47           H        SER  47  14.644  15.109  -2.052
  325    HA   SER  47           HA       SER  47  14.528  17.048  -0.893
  326   1HB   SER  47          2HB       SER  47  12.120  17.690  -0.335
  327   2HB   SER  47          1HB       SER  47  12.473  17.262  -2.006
  328    HG   SER  47           HG       SER  47  11.039  15.824  -0.058
  329    H    ALA  48           H        ALA  48  15.162  14.709   0.825
  330    HA   ALA  48           HA       ALA  48  15.548  14.225   3.002
  331   1HB   ALA  48          1HB       ALA  48  14.405  16.940   3.642
  332   2HB   ALA  48          2HB       ALA  48  16.093  16.607   3.262
  333   3HB   ALA  48          3HB       ALA  48  15.365  15.922   4.714
  334    H    ILE  49           H        ILE  49  12.407  15.690   2.388
  335    HA   ILE  49           HA       ILE  49  11.160  13.512   3.941
  336    HB   ILE  49           HB       ILE  49   9.916  16.198   3.298
  337   1HG1  ILE  49          2HG1      ILE  49  11.012  15.218   5.945
  338   2HG1  ILE  49          1HG1      ILE  49  11.805  16.397   4.905
  339   1HG2  ILE  49          1HG2      ILE  49   8.315  14.379   3.540
  340   2HG2  ILE  49          2HG2      ILE  49   8.188  15.510   4.887
  341   3HG2  ILE  49          3HG2      ILE  49   9.007  13.963   5.108
  342   1HD1  ILE  49          1HD1      ILE  49  10.656  17.488   6.732
  343   2HD1  ILE  49          2HD1      ILE  49   9.136  16.733   6.251
  344   3HD1  ILE  49          3HD1      ILE  49   9.908  17.912   5.192
  345    HA   PRO  50           HA       PRO  50  10.385  12.523  -0.392
  346   1HB   PRO  50          2HB       PRO  50   9.229  10.058   0.743
  347   2HB   PRO  50          1HB       PRO  50  10.545  10.260  -0.417
  348   1HG   PRO  50          2HG       PRO  50  11.011   9.494   2.110
  349   2HG   PRO  50          1HG       PRO  50  12.140  10.534   1.225
  350   1HD   PRO  50          2HD       PRO  50  10.118  11.271   3.307
  351   2HD   PRO  50          1HD       PRO  50  11.776  11.869   3.083
  352    H    ASP  51           H        ASP  51   8.774  13.975  -0.839
  353    HA   ASP  51           HA       ASP  51   6.100  13.754   0.075
  354   1HB   ASP  51          2HB       ASP  51   7.343  15.199  -2.259
  355   2HB   ASP  51          1HB       ASP  51   5.607  15.217  -1.975
  356    H    ASN  52           H        ASN  52   7.847  11.829  -1.979
  357    HA   ASN  52           HA       ASN  52   5.976  11.296  -4.029
  358   1HB   ASN  52          2HB       ASN  52   8.482  10.826  -4.044
  359   2HB   ASN  52          1HB       ASN  52   8.125   9.408  -3.066
  360   1HD2  ASN  52          1HD2      ASN  52   8.996   8.139  -4.764
  361   2HD2  ASN  52          2HD2      ASN  52   8.071   7.804  -6.187
  362    H    TYR  53           H        TYR  53   6.156  10.368  -0.763
  363    HA   TYR  53           HA       TYR  53   4.661   7.908  -0.794
  364   1HB   TYR  53          2HB       TYR  53   5.029   9.983   1.385
  365   2HB   TYR  53          1HB       TYR  53   4.413   8.354   1.609
  366    HD1  TYR  53           1HD      TYR  53   6.591   7.438  -0.611
  367    HD2  TYR  53           2HD      TYR  53   6.710   9.391   3.163
  368    HE1  TYR  53           1HE      TYR  53   8.883   6.622  -0.269
  369    HE2  TYR  53           2HE      TYR  53   9.002   8.582   3.515
  370    HH   TYR  53           HH       TYR  53  10.913   7.361   1.092
  371    H    LYS  54           H        LYS  54   3.690  10.698  -1.991
  372    HA   LYS  54           HA       LYS  54   0.917  10.061  -1.654
  373   1HB   LYS  54          2HB       LYS  54   0.272  12.327  -0.851
  374   2HB   LYS  54          1HB       LYS  54   1.186  11.413   0.339
  375   1HG   LYS  54          2HG       LYS  54   3.193  12.674  -0.217
  376   2HG   LYS  54          1HG       LYS  54   2.297  13.574  -1.440
  377   1HD   LYS  54          2HD       LYS  54   0.847  14.503   0.273
  378   2HD   LYS  54          1HD       LYS  54   1.668  13.550   1.510
  379   1HE   LYS  54          2HE       LYS  54   3.015  15.629  -0.211
  380   2HE   LYS  54          1HE       LYS  54   2.397  15.931   1.411
  381   1HZ   LYS  54          1HZ       LYS  54   4.832  15.426   1.242
  382   2HZ   LYS  54          2HZ       LYS  54   4.405  13.838   0.825
  383   3HZ   LYS  54          3HZ       LYS  54   3.967  14.455   2.336
  384    H    ASP  55           H        ASP  55  -0.372  11.074  -3.266
  385    HA   ASP  55           HA       ASP  55   1.157  12.515  -5.313
  386   1HB   ASP  55          2HB       ASP  55  -0.038  11.430  -6.917
  387   2HB   ASP  55          1HB       ASP  55  -0.350  10.264  -5.652
  388    H    THR  56           H        THR  56  -0.279  14.182  -6.511
  389    HA   THR  56           HA       THR  56  -1.790  15.651  -4.458
  390    HB   THR  56           HB       THR  56  -1.074  17.711  -5.784
  391    HG1  THR  56           1HG      THR  56   0.799  17.418  -7.065
  392   1HG2  THR  56          1HG2      THR  56   1.130  17.803  -4.690
  393   2HG2  THR  56          2HG2      THR  56   1.038  16.070  -4.374
  394   3HG2  THR  56          3HG2      THR  56  -0.110  17.169  -3.609
  395    H    THR  57           H        THR  57  -2.297  13.913  -7.179
  396    HA   THR  57           HA       THR  57  -4.180  15.820  -8.381
  397    HB   THR  57           HB       THR  57  -3.367  13.128  -9.482
  398    HG1  THR  57           1HG      THR  57  -1.720  15.032  -9.081
  399   1HG2  THR  57          1HG2      THR  57  -5.376  14.100 -10.480
  400   2HG2  THR  57          2HG2      THR  57  -4.040  14.132 -11.628
  401   3HG2  THR  57          3HG2      THR  57  -4.513  15.605 -10.783
  402    H    ASN  58           H        ASN  58  -4.009  12.401  -7.429
  403    HA   ASN  58           HA       ASN  58  -6.103  12.026  -5.824
  404   1HB   ASN  58          2HB       ASN  58  -8.087  11.442  -7.090
  405   2HB   ASN  58          1HB       ASN  58  -7.619  13.086  -7.497
  406   1HD2  ASN  58          1HD2      ASN  58  -7.018  13.568  -9.559
  407   2HD2  ASN  58          2HD2      ASN  58  -7.133  12.450 -10.878
  408    H    LYS  59           H        LYS  59  -3.618  10.848  -7.269
  409    HA   LYS  59           HA       LYS  59  -4.515   8.094  -7.190
  410   1HB   LYS  59          2HB       LYS  59  -3.259   7.874  -9.548
  411   2HB   LYS  59          1HB       LYS  59  -4.991   8.121  -9.390
  412   1HG   LYS  59          2HG       LYS  59  -4.354   9.643 -11.023
  413   2HG   LYS  59          1HG       LYS  59  -4.460  10.623  -9.561
  414   1HD   LYS  59          2HD       LYS  59  -2.474  11.235 -10.776
  415   2HD   LYS  59          1HD       LYS  59  -1.999  10.395  -9.299
  416   1HE   LYS  59          2HE       LYS  59  -0.666   9.631 -11.178
  417   2HE   LYS  59          1HE       LYS  59  -1.692   8.330 -10.581
  418   1HZ   LYS  59          1HZ       LYS  59  -1.715   8.379 -12.977
  419   2HZ   LYS  59          2HZ       LYS  59  -2.210  10.004 -12.983
  420   3HZ   LYS  59          3HZ       LYS  59  -3.249   8.804 -12.395
  421    H    LYS  60           H        LYS  60  -3.001   8.123  -5.383
  422    HA   LYS  60           HA       LYS  60  -0.506   6.978  -6.427
  423   1HB   LYS  60          2HB       LYS  60   0.066   9.156  -5.412
  424   2HB   LYS  60          1HB       LYS  60  -0.703   8.656  -3.913
  425   1HG   LYS  60          2HG       LYS  60   1.471   8.213  -3.400
  426   2HG   LYS  60          1HG       LYS  60   1.013   6.659  -4.094
  427   1HD   LYS  60          2HD       LYS  60   3.132   7.300  -5.008
  428   2HD   LYS  60          1HD       LYS  60   1.915   7.442  -6.279
  429   1HE   LYS  60          2HE       LYS  60   1.837   9.812  -6.043
  430   2HE   LYS  60          1HE       LYS  60   2.818   9.760  -4.579
  431   1HZ   LYS  60          1HZ       LYS  60   4.712   9.128  -5.830
  432   2HZ   LYS  60          2HZ       LYS  60   4.026  10.451  -6.623
  433   3HZ   LYS  60          3HZ       LYS  60   3.807   8.886  -7.237
  434    H    ILE  61           H        ILE  61  -0.356   4.898  -5.842
  435    HA   ILE  61           HA       ILE  61  -1.289   4.145  -3.159
  436    HB   ILE  61           HB       ILE  61  -2.014   1.936  -3.995
  437   1HG1  ILE  61          2HG1      ILE  61  -1.628   3.174  -6.731
  438   2HG1  ILE  61          1HG1      ILE  61  -0.744   1.799  -6.070
  439   1HG2  ILE  61          1HG2      ILE  61  -3.659   3.643  -3.576
  440   2HG2  ILE  61          2HG2      ILE  61  -4.133   2.681  -4.977
  441   3HG2  ILE  61          3HG2      ILE  61  -3.443   4.288  -5.205
  442   1HD1  ILE  61          1HD1      ILE  61  -3.681   1.878  -6.730
  443   2HD1  ILE  61          2HD1      ILE  61  -2.827   0.507  -6.023
  444   3HD1  ILE  61          3HD1      ILE  61  -2.417   1.059  -7.648
  445    H    THR  62           H        THR  62   0.131   2.968  -2.021
  446    HA   THR  62           HA       THR  62   2.635   2.259  -3.351
  447    HB   THR  62           HB       THR  62   1.970   2.488  -0.414
  448    HG1  THR  62           1HG      THR  62   3.634   4.232  -0.740
  449   1HG2  THR  62          1HG2      THR  62   4.360   2.210  -0.021
  450   2HG2  THR  62          2HG2      THR  62   4.609   1.886  -1.737
  451   3HG2  THR  62          3HG2      THR  62   3.658   0.770  -0.754
  452    H    ASN  63           H        ASN  63   2.865   0.304  -4.054
  453    HA   ASN  63           HA       ASN  63   2.952  -2.048  -2.749
  454   1HB   ASN  63          2HB       ASN  63   0.573  -1.834  -2.126
  455   2HB   ASN  63          1HB       ASN  63   0.141  -1.753  -3.831
  456   1HD2  ASN  63          1HD2      ASN  63   2.592  -3.851  -2.411
  457   2HD2  ASN  63          2HD2      ASN  63   1.781  -5.332  -2.765
  458    HA   PRO  64           HA       PRO  64   1.971  -3.257  -7.201
  459   1HB   PRO  64          2HB       PRO  64   1.008  -1.309  -8.932
  460   2HB   PRO  64          1HB       PRO  64   0.025  -2.423  -7.984
  461   1HG   PRO  64          2HG       PRO  64   0.244   0.404  -7.692
  462   2HG   PRO  64          1HG       PRO  64  -0.697  -0.714  -6.698
  463   1HD   PRO  64          2HD       PRO  64   1.934   0.509  -6.185
  464   2HD   PRO  64          1HD       PRO  64   0.745  -0.130  -5.026
  465    H    PHE  65           H        PHE  65   2.791  -3.140  -9.466
  466    HA   PHE  65           HA       PHE  65   5.010  -1.242  -9.789
  467   1HB   PHE  65          2HB       PHE  65   6.390  -3.183 -10.684
  468   2HB   PHE  65          1HB       PHE  65   6.131  -3.151  -8.947
  469    HD1  PHE  65           1HD      PHE  65   4.864  -4.876  -7.849
  470    HD2  PHE  65           2HD      PHE  65   5.244  -4.830 -12.090
  471    HE1  PHE  65           1HE      PHE  65   3.993  -7.173  -7.951
  472    HE2  PHE  65           2HE      PHE  65   4.372  -7.126 -12.194
  473    HZ   PHE  65           HZ       PHE  65   3.760  -8.310 -10.094
  474    H    GLY  66           H        GLY  66   2.370  -1.330 -11.002
  475   1HA   GLY  66          2HA       GLY  66   2.931  -2.254 -13.737
  476   2HA   GLY  66          1HA       GLY  66   1.346  -1.876 -13.083
  477    H    GLY  67           H        GLY  67   3.114   0.548 -11.979
  478   1HA   GLY  67          2HA       GLY  67   2.988   2.167 -14.429
  479   2HA   GLY  67          1HA       GLY  67   2.185   2.722 -12.959
  480    H    GLU  68           H        GLU  68   3.425   4.473 -12.425
  481    HA   GLU  68           HA       GLU  68   6.313   4.195 -12.373
  482   1HB   GLU  68          2HB       GLU  68   4.427   6.456 -11.754
  483   2HB   GLU  68          1HB       GLU  68   6.159   6.577 -11.462
  484   1HG   GLU  68          2HG       GLU  68   5.682   7.616 -13.549
  485   2HG   GLU  68          1HG       GLU  68   6.529   6.108 -13.879
  486    H    LEU  69           H        LEU  69   6.860   2.841 -10.807
  487    HA   LEU  69           HA       LEU  69   5.754   3.146  -8.126
  488   1HB   LEU  69          2HB       LEU  69   6.431   0.967  -7.665
  489   2HB   LEU  69          1HB       LEU  69   5.895   0.902  -9.329
  490    HG   LEU  69           HG       LEU  69   8.799   1.096  -8.513
  491   1HD1  LEU  69          1HD1      LEU  69   7.856  -0.974  -7.682
  492   2HD1  LEU  69          2HD1      LEU  69   8.922  -1.289  -9.050
  493   3HD1  LEU  69          3HD1      LEU  69   7.173  -1.323  -9.269
  494   1HD2  LEU  69          1HD2      LEU  69   7.410   0.603 -11.136
  495   2HD2  LEU  69          2HD2      LEU  69   9.091   0.157 -10.852
  496   3HD2  LEU  69          3HD2      LEU  69   8.602   1.845 -10.739
  497    H    ASN  70           H        ASN  70   6.940   3.591  -6.329
  498    HA   ASN  70           HA       ASN  70   9.770   4.326  -6.680
  499   1HB   ASN  70          2HB       ASN  70   8.304   6.063  -5.698
  500   2HB   ASN  70          1HB       ASN  70   7.861   4.949  -4.408
  501   1HD2  ASN  70          1HD2      ASN  70   8.661   6.155  -2.734
  502   2HD2  ASN  70          2HD2      ASN  70  10.351   6.440  -2.499
  503    H    VAL  71           H        VAL  71  11.308   3.029  -5.805
  504    HA   VAL  71           HA       VAL  71  10.369   0.641  -4.423
  505    HB   VAL  71           HB       VAL  71  12.683  -0.212  -4.763
  506   1HG1  VAL  71          1HG1      VAL  71  12.475  -0.530  -7.179
  507   2HG1  VAL  71          2HG1      VAL  71  11.300   0.783  -7.252
  508   3HG1  VAL  71          3HG1      VAL  71  10.914  -0.697  -6.375
  509   1HG2  VAL  71          1HG2      VAL  71  13.877   1.915  -4.799
  510   2HG2  VAL  71          2HG2      VAL  71  13.062   2.361  -6.298
  511   3HG2  VAL  71          3HG2      VAL  71  14.188   1.002  -6.277
  512    H    GLY  72           H        GLY  72  10.866   0.084  -2.367
  513   1HA   GLY  72          2HA       GLY  72  13.082   1.082  -0.931
  514   2HA   GLY  72          1HA       GLY  72  11.649   1.994  -0.489
  515    HA   PRO  73           HA       PRO  73  11.487  -1.993   1.922
  516   1HB   PRO  73          2HB       PRO  73  13.484  -1.964   3.651
  517   2HB   PRO  73          1HB       PRO  73  13.790  -2.374   1.958
  518   1HG   PRO  73          2HG       PRO  73  14.431   0.119   3.436
  519   2HG   PRO  73          1HG       PRO  73  15.272  -0.631   2.069
  520   1HD   PRO  73          2HD       PRO  73  13.343   1.495   2.001
  521   2HD   PRO  73          1HD       PRO  73  14.159   0.719   0.630
  522    H    ALA  74           H        ALA  74  10.571  -2.256   4.034
  523    HA   ALA  74           HA       ALA  74  10.186   0.293   5.472
  524   1HB   ALA  74          1HB       ALA  74   8.271  -2.015   5.336
  525   2HB   ALA  74          2HB       ALA  74   8.145  -0.515   4.418
  526   3HB   ALA  74          3HB       ALA  74   8.013  -0.489   6.176
  527    H    ASN  75           H        ASN  75  11.919   0.012   6.829
  528    HA   ASN  75           HA       ASN  75  12.853  -0.324   8.842
  529   1HB   ASN  75          2HB       ASN  75  10.552   0.158   9.619
  530   2HB   ASN  75          1HB       ASN  75  10.205  -1.568   9.590
  531   1HD2  ASN  75          1HD2      ASN  75   9.741  -1.538  11.798
  532   2HD2  ASN  75          2HD2      ASN  75  10.986  -1.433  12.994
  533    H    ASN  76           H        ASN  76  10.821  -3.230   8.785
  534    HA   ASN  76           HA       ASN  76  13.187  -4.927   8.692
  535   1HB   ASN  76          2HB       ASN  76  11.446  -4.612  11.101
  536   2HB   ASN  76          1HB       ASN  76  12.078  -6.211  10.721
  537   1HD2  ASN  76          1HD2      ASN  76  14.556  -5.320   9.615
  538   2HD2  ASN  76          2HD2      ASN  76  15.510  -4.714  10.925
  539    H    ASN  77           H        ASN  77  12.817  -6.858   7.771
  540    HA   ASN  77           HA       ASN  77  10.570  -7.009   6.098
  541   1HB   ASN  77          2HB       ASN  77  12.957  -7.997   5.796
  542   2HB   ASN  77          1HB       ASN  77  12.300  -9.397   6.643
  543   1HD2  ASN  77          1HD2      ASN  77  10.774 -10.696   5.623
  544   2HD2  ASN  77          2HD2      ASN  77  10.414 -10.541   3.931
  545    H    THR  78           H        THR  78  11.100  -8.312   9.258
  546    HA   THR  78           HA       THR  78   9.072 -10.331   9.059
  547    HB   THR  78           HB       THR  78   9.386 -10.234  11.667
  548    HG1  THR  78           1HG      THR  78  11.963  -9.474  11.347
  549   1HG2  THR  78          1HG2      THR  78  11.535 -11.187   9.773
  550   2HG2  THR  78          2HG2      THR  78  10.098 -12.086  10.254
  551   3HG2  THR  78          3HG2      THR  78  11.345 -11.712  11.445
  552    H    ALA  79           H        ALA  79   8.937  -7.032   9.295
  553    HA   ALA  79           HA       ALA  79   6.265  -7.148  10.538
  554   1HB   ALA  79          1HB       ALA  79   6.524  -4.754  11.028
  555   2HB   ALA  79          2HB       ALA  79   8.138  -4.788  10.316
  556   3HB   ALA  79          3HB       ALA  79   7.801  -5.709  11.783
  557    H    PHE  80           H        PHE  80   8.113  -5.195   8.229
  558    HA   PHE  80           HA       PHE  80   5.944  -5.550   6.273
  559   1HB   PHE  80          2HB       PHE  80   7.635  -3.059   6.428
  560   2HB   PHE  80          1HB       PHE  80   6.173  -3.317   5.490
  561    HD1  PHE  80           1HD      PHE  80   7.526  -2.125   8.558
  562    HD2  PHE  80           2HD      PHE  80   3.990  -3.647   6.749
  563    HE1  PHE  80           1HE      PHE  80   6.181  -1.146  10.370
  564    HE2  PHE  80           2HE      PHE  80   2.638  -2.670   8.556
  565    HZ   PHE  80           HZ       PHE  80   3.736  -1.463  10.398
  566    H    GLY  81           H        GLY  81   6.972  -4.987   3.967
  567   1HA   GLY  81          2HA       GLY  81   9.617  -6.313   4.025
  568   2HA   GLY  81          1HA       GLY  81   8.385  -6.716   2.834
  569    H    TYR  82           H        TYR  82   7.569  -4.820   1.604
  570    HA   TYR  82           HA       TYR  82   9.673  -2.900   0.987
  571   1HB   TYR  82          2HB       TYR  82   9.345  -3.455  -1.474
  572   2HB   TYR  82          1HB       TYR  82  10.159  -4.711  -0.544
  573    HD1  TYR  82           1HD      TYR  82   8.979  -6.807   0.020
  574    HD2  TYR  82           2HD      TYR  82   7.152  -3.837  -2.426
  575    HE1  TYR  82           1HE      TYR  82   7.277  -8.438  -0.683
  576    HE2  TYR  82           2HE      TYR  82   5.451  -5.463  -3.132
  577    HH   TYR  82           HH       TYR  82   4.911  -8.366  -1.552
  578    H    TYR  83           H        TYR  83   8.872  -1.042  -0.067
  579    HA   TYR  83           HA       TYR  83   5.963  -0.993  -0.435
  580   1HB   TYR  83          2HB       TYR  83   5.799   1.221   0.471
  581   2HB   TYR  83          1HB       TYR  83   6.628   0.222   1.652
  582    HD1  TYR  83           1HD      TYR  83   8.990   0.554   2.126
  583    HD2  TYR  83           2HD      TYR  83   6.925   3.037  -0.644
  584    HE1  TYR  83           1HE      TYR  83  10.829   2.195   2.228
  585    HE2  TYR  83           2HE      TYR  83   8.750   4.677  -0.553
  586    HH   TYR  83           HH       TYR  83  10.571   5.292   1.242
  587    H    LEU  84           H        LEU  84   5.290  -0.162  -2.300
  588    HA   LEU  84           HA       LEU  84   7.285   1.129  -4.030
  589   1HB   LEU  84          2HB       LEU  84   5.091  -0.778  -4.860
  590   2HB   LEU  84          1HB       LEU  84   6.194   0.041  -5.948
  591    HG   LEU  84           HG       LEU  84   7.031  -1.975  -3.863
  592   1HD1  LEU  84          1HD1      LEU  84   7.372  -3.495  -5.736
  593   2HD1  LEU  84          2HD1      LEU  84   6.745  -2.277  -6.847
  594   3HD1  LEU  84          3HD1      LEU  84   5.685  -2.993  -5.634
  595   1HD2  LEU  84          1HD2      LEU  84   8.551  -0.640  -6.098
  596   2HD2  LEU  84          2HD2      LEU  84   9.169  -1.933  -5.071
  597   3HD2  LEU  84          3HD2      LEU  84   8.774  -0.362  -4.371
  598    H    THR  85           H        THR  85   6.642   3.240  -3.784
  599    HA   THR  85           HA       THR  85   3.840   3.893  -3.599
  600    HB   THR  85           HB       THR  85   5.929   5.999  -3.980
  601    HG1  THR  85           1HG      THR  85   5.630   5.116  -1.357
  602   1HG2  THR  85          1HG2      THR  85   3.609   6.643  -3.646
  603   2HG2  THR  85          2HG2      THR  85   4.584   7.127  -2.257
  604   3HG2  THR  85          3HG2      THR  85   3.546   5.705  -2.153
  605    H    LEU  86           H        LEU  86   2.760   3.680  -5.426
  606    HA   LEU  86           HA       LEU  86   4.021   4.567  -7.929
  607   1HB   LEU  86          2HB       LEU  86   3.746   2.120  -7.616
  608   2HB   LEU  86          1HB       LEU  86   2.019   2.353  -7.477
  609    HG   LEU  86           HG       LEU  86   3.382   3.289  -9.958
  610   1HD1  LEU  86          1HD1      LEU  86   4.292   1.065  -9.594
  611   2HD1  LEU  86          2HD1      LEU  86   3.127   1.050 -10.918
  612   3HD1  LEU  86          3HD1      LEU  86   2.668   0.429  -9.333
  613   1HD2  LEU  86          1HD2      LEU  86   0.707   2.026  -9.375
  614   2HD2  LEU  86          2HD2      LEU  86   1.259   2.594 -10.953
  615   3HD2  LEU  86          3HD2      LEU  86   1.011   3.745  -9.637
  616    H    THR  87           H        THR  87   2.962   6.099  -9.078
  617    HA   THR  87           HA       THR  87   0.479   7.130  -8.085
  618    HB   THR  87           HB       THR  87   0.713   8.326 -10.491
  619    HG1  THR  87           1HG      THR  87   2.612   8.017 -11.347
  620   1HG2  THR  87          1HG2      THR  87   1.909  10.124  -9.380
  621   2HG2  THR  87          2HG2      THR  87   2.390   9.028  -8.085
  622   3HG2  THR  87          3HG2      THR  87   0.689   9.446  -8.303
  623    H    ARG  88           H        ARG  88  -1.450   6.422  -8.565
  624    HA   ARG  88           HA       ARG  88  -2.683   5.859 -10.878
  625   1HB   ARG  88          2HB       ARG  88  -0.746   3.974 -10.889
  626   2HB   ARG  88          1HB       ARG  88  -1.942   3.126  -9.926
  627   1HG   ARG  88          2HG       ARG  88  -3.567   3.300 -11.696
  628   2HG   ARG  88          1HG       ARG  88  -2.446   4.262 -12.663
  629   1HD   ARG  88          2HD       ARG  88  -2.356   2.021 -13.472
  630   2HD   ARG  88          1HD       ARG  88  -0.856   2.339 -12.593
  631    HE   ARG  88           HE       ARG  88  -3.107   0.935 -11.305
  632   1HH1  ARG  88          1HH1      ARG  88   0.288   1.117 -12.158
  633   2HH1  ARG  88          2HH1      ARG  88   0.669  -0.409 -11.432
  634   1HH2  ARG  88          1HH2      ARG  88  -2.602  -1.044 -10.333
  635   2HH2  ARG  88          2HH2      ARG  88  -0.974  -1.665 -10.429
  636    H    LEU  89           H        LEU  89  -4.769   5.868 -10.240
  637    HA   LEU  89           HA       LEU  89  -5.870   4.110  -8.354
  638   1HB   LEU  89          2HB       LEU  89  -4.545   5.533  -6.781
  639   2HB   LEU  89          1HB       LEU  89  -5.507   6.910  -7.278
  640    HG   LEU  89           HG       LEU  89  -7.520   5.856  -6.359
  641   1HD1  LEU  89          1HD1      LEU  89  -6.935   3.520  -6.714
  642   2HD1  LEU  89          2HD1      LEU  89  -7.339   3.812  -5.022
  643   3HD1  LEU  89          3HD1      LEU  89  -5.653   3.647  -5.510
  644   1HD2  LEU  89          1HD2      LEU  89  -5.221   5.890  -4.412
  645   2HD2  LEU  89          2HD2      LEU  89  -6.932   6.014  -4.004
  646   3HD2  LEU  89          3HD2      LEU  89  -6.152   7.294  -4.932
  647    H    ASP  90           H        ASP  90  -8.118   4.515  -7.979
  648    HA   ASP  90           HA       ASP  90  -9.374   6.533  -9.672
  649   1HB   ASP  90          2HB       ASP  90  -9.176   4.494 -11.060
  650   2HB   ASP  90          1HB       ASP  90  -9.982   3.561  -9.804
  651    H    LYS  91           H        LYS  91 -11.673   6.835  -9.088
  652    HA   LYS  91           HA       LYS  91 -12.096   6.872  -6.321
  653   1HB   LYS  91          2HB       LYS  91 -13.300   8.285  -8.012
  654   2HB   LYS  91          1HB       LYS  91 -14.258   6.871  -8.436
  655   1HG   LYS  91          2HG       LYS  91 -15.464   8.314  -6.896
  656   2HG   LYS  91          1HG       LYS  91 -15.112   6.750  -6.153
  657   1HD   LYS  91          2HD       LYS  91 -13.143   7.762  -5.052
  658   2HD   LYS  91          1HD       LYS  91 -13.601   9.329  -5.721
  659   1HE   LYS  91          2HE       LYS  91 -15.833   8.992  -4.542
  660   2HE   LYS  91          1HE       LYS  91 -15.053   7.660  -3.688
  661   1HZ   LYS  91          1HZ       LYS  91 -14.880  10.442  -3.185
  662   2HZ   LYS  91          2HZ       LYS  91 -13.334   9.826  -3.496
  663   3HZ   LYS  91          3HZ       LYS  91 -14.282   9.151  -2.257
  664    H    ALA  92           H        ALA  92 -13.114   4.541  -8.774
  665    HA   ALA  92           HA       ALA  92 -14.621   2.958  -6.901
  666   1HB   ALA  92          1HB       ALA  92 -14.874   1.384  -8.734
  667   2HB   ALA  92          2HB       ALA  92 -13.670   2.266  -9.677
  668   3HB   ALA  92          3HB       ALA  92 -15.209   3.027  -9.276
  669    H    ALA  93           H        ALA  93 -11.335   3.191  -7.873
  670    HA   ALA  93           HA       ALA  93 -10.522   0.565  -7.156
  671   1HB   ALA  93          1HB       ALA  93  -8.246   1.474  -7.160
  672   2HB   ALA  93          2HB       ALA  93  -8.904   3.104  -7.299
  673   3HB   ALA  93          3HB       ALA  93  -9.143   1.943  -8.605
  674    H    CYS  94           H        CYS  94 -10.687   3.656  -5.426
  675    HA   CYS  94           HA       CYS  94  -9.693   2.867  -2.951
  676   1HB   CYS  94          2HB       CYS  94 -11.939   4.763  -3.654
  677   2HB   CYS  94          1HB       CYS  94 -11.377   4.530  -2.003
  678    H    VAL  95           H        VAL  95 -12.957   2.565  -4.262
  679    HA   VAL  95           HA       VAL  95 -14.083   1.282  -2.012
  680    HB   VAL  95           HB       VAL  95 -14.950   1.268  -4.903
  681   1HG1  VAL  95          1HG1      VAL  95 -15.956  -0.606  -3.748
  682   2HG1  VAL  95          2HG1      VAL  95 -17.173   0.639  -4.028
  683   3HG1  VAL  95          3HG1      VAL  95 -16.463   0.446  -2.427
  684   1HG2  VAL  95          1HG2      VAL  95 -16.557   2.984  -4.187
  685   2HG2  VAL  95          2HG2      VAL  95 -14.886   3.501  -3.957
  686   3HG2  VAL  95          3HG2      VAL  95 -15.842   2.965  -2.574
  687    H    SER  96           H        SER  96 -12.580   0.118  -4.952
  688    HA   SER  96           HA       SER  96 -13.186  -2.604  -4.653
  689   1HB   SER  96          2HB       SER  96 -12.445  -1.598  -6.758
  690   2HB   SER  96          1HB       SER  96 -10.861  -1.282  -6.057
  691    HG   SER  96           HG       SER  96 -11.806  -3.907  -5.983
  692    H    LEU  97           H        LEU  97 -10.475  -0.665  -3.464
  693    HA   LEU  97           HA       LEU  97  -8.958  -2.915  -2.586
  694   1HB   LEU  97          2HB       LEU  97  -8.767  -0.002  -1.840
  695   2HB   LEU  97          1HB       LEU  97  -7.589  -1.224  -1.398
  696    HG   LEU  97           HG       LEU  97  -8.258  -0.344  -4.209
  697   1HD1  LEU  97          1HD1      LEU  97  -6.006   0.584  -4.218
  698   2HD1  LEU  97          2HD1      LEU  97  -5.788   0.097  -2.537
  699   3HD1  LEU  97          3HD1      LEU  97  -6.989   1.320  -2.951
  700   1HD2  LEU  97          1HD2      LEU  97  -6.371  -1.757  -4.876
  701   2HD2  LEU  97          2HD2      LEU  97  -7.671  -2.701  -4.149
  702   3HD2  LEU  97          3HD2      LEU  97  -6.220  -2.333  -3.216
  703    H    ALA  98           H        ALA  98 -11.463  -0.963  -1.150
  704    HA   ALA  98           HA       ALA  98 -11.000  -2.108   1.482
  705   1HB   ALA  98          1HB       ALA  98 -13.218  -0.299   0.547
  706   2HB   ALA  98          2HB       ALA  98 -11.712   0.229   1.300
  707   3HB   ALA  98          3HB       ALA  98 -12.864  -0.743   2.217
  708    H    THR  99           H        THR  99 -12.723  -2.833  -1.332
  709    HA   THR  99           HA       THR  99 -14.359  -4.815   0.078
  710    HB   THR  99           HB       THR  99 -15.370  -5.218  -2.197
  711    HG1  THR  99           1HG      THR  99 -14.102  -2.781  -2.920
  712   1HG2  THR  99          1HG2      THR  99 -16.731  -3.188  -2.194
  713   2HG2  THR  99          2HG2      THR  99 -15.550  -2.387  -1.157
  714   3HG2  THR  99          3HG2      THR  99 -16.460  -3.769  -0.550
  715    H    LEU 100           H        LEU 100 -11.357  -4.578  -0.756
  716    HA   LEU 100           HA       LEU 100 -11.083  -7.345  -1.711
  717   1HB   LEU 100          2HB       LEU 100  -9.823  -5.290  -2.758
  718   2HB   LEU 100          1HB       LEU 100  -8.822  -5.392  -1.322
  719    HG   LEU 100           HG       LEU 100  -9.180  -7.779  -3.123
  720   1HD1  LEU 100          1HD1      LEU 100  -8.443  -5.946  -4.543
  721   2HD1  LEU 100          2HD1      LEU 100  -7.139  -7.105  -4.286
  722   3HD1  LEU 100          3HD1      LEU 100  -7.143  -5.575  -3.409
  723   1HD2  LEU 100          1HD2      LEU 100  -6.997  -8.393  -2.214
  724   2HD2  LEU 100          2HD2      LEU 100  -8.172  -8.150  -0.922
  725   3HD2  LEU 100          3HD2      LEU 100  -6.967  -6.909  -1.262
  726    H    ASN 101           H        ASN 101 -10.116  -8.852  -0.307
  727    HA   ASN 101           HA       ASN 101 -10.202  -8.059   2.451
  728   1HB   ASN 101          2HB       ASN 101 -11.087 -10.241   1.831
  729   2HB   ASN 101          1HB       ASN 101  -9.499 -10.739   1.248
  730   1HD2  ASN 101          1HD2      ASN 101 -11.316  -9.772   4.092
  731   2HD2  ASN 101          2HD2      ASN 101 -10.309 -10.594   5.237
  732    H    LEU 102           H        LEU 102  -8.572  -6.630   2.733
  733    HA   LEU 102           HA       LEU 102  -5.819  -7.367   2.269
  734   1HB   LEU 102          2HB       LEU 102  -7.217  -5.007   3.476
  735   2HB   LEU 102          1HB       LEU 102  -5.513  -5.243   3.798
  736    HG   LEU 102           HG       LEU 102  -5.841  -3.661   1.977
  737   1HD1  LEU 102          1HD1      LEU 102  -4.408  -4.687   0.303
  738   2HD1  LEU 102          2HD1      LEU 102  -4.732  -6.280   0.989
  739   3HD1  LEU 102          3HD1      LEU 102  -3.856  -5.076   1.933
  740   1HD2  LEU 102          1HD2      LEU 102  -6.815  -4.311  -0.137
  741   2HD2  LEU 102          2HD2      LEU 102  -7.993  -4.508   1.161
  742   3HD2  LEU 102          3HD2      LEU 102  -7.171  -5.920   0.495
  743    H    GLY 103           H        GLY 103  -7.197  -9.257   3.853
  744   1HA   GLY 103          2HA       GLY 103  -5.724  -8.951   6.393
  745   2HA   GLY 103          1HA       GLY 103  -7.378  -9.547   6.372
  746    H    THR 104           H        THR 104  -5.621 -10.550   3.678
  747    HA   THR 104           HA       THR 104  -4.982 -13.112   4.975
  748    HB   THR 104           HB       THR 104  -5.370 -14.025   2.556
  749    HG1  THR 104           1HG      THR 104  -7.288 -11.966   2.426
  750   1HG2  THR 104          1HG2      THR 104  -6.702 -14.663   4.508
  751   2HG2  THR 104          2HG2      THR 104  -7.726 -14.458   3.088
  752   3HG2  THR 104          3HG2      THR 104  -7.677 -13.206   4.330
  753    H    SER 105           H        SER 105  -4.242 -11.179   2.063
  754    HA   SER 105           HA       SER 105  -1.488 -12.221   2.190
  755   1HB   SER 105          2HB       SER 105  -1.390 -11.586  -0.223
  756   2HB   SER 105          1HB       SER 105  -2.613 -12.807   0.126
  757    HG   SER 105           HG       SER 105  -2.908 -10.152  -0.661
  758    H    ALA 106           H        ALA 106  -2.726  -9.841   3.603
  759    HA   ALA 106           HA       ALA 106  -1.085  -7.725   2.383
  760   1HB   ALA 106          1HB       ALA 106  -2.507  -6.125   3.559
  761   2HB   ALA 106          2HB       ALA 106  -3.437  -7.455   4.252
  762   3HB   ALA 106          3HB       ALA 106  -3.456  -7.176   2.510
  763    H    LYS 107           H        LYS 107  -0.173  -6.145   3.972
  764    HA   LYS 107           HA       LYS 107   0.419  -7.445   6.525
  765   1HB   LYS 107          2HB       LYS 107   2.299  -6.554   4.516
  766   2HB   LYS 107          1HB       LYS 107   2.605  -5.794   6.076
  767   1HG   LYS 107          2HG       LYS 107   3.232  -7.722   7.054
  768   2HG   LYS 107          1HG       LYS 107   2.055  -8.684   6.163
  769   1HD   LYS 107          2HD       LYS 107   4.129  -9.422   5.382
  770   2HD   LYS 107          1HD       LYS 107   3.553  -8.316   4.136
  771   1HE   LYS 107          2HE       LYS 107   4.954  -6.542   5.063
  772   2HE   LYS 107          1HE       LYS 107   5.542  -7.655   6.301
  773   1HZ   LYS 107          1HZ       LYS 107   6.504  -9.036   4.597
  774   2HZ   LYS 107          2HZ       LYS 107   7.071  -7.452   4.413
  775   3HZ   LYS 107          3HZ       LYS 107   5.874  -8.042   3.366
  776    H    GLY 108           H        GLY 108  -0.440  -4.611   4.785
  777   1HA   GLY 108          2HA       GLY 108  -1.586  -3.398   7.064
  778   2HA   GLY 108          1HA       GLY 108  -0.066  -2.602   6.678
  779    H    TYR 109           H        TYR 109  -2.701  -1.426   6.566
  780    HA   TYR 109           HA       TYR 109  -2.587  -0.507   3.799
  781   1HB   TYR 109          2HB       TYR 109  -4.249  -2.389   3.912
  782   2HB   TYR 109          1HB       TYR 109  -5.167  -1.455   5.081
  783    HD1  TYR 109           1HD      TYR 109  -3.532  -0.089   2.060
  784    HD2  TYR 109           2HD      TYR 109  -7.196  -1.231   3.875
  785    HE1  TYR 109           1HE      TYR 109  -4.764   0.969   0.215
  786    HE2  TYR 109           2HE      TYR 109  -8.442  -0.178   2.037
  787    HH   TYR 109           HH       TYR 109  -8.099   1.554   0.331
  788    H    GLY 110           H        GLY 110  -2.650   1.706   3.807
  789   1HA   GLY 110          2HA       GLY 110  -4.016   3.040   6.040
  790   2HA   GLY 110          1HA       GLY 110  -2.295   3.322   5.827
  791    H    VAL 111           H        VAL 111  -5.241   4.598   5.249
  792    HA   VAL 111           HA       VAL 111  -4.663   5.656   2.596
  793    HB   VAL 111           HB       VAL 111  -7.090   6.185   4.326
  794   1HG1  VAL 111          1HG1      VAL 111  -8.140   6.869   2.223
  795   2HG1  VAL 111          2HG1      VAL 111  -6.620   6.591   1.374
  796   3HG1  VAL 111          3HG1      VAL 111  -6.728   7.859   2.594
  797   1HG2  VAL 111          1HG2      VAL 111  -8.238   4.521   2.923
  798   2HG2  VAL 111          2HG2      VAL 111  -6.931   3.807   3.865
  799   3HG2  VAL 111          3HG2      VAL 111  -6.702   4.133   2.146
  800    H    ASN 112           H        ASN 112  -3.834   7.604   2.257
  801    HA   ASN 112           HA       ASN 112  -3.028   9.691   2.557
  802   1HB   ASN 112          2HB       ASN 112  -5.011   9.682   4.802
  803   2HB   ASN 112          1HB       ASN 112  -3.870  11.012   4.633
  804   1HD2  ASN 112          1HD2      ASN 112  -6.728   9.554   3.466
  805   2HD2  ASN 112          2HD2      ASN 112  -7.085  10.708   2.232
  806    H    ILE 113           H        ILE 113  -2.001   7.191   3.995
  807    HA   ILE 113           HA       ILE 113  -0.319   8.443   6.002
  808    HB   ILE 113           HB       ILE 113  -0.647   5.625   5.028
  809   1HG1  ILE 113          2HG1      ILE 113  -0.727   5.185   7.484
  810   2HG1  ILE 113          1HG1      ILE 113  -0.542   6.911   7.764
  811   1HG2  ILE 113          1HG2      ILE 113   1.747   6.590   6.588
  812   2HG2  ILE 113          2HG2      ILE 113   1.761   5.958   4.941
  813   3HG2  ILE 113          3HG2      ILE 113   1.328   4.903   6.287
  814   1HD1  ILE 113          1HD1      ILE 113  -2.851   6.239   7.988
  815   2HD1  ILE 113          2HD1      ILE 113  -2.837   5.576   6.354
  816   3HD1  ILE 113          3HD1      ILE 113  -2.657   7.313   6.604
  817    H    SER 114           H        SER 114   1.597   9.325   5.588
  818    HA   SER 114           HA       SER 114   3.007   8.508   3.143
  819   1HB   SER 114          2HB       SER 114   2.802  11.286   4.326
  820   2HB   SER 114          1HB       SER 114   3.905  10.842   3.024
  821    HG   SER 114           HG       SER 114   1.847  10.044   1.978
  822    H    GLY 115           H        GLY 115   4.713   7.381   3.718
  823   1HA   GLY 115          2HA       GLY 115   6.930   7.744   4.972
  824   2HA   GLY 115          1HA       GLY 115   5.885   7.884   6.381
  825    H    GLU 116           H        GLU 116   5.889   5.754   3.574
  826    HA   GLU 116           HA       GLU 116   4.881   3.516   4.784
  827   1HB   GLU 116          2HB       GLU 116   6.701   3.835   2.409
  828   2HB   GLU 116          1HB       GLU 116   5.966   2.301   2.854
  829   1HG   GLU 116          2HG       GLU 116   4.453   3.017   1.346
  830   2HG   GLU 116          1HG       GLU 116   3.773   3.778   2.785
  831    H    ASN 117           H        ASN 117   8.166   4.659   4.835
  832    HA   ASN 117           HA       ASN 117   9.566   2.349   5.453
  833   1HB   ASN 117          2HB       ASN 117  10.069   5.074   6.663
  834   2HB   ASN 117          1HB       ASN 117  11.235   3.766   6.497
  835   1HD2  ASN 117          1HD2      ASN 117  12.066   3.284   4.447
  836   2HD2  ASN 117          2HD2      ASN 117  11.947   4.406   3.135
  837    H    ASN 118           H        ASN 118   7.464   4.280   7.471
  838    HA   ASN 118           HA       ASN 118   7.356   2.131   9.397
  839   1HB   ASN 118          2HB       ASN 118   9.241   3.562  10.215
  840   2HB   ASN 118          1HB       ASN 118   8.116   4.909  10.341
  841   1HD2  ASN 118          1HD2      ASN 118   8.472   5.093  12.554
  842   2HD2  ASN 118          2HD2      ASN 118   7.829   3.957  13.689
  843    H    ILE 119           H        ILE 119   5.290   2.189   8.238
  844    HA   ILE 119           HA       ILE 119   3.473   4.324   8.393
  845    HB   ILE 119           HB       ILE 119   3.202   2.569   6.752
  846   1HG1  ILE 119          2HG1      ILE 119   0.873   2.483   8.683
  847   2HG1  ILE 119          1HG1      ILE 119   1.171   3.781   7.535
  848   1HG2  ILE 119          1HG2      ILE 119   4.072   0.703   8.035
  849   2HG2  ILE 119          2HG2      ILE 119   2.490   0.313   7.360
  850   3HG2  ILE 119          3HG2      ILE 119   2.641   0.727   9.068
  851   1HD1  ILE 119          1HD1      ILE 119   0.641   0.907   6.819
  852   2HD1  ILE 119          2HD1      ILE 119   0.881   2.236   5.686
  853   3HD1  ILE 119          3HD1      ILE 119  -0.532   2.222   6.743
  854    H    THR 120           H        THR 120   1.627   4.610   9.669
  855    HA   THR 120           HA       THR 120   2.063   4.294  12.434
  856    HB   THR 120           HB       THR 120   0.858   6.205  11.436
  857    HG1  THR 120           1HG      THR 120  -0.989   6.099  12.992
  858   1HG2  THR 120          1HG2      THR 120  -0.425   5.005   9.741
  859   2HG2  THR 120          2HG2      THR 120  -1.488   5.964  10.772
  860   3HG2  THR 120          3HG2      THR 120  -1.372   4.219  11.004
  861    H    SER 121           H        SER 121   0.134   3.551  13.863
  862    HA   SER 121           HA       SER 121  -0.009   0.746  13.670
  863   1HB   SER 121          2HB       SER 121  -1.695   2.589  15.377
  864   2HB   SER 121          1HB       SER 121  -1.378   0.879  15.669
  865    HG   SER 121           HG       SER 121  -0.005   2.117  16.938
  866    H    PHE 122           H        PHE 122  -1.937  -0.585  13.531
  867    HA   PHE 122           HA       PHE 122  -3.715   0.469  11.439
  868   1HB   PHE 122          2HB       PHE 122  -3.055  -2.409  12.080
  869   2HB   PHE 122          1HB       PHE 122  -3.946  -1.820  10.682
  870    HD1  PHE 122           1HD      PHE 122  -2.749  -0.506   8.932
  871    HD2  PHE 122           2HD      PHE 122  -0.704  -2.476  12.102
  872    HE1  PHE 122           1HE      PHE 122  -0.651  -0.366   7.659
  873    HE2  PHE 122           2HE      PHE 122   1.400  -2.336  10.833
  874    HZ   PHE 122           HZ       PHE 122   1.426  -1.277   8.611
  875    H    GLY 123           H        GLY 123  -5.910   0.121  11.514
  876   1HA   GLY 123          2HA       GLY 123  -7.032  -1.363  13.782
  877   2HA   GLY 123          1HA       GLY 123  -7.536   0.303  13.537
  878    H    ASN 124           H        ASN 124  -9.476   0.412  12.604
  879    HA   ASN 124           HA       ASN 124  -9.998  -1.212  10.232
  880   1HB   ASN 124          2HB       ASN 124 -11.628  -1.335  12.755
  881   2HB   ASN 124          1HB       ASN 124 -12.369  -1.652  11.191
  882   1HD2  ASN 124          1HD2      ASN 124 -11.680  -3.459   9.992
  883   2HD2  ASN 124          2HD2      ASN 124 -10.872  -4.787  10.743
  884    H    SER 125           H        SER 125  -9.428   1.517  10.566
  885    HA   SER 125           HA       SER 125 -11.742   2.593   9.167
  886   1HB   SER 125          2HB       SER 125 -12.051   3.262  11.555
  887   2HB   SER 125          1HB       SER 125 -10.473   4.045  11.523
  888    HG   SER 125           HG       SER 125 -12.791   5.081  10.841
  889    H    ALA 126           H        ALA 126 -10.998   4.945   8.378
  890    HA   ALA 126           HA       ALA 126  -8.239   4.630   7.411
  891   1HB   ALA 126          1HB       ALA 126  -8.937   5.135   5.148
  892   2HB   ALA 126          2HB       ALA 126 -10.617   5.261   5.673
  893   3HB   ALA 126          3HB       ALA 126  -9.782   3.709   5.749
  894    H    ASP 127           H        ASP 127  -7.868   6.683   5.839
  895    HA   ASP 127           HA       ASP 127  -7.661   8.912   5.521
  896   1HB   ASP 127          2HB       ASP 127 -10.087   9.110   5.723
  897   2HB   ASP 127          1HB       ASP 127  -9.952   9.154   7.479
  898    H    GLN 128           H        GLN 128  -5.640   9.018   6.298
  899    HA   GLN 128           HA       GLN 128  -3.900   9.659   7.586
  900   1HB   GLN 128          2HB       GLN 128  -6.061  10.966   9.242
  901   2HB   GLN 128          1HB       GLN 128  -4.341  11.138   9.571
  902   1HG   GLN 128          2HG       GLN 128  -4.014  12.137   7.369
  903   2HG   GLN 128          1HG       GLN 128  -5.737  11.961   7.034
  904   1HE2  GLN 128          1HE2      GLN 128  -3.326  13.680   8.857
  905   2HE2  GLN 128          2HE2      GLN 128  -4.361  14.974   9.374
  906    H    ALA 129           H        ALA 129  -5.920   7.360   8.245
  907    HA   ALA 129           HA       ALA 129  -4.371   6.394  10.530
  908   1HB   ALA 129          1HB       ALA 129  -6.389   5.359  11.465
  909   2HB   ALA 129          2HB       ALA 129  -7.358   6.096  10.187
  910   3HB   ALA 129          3HB       ALA 129  -6.549   7.114  11.380
  911    H    ALA 130           H        ALA 130  -4.027   4.161  10.529
  912    HA   ALA 130           HA       ALA 130  -4.461   2.904   7.918
  913   1HB   ALA 130          1HB       ALA 130  -2.132   3.090   8.638
  914   2HB   ALA 130          2HB       ALA 130  -2.634   1.401   8.537
  915   3HB   ALA 130          3HB       ALA 130  -2.511   2.193  10.108
  916    H    LYS 131           H        LYS 131  -5.107   0.675   7.852
  917    HA   LYS 131           HA       LYS 131  -6.422  -0.278  10.300
  918   1HB   LYS 131          2HB       LYS 131  -8.378  -0.933   9.175
  919   2HB   LYS 131          1HB       LYS 131  -8.036   0.670   8.528
  920   1HG   LYS 131          2HG       LYS 131  -7.230  -1.881   7.147
  921   2HG   LYS 131          1HG       LYS 131  -8.759  -1.052   6.850
  922   1HD   LYS 131          2HD       LYS 131  -6.236   0.514   6.675
  923   2HD   LYS 131          1HD       LYS 131  -6.620  -0.609   5.371
  924   1HE   LYS 131          2HE       LYS 131  -7.406   1.744   5.010
  925   2HE   LYS 131          1HE       LYS 131  -8.661   0.514   4.897
  926   1HZ   LYS 131          1HZ       LYS 131  -8.147   2.209   7.281
  927   2HZ   LYS 131          2HZ       LYS 131  -9.380   1.053   7.116
  928   3HZ   LYS 131          3HZ       LYS 131  -9.391   2.441   6.153
  929    H    SER 132           H        SER 132  -6.593  -2.597  10.442
  930    HA   SER 132           HA       SER 132  -4.227  -3.802   9.277
  931   1HB   SER 132          2HB       SER 132  -5.101  -5.715  10.925
  932   2HB   SER 132          1HB       SER 132  -4.214  -4.306  11.511
  933    HG   SER 132           HG       SER 132  -6.958  -4.903  11.692
  934    H    THR 133           H        THR 133  -7.653  -3.928   8.861
  935    HA   THR 133           HA       THR 133  -7.283  -5.983   6.810
  936    HB   THR 133           HB       THR 133  -9.526  -6.973   7.528
  937    HG1  THR 133           1HG      THR 133  -8.868  -5.962  10.092
  938   1HG2  THR 133          1HG2      THR 133  -8.498  -8.453   9.210
  939   2HG2  THR 133          2HG2      THR 133  -7.135  -7.340   9.342
  940   3HG2  THR 133          3HG2      THR 133  -7.434  -8.190   7.827
  941    H    ALA 134           H        ALA 134  -8.626  -5.791   5.044
  942    HA   ALA 134           HA       ALA 134 -10.765  -3.790   5.204
  943   1HB   ALA 134          1HB       ALA 134  -8.964  -2.952   3.779
  944   2HB   ALA 134          2HB       ALA 134 -10.406  -3.300   2.825
  945   3HB   ALA 134          3HB       ALA 134  -9.044  -4.421   2.803
  946    H    ILE 135           H        ILE 135 -12.735  -4.456   4.574
  947    HA   ILE 135           HA       ILE 135 -13.393  -6.541   2.851
  948    HB   ILE 135           HB       ILE 135 -12.144  -7.887   4.604
  949   1HG1  ILE 135          2HG1      ILE 135 -13.911  -9.667   4.798
  950   2HG1  ILE 135          1HG1      ILE 135 -15.053  -8.522   4.101
  951   1HG2  ILE 135          1HG2      ILE 135 -14.508  -7.154   6.324
  952   2HG2  ILE 135          2HG2      ILE 135 -12.823  -6.702   6.588
  953   3HG2  ILE 135          3HG2      ILE 135 -13.309  -8.392   6.710
  954   1HD1  ILE 135          1HD1      ILE 135 -13.723  -8.414   2.073
  955   2HD1  ILE 135          2HD1      ILE 135 -14.195 -10.074   2.438
  956   3HD1  ILE 135          3HD1      ILE 135 -12.551  -9.529   2.772
  957    H    THR 136           H        THR 136 -14.198  -3.912   4.104
  958    HA   THR 136           HA       THR 136 -16.915  -4.600   4.975
  959    HB   THR 136           HB       THR 136 -15.151  -2.543   6.319
  960    HG1  THR 136           1HG      THR 136 -16.008  -4.848   7.659
  961   1HG2  THR 136          1HG2      THR 136 -17.868  -3.632   7.062
  962   2HG2  THR 136          2HG2      THR 136 -17.525  -2.014   6.449
  963   3HG2  THR 136          3HG2      THR 136 -16.913  -2.506   8.028
  964    HA   PRO 137           HA       PRO 137 -18.050  -1.479   1.941
  965   1HB   PRO 137          2HB       PRO 137 -20.504  -1.421   3.622
  966   2HB   PRO 137          1HB       PRO 137 -20.340  -1.630   1.874
  967   1HG   PRO 137          2HG       PRO 137 -20.931  -3.699   3.445
  968   2HG   PRO 137          1HG       PRO 137 -19.846  -3.887   2.055
  969   1HD   PRO 137          2HD       PRO 137 -19.191  -3.729   4.964
  970   2HD   PRO 137          1HD       PRO 137 -18.438  -4.705   3.685
  971    H    ALA 138           H        ALA 138 -18.595  -1.075   5.433
  972    HA   ALA 138           HA       ALA 138 -18.813   1.717   5.494
  973   1HB   ALA 138          1HB       ALA 138 -17.587  -0.094   7.574
  974   2HB   ALA 138          2HB       ALA 138 -19.300   0.305   7.430
  975   3HB   ALA 138          3HB       ALA 138 -18.132   1.565   7.835
  976    H    GLU 139           H        GLU 139 -15.939  -0.335   5.837
  977    HA   GLU 139           HA       GLU 139 -13.971   1.584   6.043
  978   1HB   GLU 139          2HB       GLU 139 -13.637  -0.843   6.328
  979   2HB   GLU 139          1HB       GLU 139 -13.850  -1.071   4.599
  980   1HG   GLU 139          2HG       GLU 139 -11.511  -1.150   5.227
  981   2HG   GLU 139          1HG       GLU 139 -11.840   0.224   4.169
  982    H    ALA 140           H        ALA 140 -15.505   0.266   3.133
  983    HA   ALA 140           HA       ALA 140 -13.868   1.497   1.223
  984   1HB   ALA 140          1HB       ALA 140 -15.439  -0.317   0.710
  985   2HB   ALA 140          2HB       ALA 140 -15.658   1.068  -0.361
  986   3HB   ALA 140          3HB       ALA 140 -16.790   0.788   0.962
  987    H    ALA 141           H        ALA 141 -16.583   2.725   3.044
  988    HA   ALA 141           HA       ALA 141 -16.773   5.135   1.453
  989   1HB   ALA 141          1HB       ALA 141 -18.518   5.789   3.046
  990   2HB   ALA 141          2HB       ALA 141 -18.153   4.363   4.019
  991   3HB   ALA 141          3HB       ALA 141 -18.796   4.178   2.387
  992    H    THR 142           H        THR 142 -15.064   4.060   4.254
  993    HA   THR 142           HA       THR 142 -14.661   6.738   5.297
  994    HB   THR 142           HB       THR 142 -13.401   4.158   6.252
  995    HG1  THR 142           1HG      THR 142 -15.687   3.980   6.287
  996   1HG2  THR 142          1HG2      THR 142 -13.957   6.785   7.644
  997   2HG2  THR 142          2HG2      THR 142 -12.374   6.214   7.113
  998   3HG2  THR 142          3HG2      THR 142 -13.237   5.355   8.389
  999    H    ALA 143           H        ALA 143 -13.021   4.398   3.324
 1000    HA   ALA 143           HA       ALA 143 -10.372   5.248   3.597
 1001   1HB   ALA 143          1HB       ALA 143 -10.998   3.142   2.527
 1002   2HB   ALA 143          2HB       ALA 143  -9.961   4.109   1.479
 1003   3HB   ALA 143          3HB       ALA 143 -11.696   4.032   1.174
 1004    H    CYS 144           H        CYS 144 -12.383   5.898   0.727
 1005    HA   CYS 144           HA       CYS 144 -11.015   8.492   0.512
 1006   1HB   CYS 144          2HB       CYS 144 -12.097   6.746  -1.712
 1007   2HB   CYS 144          1HB       CYS 144 -11.405   8.347  -1.936
 1008    H    LYS 145           H        LYS 145 -12.646   9.373   1.890
 1009    HA   LYS 145           HA       LYS 145 -15.353   9.529   0.791
 1010   1HB   LYS 145          2HB       LYS 145 -14.667   9.170   3.302
 1011   2HB   LYS 145          1HB       LYS 145 -14.440  10.911   3.297
 1012   1HG   LYS 145          2HG       LYS 145 -17.006   9.521   2.561
 1013   2HG   LYS 145          1HG       LYS 145 -16.639  10.183   4.153
 1014   1HD   LYS 145          2HD       LYS 145 -16.306  12.408   3.037
 1015   2HD   LYS 145          1HD       LYS 145 -16.944  11.680   1.558
 1016   1HE   LYS 145          2HE       LYS 145 -18.704  12.850   2.745
 1017   2HE   LYS 145          1HE       LYS 145 -19.013  11.115   2.747
 1018   1HZ   LYS 145          1HZ       LYS 145 -19.432  12.069   4.915
 1019   2HZ   LYS 145          2HZ       LYS 145 -17.850  12.674   4.992
 1020   3HZ   LYS 145          3HZ       LYS 145 -18.117  11.000   4.999
 1021    H    ASN 146           H        ASN 146 -13.641  12.088   2.510
 1022    HA   ASN 146           HA       ASN 146 -14.052  13.883   0.236
 1023   1HB   ASN 146          2HB       ASN 146 -13.159  14.393   3.085
 1024   2HB   ASN 146          1HB       ASN 146 -13.169  15.640   1.840
 1025   1HD2  ASN 146          1HD2      ASN 146 -15.602  14.583   0.590
 1026   2HD2  ASN 146          2HD2      ASN 146 -16.904  15.041   1.633
 1027    H    THR 147           H        THR 147 -12.520  13.467  -1.265
 1028    HA   THR 147           HA       THR 147  -9.731  13.420  -0.419
 1029    HB   THR 147           HB       THR 147  -9.619  11.257  -1.976
 1030    HG1  THR 147           1HG      THR 147 -12.264  11.432  -1.028
 1031   1HG2  THR 147          1HG2      THR 147 -10.411  11.224   0.940
 1032   2HG2  THR 147          2HG2      THR 147  -8.771  11.377   0.310
 1033   3HG2  THR 147          3HG2      THR 147  -9.674   9.882   0.065
 1034    H    ASP 148           H        ASP 148  -9.049  15.066  -1.665
 1035    HA   ASP 148           HA       ASP 148  -9.348  14.734  -4.580
 1036   1HB   ASP 148          2HB       ASP 148  -8.530  17.147  -4.699
 1037   2HB   ASP 148          1HB       ASP 148 -10.143  16.907  -4.045
 1038    H    SER 149           H        SER 149  -6.824  16.597  -2.956
 1039    HA   SER 149           HA       SER 149  -4.728  14.947  -4.067
 1040   1HB   SER 149          2HB       SER 149  -3.254  16.472  -2.660
 1041   2HB   SER 149          1HB       SER 149  -4.255  17.298  -3.854
 1042    HG   SER 149           HG       SER 149  -5.745  17.769  -2.170
 1043    H    THR 150           H        THR 150  -6.803  14.767  -1.520
 1044    HA   THR 150           HA       THR 150  -5.070  13.317   0.281
 1045    HB   THR 150           HB       THR 150  -7.456  12.984   1.396
 1046    HG1  THR 150           1HG      THR 150  -8.573  15.126   0.819
 1047   1HG2  THR 150          1HG2      THR 150  -7.124  15.064   2.617
 1048   2HG2  THR 150          2HG2      THR 150  -6.062  15.667   1.345
 1049   3HG2  THR 150          3HG2      THR 150  -5.568  14.287   2.325
 1050    H    ASN 151           H        ASN 151  -6.560  12.608  -2.555
 1051    HA   ASN 151           HA       ASN 151  -7.607  10.005  -1.807
 1052   1HB   ASN 151          2HB       ASN 151  -8.598  11.583  -3.602
 1053   2HB   ASN 151          1HB       ASN 151  -7.288  11.014  -4.630
 1054   1HD2  ASN 151          1HD2      ASN 151  -7.347   8.934  -5.440
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.739   7.914  -5.290
 1056    H    LYS 152           H        LYS 152  -5.209   9.826  -1.000
 1057    HA   LYS 152           HA       LYS 152  -3.890   8.100  -2.938
 1058   1HB   LYS 152          2HB       LYS 152  -1.646   9.029  -2.020
 1059   2HB   LYS 152          1HB       LYS 152  -2.489   9.914  -3.276
 1060   1HG   LYS 152          2HG       LYS 152  -1.727  11.533  -1.757
 1061   2HG   LYS 152          1HG       LYS 152  -3.451  11.358  -1.434
 1062   1HD   LYS 152          2HD       LYS 152  -3.047  10.113   0.539
 1063   2HD   LYS 152          1HD       LYS 152  -1.344   9.889   0.135
 1064   1HE   LYS 152          2HE       LYS 152  -1.686  11.579   1.893
 1065   2HE   LYS 152          1HE       LYS 152  -0.915  12.243   0.453
 1066   1HZ   LYS 152          1HZ       LYS 152  -3.089  13.103  -0.236
 1067   2HZ   LYS 152          2HZ       LYS 152  -2.594  13.734   1.258
 1068   3HZ   LYS 152          3HZ       LYS 152  -3.775  12.519   1.206
 1069    H    VAL 153           H        VAL 153  -2.985   6.289  -2.066
 1070    HA   VAL 153           HA       VAL 153  -3.021   6.041   0.839
 1071    HB   VAL 153           HB       VAL 153  -5.222   5.343   0.337
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.036   5.015  -2.059
 1073   2HG1  VAL 153          2HG1      VAL 153  -5.770   3.602  -1.303
 1074   3HG1  VAL 153          3HG1      VAL 153  -4.081   3.552  -1.807
 1075   1HG2  VAL 153          1HG2      VAL 153  -3.485   2.903   0.634
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.211   2.985   0.990
 1077   3HG2  VAL 153          3HG2      VAL 153  -4.068   3.941   1.933
 1078    H    THR 154           H        THR 154  -0.887   5.641   1.085
 1079    HA   THR 154           HA       THR 154   0.482   3.602  -0.399
 1080    HB   THR 154           HB       THR 154   2.326   4.063   1.107
 1081    HG1  THR 154           1HG      THR 154   1.327   5.972   2.677
 1082   1HG2  THR 154          1HG2      THR 154   1.879   5.730  -0.637
 1083   2HG2  THR 154          2HG2      THR 154   2.543   6.490   0.808
 1084   3HG2  THR 154          3HG2      THR 154   0.816   6.604   0.465
 1085    H    TYR 155           H        TYR 155   0.621   1.368   0.130
 1086    HA   TYR 155           HA       TYR 155   0.089   0.679   2.901
 1087   1HB   TYR 155          2HB       TYR 155  -1.646  -0.916   2.479
 1088   2HB   TYR 155          1HB       TYR 155  -2.135   0.654   1.871
 1089    HD1  TYR 155           1HD      TYR 155  -1.668  -2.809   1.111
 1090    HD2  TYR 155           2HD      TYR 155  -2.025   1.049  -0.651
 1091    HE1  TYR 155           1HE      TYR 155  -2.303  -3.857  -1.024
 1092    HE2  TYR 155           2HE      TYR 155  -2.650   0.017  -2.795
 1093    HH   TYR 155           HH       TYR 155  -2.427  -2.112  -3.966
 1094    H    PHE 156           H        PHE 156   0.100  -1.806   3.158
 1095    HA   PHE 156           HA       PHE 156   2.366  -2.877   1.617
 1096   1HB   PHE 156          2HB       PHE 156   1.832  -2.974   4.579
 1097   2HB   PHE 156          1HB       PHE 156   2.933  -4.101   3.788
 1098    HD1  PHE 156           1HD      PHE 156   5.072  -3.402   3.004
 1099    HD2  PHE 156           2HD      PHE 156   2.318  -0.608   4.654
 1100    HE1  PHE 156           1HE      PHE 156   6.878  -1.745   3.190
 1101    HE2  PHE 156           2HE      PHE 156   4.126   1.059   4.845
 1102    HZ   PHE 156           HZ       PHE 156   6.397   0.506   3.975
 1103    H    MET 157           H        MET 157   1.841  -4.655   0.549
 1104    HA   MET 157           HA       MET 157  -0.241  -6.342   1.745
 1105   1HB   MET 157          2HB       MET 157  -1.036  -5.202  -0.330
 1106   2HB   MET 157          1HB       MET 157   0.238  -6.022  -1.227
 1107   1HG   MET 157          2HG       MET 157  -0.815  -8.024  -1.171
 1108   2HG   MET 157          1HG       MET 157  -1.556  -7.717   0.395
 1109   1HE   MET 157          1HE       MET 157  -3.190  -6.022  -3.586
 1110   2HE   MET 157          2HE       MET 157  -1.796  -7.098  -3.489
 1111   3HE   MET 157          3HE       MET 157  -1.689  -5.457  -2.850
 1112    H    LYS 158           H        LYS 158   1.336  -7.398   2.850
 1113    HA   LYS 158           HA       LYS 158   3.052  -8.731   3.341
 1114   1HB   LYS 158          2HB       LYS 158   1.369 -10.256   2.645
 1115   2HB   LYS 158          1HB       LYS 158   1.849 -10.103   0.980
 1116   1HG   LYS 158          2HG       LYS 158   3.969 -11.202   1.474
 1117   2HG   LYS 158          1HG       LYS 158   3.513 -11.300   3.180
 1118   1HD   LYS 158          2HD       LYS 158   2.128 -12.624   0.848
 1119   2HD   LYS 158          1HD       LYS 158   3.063 -13.421   2.118
 1120   1HE   LYS 158          2HE       LYS 158   0.602 -11.776   2.676
 1121   2HE   LYS 158          1HE       LYS 158   0.539 -13.501   2.362
 1122   1HZ   LYS 158          1HZ       LYS 158   1.859 -12.118   4.623
 1123   2HZ   LYS 158          2HZ       LYS 158   2.144 -13.750   4.262
 1124   3HZ   LYS 158          3HZ       LYS 158   0.587 -13.235   4.689
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1 -24.834  -0.657  -3.624
    2   2H    MET   1          2HT       MET   1 -25.843  -1.933  -3.146
    3   3H    MET   1          3HT       MET   1 -24.314  -2.261  -3.800
    4    HA   MET   1           HA       MET   1 -23.246  -1.219  -1.920
    5   1HB   MET   1          2HB       MET   1 -26.108  -0.793  -1.064
    6   2HB   MET   1          1HB       MET   1 -24.783  -0.779   0.088
    7   1HG   MET   1          2HG       MET   1 -25.368   1.469  -0.527
    8   2HG   MET   1          1HG       MET   1 -23.756   1.082  -1.125
    9   1HE   MET   1          1HE       MET   1 -25.153   3.553  -3.829
   10   2HE   MET   1          2HE       MET   1 -23.826   3.213  -2.718
   11   3HE   MET   1          3HE       MET   1 -25.427   3.598  -2.088
   12    H    GLU   2           H        GLU   2 -24.105  -2.172   0.613
   13    HA   GLU   2           HA       GLU   2 -24.200  -4.003   1.907
   14   1HB   GLU   2          2HB       GLU   2 -25.530  -5.183  -0.516
   15   2HB   GLU   2          1HB       GLU   2 -25.263  -6.109   0.956
   16   1HG   GLU   2          2HG       GLU   2 -26.921  -3.622   0.629
   17   2HG   GLU   2          1HG       GLU   2 -27.479  -5.250   1.021
   18    H    GLN   3           H        GLN   3 -22.213  -4.424   2.389
   19    HA   GLN   3           HA       GLN   3 -20.210  -5.444   2.508
   20   1HB   GLN   3          2HB       GLN   3 -21.591  -7.450   0.732
   21   2HB   GLN   3          1HB       GLN   3 -19.989  -7.693   1.415
   22   1HG   GLN   3          2HG       GLN   3 -22.587  -7.418   2.898
   23   2HG   GLN   3          1HG       GLN   3 -21.548  -8.839   2.789
   24   1HE2  GLN   3          1HE2      GLN   3 -22.093  -5.796   4.332
   25   2HE2  GLN   3          2HE2      GLN   3 -20.835  -5.940   5.516
   26    H    SER   4           H        SER   4 -18.509  -6.661   0.896
   27    HA   SER   4           HA       SER   4 -17.946  -4.588  -1.078
   28   1HB   SER   4          2HB       SER   4 -16.177  -6.765   0.057
   29   2HB   SER   4          1HB       SER   4 -15.652  -5.462  -1.013
   30    HG   SER   4           HG       SER   4 -15.760  -5.402   1.594
   31    H    ALA   5           H        ALA   5 -17.854  -4.953  -3.206
   32    HA   ALA   5           HA       ALA   5 -18.746  -7.517  -4.223
   33   1HB   ALA   5          1HB       ALA   5 -18.838  -6.368  -6.390
   34   2HB   ALA   5          2HB       ALA   5 -18.111  -4.938  -5.658
   35   3HB   ALA   5          3HB       ALA   5 -19.709  -5.475  -5.144
   36    H    SER   6           H        SER   6 -17.595  -8.696  -5.833
   37    HA   SER   6           HA       SER   6 -15.803  -9.831  -6.606
   38   1HB   SER   6          2HB       SER   6 -13.949  -8.532  -7.586
   39   2HB   SER   6          1HB       SER   6 -15.520  -7.886  -8.046
   40    HG   SER   6           HG       SER   6 -14.779  -6.640  -5.830
   41    H    ASP   7           H        ASP   7 -16.029  -9.286  -3.711
   42    HA   ASP   7           HA       ASP   7 -13.440  -8.946  -2.584
   43   1HB   ASP   7          2HB       ASP   7 -14.475  -9.450  -0.493
   44   2HB   ASP   7          1HB       ASP   7 -15.666  -8.540  -1.418
   45    H    SER   8           H        SER   8 -15.097 -11.593  -3.962
   46    HA   SER   8           HA       SER   8 -13.293 -13.508  -2.683
   47   1HB   SER   8          2HB       SER   8 -15.103 -14.999  -4.116
   48   2HB   SER   8          1HB       SER   8 -15.266 -14.564  -2.413
   49    HG   SER   8           HG       SER   8 -16.524 -12.796  -3.001
   50    H    ASN   9           H        ASN   9 -14.098 -12.100  -5.771
   51    HA   ASN   9           HA       ASN   9 -12.585 -14.108  -7.219
   52   1HB   ASN   9          2HB       ASN   9 -14.310 -11.810  -8.002
   53   2HB   ASN   9          1HB       ASN   9 -13.111 -12.389  -9.156
   54   1HD2  ASN   9          1HD2      ASN   9 -16.011 -13.166  -7.402
   55   2HD2  ASN   9          2HD2      ASN   9 -16.414 -14.588  -8.310
   56    H    LYS  10           H        LYS  10 -12.349 -10.531  -6.943
   57    HA   LYS  10           HA       LYS  10  -9.839 -10.556  -8.307
   58   1HB   LYS  10          2HB       LYS  10 -11.320  -8.603  -8.465
   59   2HB   LYS  10          1HB       LYS  10 -11.128  -8.314  -6.738
   60   1HG   LYS  10          2HG       LYS  10  -8.753  -7.913  -7.045
   61   2HG   LYS  10          1HG       LYS  10  -8.902  -8.253  -8.768
   62   1HD   LYS  10          2HD       LYS  10 -10.423  -6.326  -8.990
   63   2HD   LYS  10          1HD       LYS  10 -10.209  -5.979  -7.272
   64   1HE   LYS  10          2HE       LYS  10  -7.811  -5.677  -7.628
   65   2HE   LYS  10          1HE       LYS  10  -8.016  -6.033  -9.340
   66   1HZ   LYS  10          1HZ       LYS  10  -9.287  -3.753  -7.929
   67   2HZ   LYS  10          2HZ       LYS  10  -9.348  -4.070  -9.590
   68   3HZ   LYS  10          3HZ       LYS  10  -7.876  -3.646  -8.865
   69    H    SER  11           H        SER  11 -10.817 -10.237  -4.935
   70    HA   SER  11           HA       SER  11  -8.441  -9.493  -3.782
   71   1HB   SER  11          2HB       SER  11 -10.444 -11.472  -2.674
   72   2HB   SER  11          1HB       SER  11  -9.273 -10.545  -1.734
   73    HG   SER  11           HG       SER  11 -11.661  -9.810  -2.210
   74    H    GLN  12           H        GLN  12  -9.500 -12.787  -4.600
   75    HA   GLN  12           HA       GLN  12  -7.286 -14.023  -3.340
   76   1HB   GLN  12          2HB       GLN  12  -9.233 -15.116  -5.366
   77   2HB   GLN  12          1HB       GLN  12  -8.074 -16.084  -4.467
   78   1HG   GLN  12          2HG       GLN  12 -10.432 -14.566  -3.400
   79   2HG   GLN  12          1HG       GLN  12 -10.154 -16.307  -3.371
   80   1HE2  GLN  12          1HE2      GLN  12  -8.567 -17.137  -1.950
   81   2HE2  GLN  12          2HE2      GLN  12  -8.075 -16.253  -0.542
   82    H    ASN  13           H        ASN  13  -7.821 -12.906  -6.648
   83    HA   ASN  13           HA       ASN  13  -5.473 -14.333  -7.557
   84   1HB   ASN  13          2HB       ASN  13  -5.914 -13.410  -9.767
   85   2HB   ASN  13          1HB       ASN  13  -7.364 -14.131  -9.095
   86   1HD2  ASN  13          1HD2      ASN  13  -8.857 -13.055 -10.209
   87   2HD2  ASN  13          2HD2      ASN  13  -9.099 -11.340 -10.154
   88    H    ALA  14           H        ALA  14  -6.301 -11.144  -6.473
   89    HA   ALA  14           HA       ALA  14  -3.890  -9.865  -7.264
   90   1HB   ALA  14          1HB       ALA  14  -4.498  -8.139  -5.652
   91   2HB   ALA  14          2HB       ALA  14  -5.733  -9.196  -4.969
   92   3HB   ALA  14          3HB       ALA  14  -5.893  -8.605  -6.624
   93    H    ILE  15           H        ILE  15  -4.950 -11.441  -4.272
   94    HA   ILE  15           HA       ILE  15  -2.717 -11.080  -2.677
   95    HB   ILE  15           HB       ILE  15  -4.564 -13.465  -2.859
   96   1HG1  ILE  15          2HG1      ILE  15  -4.446 -11.223  -0.831
   97   2HG1  ILE  15          1HG1      ILE  15  -5.554 -11.268  -2.198
   98   1HG2  ILE  15          1HG2      ILE  15  -2.455 -14.172  -1.861
   99   2HG2  ILE  15          2HG2      ILE  15  -3.737 -14.134  -0.652
  100   3HG2  ILE  15          3HG2      ILE  15  -2.541 -12.839  -0.710
  101   1HD1  ILE  15          1HD1      ILE  15  -6.663 -11.977  -0.171
  102   2HD1  ILE  15          2HD1      ILE  15  -5.455 -13.240   0.074
  103   3HD1  ILE  15          3HD1      ILE  15  -6.549 -13.321  -1.307
  104    H    SER  16           H        SER  16  -3.333 -13.602  -5.080
  105    HA   SER  16           HA       SER  16  -1.132 -15.212  -4.583
  106   1HB   SER  16          2HB       SER  16  -3.066 -15.771  -6.074
  107   2HB   SER  16          1HB       SER  16  -2.375 -14.704  -7.295
  108    HG   SER  16           HG       SER  16  -0.568 -16.049  -7.410
  109    H    GLU  17           H        GLU  17  -1.403 -12.492  -6.875
  110    HA   GLU  17           HA       GLU  17   1.208 -12.885  -7.913
  111   1HB   GLU  17          2HB       GLU  17  -0.620 -11.796  -9.175
  112   2HB   GLU  17          1HB       GLU  17  -0.531 -10.421  -8.081
  113   1HG   GLU  17          2HG       GLU  17   1.647  -9.859  -8.830
  114   2HG   GLU  17          1HG       GLU  17   1.795 -11.370  -9.728
  115    H    VAL  18           H        VAL  18  -0.127 -10.500  -5.612
  116    HA   VAL  18           HA       VAL  18   2.291  -9.072  -5.343
  117    HB   VAL  18           HB       VAL  18   1.325  -8.091  -3.292
  118   1HG1  VAL  18          1HG1      VAL  18   0.787  -7.121  -5.440
  119   2HG1  VAL  18          2HG1      VAL  18  -0.615  -7.034  -4.372
  120   3HG1  VAL  18          3HG1      VAL  18  -0.551  -8.254  -5.644
  121   1HG2  VAL  18          1HG2      VAL  18  -0.915 -10.049  -3.776
  122   2HG2  VAL  18          2HG2      VAL  18  -0.991  -8.686  -2.661
  123   3HG2  VAL  18          3HG2      VAL  18   0.158  -9.994  -2.379
  124    H    MET  19           H        MET  19   0.929 -11.743  -3.444
  125    HA   MET  19           HA       MET  19   2.929 -11.723  -1.447
  126   1HB   MET  19          2HB       MET  19   0.711 -12.833  -1.219
  127   2HB   MET  19          1HB       MET  19   1.240 -14.056  -2.365
  128   1HG   MET  19          2HG       MET  19   3.005 -14.744  -0.838
  129   2HG   MET  19          1HG       MET  19   2.512 -13.497   0.304
  130   1HE   MET  19          1HE       MET  19   0.145 -15.761  -1.903
  131   2HE   MET  19          2HE       MET  19  -0.103 -17.131  -0.820
  132   3HE   MET  19          3HE       MET  19   1.495 -16.821  -1.499
  133    H    SER  20           H        SER  20   2.707 -13.206  -4.609
  134    HA   SER  20           HA       SER  20   4.969 -14.902  -4.334
  135   1HB   SER  20          2HB       SER  20   3.699 -13.742  -6.828
  136   2HB   SER  20          1HB       SER  20   4.893 -15.041  -6.804
  137    HG   SER  20           HG       SER  20   2.248 -15.066  -5.773
  138    H    ALA  21           H        ALA  21   4.509 -11.543  -5.224
  139    HA   ALA  21           HA       ALA  21   7.203 -11.144  -6.126
  140   1HB   ALA  21          1HB       ALA  21   6.627  -8.763  -6.114
  141   2HB   ALA  21          2HB       ALA  21   5.111  -9.134  -5.289
  142   3HB   ALA  21          3HB       ALA  21   5.391  -9.723  -6.929
  143    H    THR  22           H        THR  22   5.425 -10.586  -3.101
  144    HA   THR  22           HA       THR  22   7.484  -9.461  -1.607
  145    HB   THR  22           HB       THR  22   5.327 -11.341  -0.620
  146    HG1  THR  22           1HG      THR  22   3.958  -9.667  -0.727
  147   1HG2  THR  22          1HG2      THR  22   5.517 -10.037   1.452
  148   2HG2  THR  22          2HG2      THR  22   6.847  -9.123   0.741
  149   3HG2  THR  22          3HG2      THR  22   7.027 -10.849   1.047
  150    H    SER  23           H        SER  23   6.690 -12.835  -2.302
  151    HA   SER  23           HA       SER  23   8.785 -13.948  -0.733
  152   1HB   SER  23          2HB       SER  23   6.826 -15.267  -1.445
  153   2HB   SER  23          1HB       SER  23   7.326 -15.106  -3.128
  154    HG   SER  23           HG       SER  23   9.076 -16.219  -1.215
  155    H    ALA  24           H        ALA  24   8.511 -12.849  -4.067
  156    HA   ALA  24           HA       ALA  24  10.918 -13.928  -5.040
  157   1HB   ALA  24          1HB       ALA  24   9.486 -11.453  -5.991
  158   2HB   ALA  24          2HB       ALA  24   9.101 -13.105  -6.479
  159   3HB   ALA  24          3HB       ALA  24  10.664 -12.403  -6.898
  160    H    ILE  25           H        ILE  25  10.190 -10.723  -3.656
  161    HA   ILE  25           HA       ILE  25  12.806  -9.715  -4.070
  162    HB   ILE  25           HB       ILE  25  10.914  -8.211  -3.728
  163   1HG1  ILE  25          2HG1      ILE  25  13.038  -7.926  -1.588
  164   2HG1  ILE  25          1HG1      ILE  25  13.212  -7.435  -3.269
  165   1HG2  ILE  25          1HG2      ILE  25   9.951  -7.851  -1.520
  166   2HG2  ILE  25          2HG2      ILE  25  10.949  -9.151  -0.865
  167   3HG2  ILE  25          3HG2      ILE  25   9.699  -9.514  -2.055
  168   1HD1  ILE  25          1HD1      ILE  25  12.754  -5.536  -1.815
  169   2HD1  ILE  25          2HD1      ILE  25  11.241  -6.286  -1.304
  170   3HD1  ILE  25          3HD1      ILE  25  11.452  -5.780  -2.980
  171    H    ASN  26           H        ASN  26  11.361 -11.589  -1.492
  172    HA   ASN  26           HA       ASN  26  13.451 -11.333   0.387
  173   1HB   ASN  26          2HB       ASN  26  11.369 -12.335   1.077
  174   2HB   ASN  26          1HB       ASN  26  11.514 -13.598  -0.141
  175   1HD2  ASN  26          1HD2      ASN  26  12.648 -12.438   2.940
  176   2HD2  ASN  26          2HD2      ASN  26  13.449 -13.901   3.416
  177    H    GLY  27           H        GLY  27  12.912 -13.499  -2.338
  178   1HA   GLY  27          2HA       GLY  27  15.282 -15.025  -2.025
  179   2HA   GLY  27          1HA       GLY  27  14.317 -14.898  -3.488
  180    H    LEU  28           H        LEU  28  14.645 -11.920  -3.437
  181    HA   LEU  28           HA       LEU  28  17.148 -11.780  -4.854
  182   1HB   LEU  28          2HB       LEU  28  15.271  -9.554  -4.051
  183   2HB   LEU  28          1HB       LEU  28  16.580  -9.427  -5.208
  184    HG   LEU  28           HG       LEU  28  14.049 -11.042  -5.531
  185   1HD1  LEU  28          1HD1      LEU  28  15.069  -8.575  -6.931
  186   2HD1  LEU  28          2HD1      LEU  28  13.707  -8.662  -5.813
  187   3HD1  LEU  28          3HD1      LEU  28  13.619  -9.478  -7.377
  188   1HD2  LEU  28          1HD2      LEU  28  15.928 -12.210  -6.547
  189   2HD2  LEU  28          2HD2      LEU  28  16.402 -10.741  -7.398
  190   3HD2  LEU  28          3HD2      LEU  28  14.874 -11.531  -7.789
  191    H    TYR  29           H        TYR  29  15.908 -10.930  -1.719
  192    HA   TYR  29           HA       TYR  29  18.435  -9.611  -1.024
  193   1HB   TYR  29          2HB       TYR  29  15.640  -9.368   0.041
  194   2HB   TYR  29          1HB       TYR  29  17.015  -8.851   1.008
  195    HD1  TYR  29           1HD      TYR  29  15.791  -8.436  -2.514
  196    HD2  TYR  29           2HD      TYR  29  17.538  -6.620   0.912
  197    HE1  TYR  29           1HE      TYR  29  15.803  -6.270  -3.676
  198    HE2  TYR  29           2HE      TYR  29  17.556  -4.451  -0.237
  199    HH   TYR  29           HH       TYR  29  15.887  -3.937  -3.225
  200    H    ILE  30           H        ILE  30  18.149 -12.470  -1.150
  201    HA   ILE  30           HA       ILE  30  17.815 -13.698   1.342
  202    HB   ILE  30           HB       ILE  30  19.479 -14.464  -1.054
  203   1HG1  ILE  30          2HG1      ILE  30  17.001 -14.484  -1.249
  204   2HG1  ILE  30          1HG1      ILE  30  17.726 -16.075  -1.465
  205   1HG2  ILE  30          1HG2      ILE  30  19.011 -16.119   1.424
  206   2HG2  ILE  30          2HG2      ILE  30  20.554 -15.452   0.890
  207   3HG2  ILE  30          3HG2      ILE  30  19.750 -16.694  -0.071
  208   1HD1  ILE  30          1HD1      ILE  30  17.119 -16.651   0.836
  209   2HD1  ILE  30          2HD1      ILE  30  15.709 -16.214  -0.132
  210   3HD1  ILE  30          3HD1      ILE  30  16.374 -15.064   1.028
  211    H    GLY  31           H        GLY  31  20.677 -12.224  -0.130
  212   1HA   GLY  31          2HA       GLY  31  22.341 -12.901   2.143
  213   2HA   GLY  31          1HA       GLY  31  22.831 -11.977   0.731
  214    H    GLN  32           H        GLN  32  19.941 -10.849   2.019
  215    HA   GLN  32           HA       GLN  32  21.333  -8.707   3.480
  216   1HB   GLN  32          2HB       GLN  32  18.952  -8.603   1.669
  217   2HB   GLN  32          1HB       GLN  32  19.198  -7.377   2.898
  218   1HG   GLN  32          2HG       GLN  32  20.079  -6.512   0.891
  219   2HG   GLN  32          1HG       GLN  32  21.449  -6.943   1.903
  220   1HE2  GLN  32          1HE2      GLN  32  19.512  -9.201   0.055
  221   2HE2  GLN  32          2HE2      GLN  32  20.750  -9.633  -1.067
  222    H    THR  33           H        THR  33  18.006  -9.863   3.202
  223    HA   THR  33           HA       THR  33  16.406 -10.369   4.740
  224    HB   THR  33           HB       THR  33  18.665 -10.685   6.727
  225    HG1  THR  33           1HG      THR  33  17.648 -12.349   4.683
  226   1HG2  THR  33          1HG2      THR  33  16.449 -10.572   7.763
  227   2HG2  THR  33          2HG2      THR  33  17.112 -12.204   7.874
  228   3HG2  THR  33          3HG2      THR  33  15.869 -11.835   6.677
  229    H    SER  34           H        SER  34  18.878  -8.157   5.852
  230    HA   SER  34           HA       SER  34  17.199  -6.715   7.644
  231   1HB   SER  34          2HB       SER  34  19.662  -6.713   7.838
  232   2HB   SER  34          1HB       SER  34  19.780  -5.899   6.280
  233    HG   SER  34           HG       SER  34  19.067  -4.905   8.772
  234    H    TYR  35           H        TYR  35  18.336  -6.242   4.327
  235    HA   TYR  35           HA       TYR  35  17.422  -5.169   2.530
  236   1HB   TYR  35          2HB       TYR  35  15.163  -4.581   4.445
  237   2HB   TYR  35          1HB       TYR  35  15.204  -3.932   2.814
  238    HD1  TYR  35           1HD      TYR  35  16.326  -7.347   3.707
  239    HD2  TYR  35           2HD      TYR  35  13.215  -4.968   2.035
  240    HE1  TYR  35           1HE      TYR  35  15.212  -9.383   2.891
  241    HE2  TYR  35           2HE      TYR  35  12.103  -6.997   1.210
  242    HH   TYR  35           HH       TYR  35  12.702  -9.320   0.628
  243    H    SER  36           H        SER  36  18.233  -3.768   5.478
  244    HA   SER  36           HA       SER  36  18.548  -1.675   6.326
  245   1HB   SER  36          2HB       SER  36  19.899  -0.161   4.963
  246   2HB   SER  36          1HB       SER  36  20.482  -1.815   4.828
  247    HG   SER  36           HG       SER  36  18.941  -1.759   2.866
  248    H    GLY  37           H        GLY  37  15.975  -2.245   4.684
  249   1HA   GLY  37          2HA       GLY  37  14.108  -1.149   3.957
  250   2HA   GLY  37          1HA       GLY  37  14.641   0.197   4.953
  251    H    LEU  38           H        LEU  38  17.098  -0.445   2.828
  252    HA   LEU  38           HA       LEU  38  18.142   1.123   1.556
  253   1HB   LEU  38          2HB       LEU  38  15.535   0.777   0.110
  254   2HB   LEU  38          1HB       LEU  38  16.916   1.615  -0.571
  255    HG   LEU  38           HG       LEU  38  16.838  -1.279   0.262
  256   1HD1  LEU  38          1HD1      LEU  38  17.016  -1.741  -2.138
  257   2HD1  LEU  38          2HD1      LEU  38  16.906  -0.015  -2.476
  258   3HD1  LEU  38          3HD1      LEU  38  15.538  -0.861  -1.752
  259   1HD2  LEU  38          1HD2      LEU  38  19.022   0.373  -0.992
  260   2HD2  LEU  38          2HD2      LEU  38  19.041  -1.387  -0.883
  261   3HD2  LEU  38          3HD2      LEU  38  19.047  -0.413   0.586
  262    H    ASP  39           H        ASP  39  16.492   2.054   3.769
  263    HA   ASP  39           HA       ASP  39  15.031   4.357   3.291
  264   1HB   ASP  39          2HB       ASP  39  15.136   3.292   5.490
  265   2HB   ASP  39          1HB       ASP  39  16.836   3.715   5.634
  266    H    SER  40           H        SER  40  18.494   3.911   3.675
  267    HA   SER  40           HA       SER  40  19.321   6.566   3.664
  268   1HB   SER  40          2HB       SER  40  21.437   5.561   2.599
  269   2HB   SER  40          1HB       SER  40  20.936   4.924   4.168
  270    HG   SER  40           HG       SER  40  21.336   3.166   2.905
  271    H    THR  41           H        THR  41  18.857   4.379   0.893
  272    HA   THR  41           HA       THR  41  19.617   6.356  -1.020
  273    HB   THR  41           HB       THR  41  18.718   4.668  -2.687
  274    HG1  THR  41           1HG      THR  41  17.562   3.679  -0.534
  275   1HG2  THR  41          1HG2      THR  41  20.557   3.093  -2.319
  276   2HG2  THR  41          2HG2      THR  41  20.758   3.706  -0.677
  277   3HG2  THR  41          3HG2      THR  41  21.083   4.757  -2.056
  278    H    ILE  42           H        ILE  42  16.583   5.459   0.440
  279    HA   ILE  42           HA       ILE  42  15.038   6.785  -1.635
  280    HB   ILE  42           HB       ILE  42  14.085   5.641   0.997
  281   1HG1  ILE  42          2HG1      ILE  42  15.004   3.842  -0.276
  282   2HG1  ILE  42          1HG1      ILE  42  13.258   3.762  -0.490
  283   1HG2  ILE  42          1HG2      ILE  42  12.543   6.437  -1.472
  284   2HG2  ILE  42          2HG2      ILE  42  12.546   7.290   0.071
  285   3HG2  ILE  42          3HG2      ILE  42  11.867   5.666  -0.038
  286   1HD1  ILE  42          1HD1      ILE  42  13.483   4.852  -2.667
  287   2HD1  ILE  42          2HD1      ILE  42  14.410   3.354  -2.578
  288   3HD1  ILE  42          3HD1      ILE  42  15.232   4.907  -2.449
  289    H    LEU  43           H        LEU  43  16.222   7.386   1.576
  290    HA   LEU  43           HA       LEU  43  14.750   9.664   2.265
  291   1HB   LEU  43          2HB       LEU  43  16.338   8.323   3.714
  292   2HB   LEU  43          1HB       LEU  43  17.656   9.141   2.892
  293    HG   LEU  43           HG       LEU  43  16.649  11.320   3.693
  294   1HD1  LEU  43          1HD1      LEU  43  15.174  11.195   5.632
  295   2HD1  LEU  43          2HD1      LEU  43  15.091   9.442   5.463
  296   3HD1  LEU  43          3HD1      LEU  43  14.421  10.480   4.206
  297   1HD2  LEU  43          1HD2      LEU  43  17.624   9.349   5.759
  298   2HD2  LEU  43          2HD2      LEU  43  17.631  11.105   5.918
  299   3HD2  LEU  43          3HD2      LEU  43  18.639  10.328   4.698
  300    H    LEU  44           H        LEU  44  17.888   9.364   0.630
  301    HA   LEU  44           HA       LEU  44  18.211  12.159   0.212
  302   1HB   LEU  44          2HB       LEU  44  20.079  11.510  -1.259
  303   2HB   LEU  44          1HB       LEU  44  20.149  10.750   0.317
  304    HG   LEU  44           HG       LEU  44  19.044   8.717  -0.886
  305   1HD1  LEU  44          1HD1      LEU  44  20.279  10.151  -3.234
  306   2HD1  LEU  44          2HD1      LEU  44  18.557   9.855  -2.992
  307   3HD1  LEU  44          3HD1      LEU  44  19.661   8.500  -3.235
  308   1HD2  LEU  44          1HD2      LEU  44  21.910   9.500  -1.389
  309   2HD2  LEU  44          2HD2      LEU  44  21.254   7.865  -1.478
  310   3HD2  LEU  44          3HD2      LEU  44  21.282   8.721   0.062
  311    H    ASN  45           H        ASN  45  16.273   9.869  -1.318
  312    HA   ASN  45           HA       ASN  45  16.360  10.868  -3.977
  313   1HB   ASN  45          2HB       ASN  45  15.568   8.630  -3.646
  314   2HB   ASN  45          1HB       ASN  45  14.342   9.178  -2.503
  315   1HD2  ASN  45          1HD2      ASN  45  15.254   8.995  -5.864
  316   2HD2  ASN  45          2HD2      ASN  45  13.685   9.331  -6.506
  317    H    THR  46           H        THR  46  13.720  11.050  -1.595
  318    HA   THR  46           HA       THR  46  13.003  13.652  -2.742
  319    HB   THR  46           HB       THR  46  11.377  12.248  -0.638
  320    HG1  THR  46           1HG      THR  46  11.882  11.300  -3.127
  321   1HG2  THR  46          1HG2      THR  46  10.718  14.132  -2.906
  322   2HG2  THR  46          2HG2      THR  46  10.773  14.533  -1.190
  323   3HG2  THR  46          3HG2      THR  46   9.536  13.434  -1.799
  324    H    SER  47           H        SER  47  14.178  15.170  -1.834
  325    HA   SER  47           HA       SER  47  16.086  15.044  -0.070
  326   1HB   SER  47          2HB       SER  47  14.209  17.397  -0.189
  327   2HB   SER  47          1HB       SER  47  15.892  17.432   0.340
  328    HG   SER  47           HG       SER  47  16.283  16.457  -1.867
  329    H    ALA  48           H        ALA  48  15.514  13.477   1.529
  330    HA   ALA  48           HA       ALA  48  15.635  13.082   3.766
  331   1HB   ALA  48          1HB       ALA  48  15.493  14.844   5.407
  332   2HB   ALA  48          2HB       ALA  48  14.840  15.953   4.200
  333   3HB   ALA  48          3HB       ALA  48  16.492  15.355   4.046
  334    H    ILE  49           H        ILE  49  12.760  14.629   2.493
  335    HA   ILE  49           HA       ILE  49  11.202  12.815   4.190
  336    HB   ILE  49           HB       ILE  49   9.407  14.756   3.463
  337   1HG1  ILE  49          2HG1      ILE  49  10.566  16.852   4.474
  338   2HG1  ILE  49          1HG1      ILE  49  12.059  16.049   3.998
  339   1HG2  ILE  49          1HG2      ILE  49   9.419  15.373   5.840
  340   2HG2  ILE  49          2HG2      ILE  49  10.937  14.498   6.039
  341   3HG2  ILE  49          3HG2      ILE  49   9.467  13.629   5.593
  342   1HD1  ILE  49          1HD1      ILE  49  11.335  17.647   2.318
  343   2HD1  ILE  49          2HD1      ILE  49   9.795  16.804   2.158
  344   3HD1  ILE  49          3HD1      ILE  49  11.292  16.004   1.681
  345    HA   PRO  50           HA       PRO  50  10.225  11.394   0.051
  346   1HB   PRO  50          2HB       PRO  50   8.743   9.242   1.332
  347   2HB   PRO  50          1HB       PRO  50  10.215   9.160   0.370
  348   1HG   PRO  50          2HG       PRO  50  10.155   8.686   3.053
  349   2HG   PRO  50          1HG       PRO  50  11.580   9.302   2.197
  350   1HD   PRO  50          2HD       PRO  50   9.580  10.781   3.860
  351   2HD   PRO  50          1HD       PRO  50  11.340  10.998   3.753
  352    H    ASP  51           H        ASP  51   8.914  13.283  -0.079
  353    HA   ASP  51           HA       ASP  51   6.245  13.482   0.809
  354   1HB   ASP  51          2HB       ASP  51   7.686  15.388   0.191
  355   2HB   ASP  51          1HB       ASP  51   7.669  14.858  -1.483
  356    H    ASN  52           H        ASN  52   7.583  11.540  -1.545
  357    HA   ASN  52           HA       ASN  52   5.737  11.820  -3.666
  358   1HB   ASN  52          2HB       ASN  52   6.767   9.770  -4.572
  359   2HB   ASN  52          1HB       ASN  52   7.965  10.960  -4.071
  360   1HD2  ASN  52          1HD2      ASN  52   9.393  10.463  -2.469
  361   2HD2  ASN  52          2HD2      ASN  52   9.472   8.908  -1.716
  362    H    TYR  53           H        TYR  53   5.412  10.159  -0.669
  363    HA   TYR  53           HA       TYR  53   3.925   7.908  -1.430
  364   1HB   TYR  53          2HB       TYR  53   3.603   9.520   1.106
  365   2HB   TYR  53          1HB       TYR  53   3.005   7.894   0.839
  366    HD1  TYR  53           1HD      TYR  53   5.189   6.469  -0.364
  367    HD2  TYR  53           2HD      TYR  53   5.296   9.441   2.678
  368    HE1  TYR  53           1HE      TYR  53   7.286   5.510   0.492
  369    HE2  TYR  53           2HE      TYR  53   7.393   8.492   3.538
  370    HH   TYR  53           HH       TYR  53   9.124   5.977   1.845
  371    H    LYS  54           H        LYS  54   2.964  11.244  -1.102
  372    HA   LYS  54           HA       LYS  54   0.197  10.476  -1.705
  373   1HB   LYS  54          2HB       LYS  54  -0.326  12.865  -1.146
  374   2HB   LYS  54          1HB       LYS  54   0.325  11.936   0.193
  375   1HG   LYS  54          2HG       LYS  54   2.535  12.941  -0.219
  376   2HG   LYS  54          1HG       LYS  54   1.824  13.916  -1.507
  377   1HD   LYS  54          2HD       LYS  54   0.292  14.929   0.129
  378   2HD   LYS  54          1HD       LYS  54   1.048  13.975   1.407
  379   1HE   LYS  54          2HE       LYS  54   1.961  16.211   1.412
  380   2HE   LYS  54          1HE       LYS  54   3.200  15.060   0.916
  381   1HZ   LYS  54          1HZ       LYS  54   1.631  16.821  -0.884
  382   2HZ   LYS  54          2HZ       LYS  54   2.763  15.676  -1.402
  383   3HZ   LYS  54          3HZ       LYS  54   3.261  17.005  -0.477
  384    H    ASP  55           H        ASP  55  -0.938  11.779  -3.357
  385    HA   ASP  55           HA       ASP  55   0.898  12.732  -5.458
  386   1HB   ASP  55          2HB       ASP  55  -0.482  10.607  -5.942
  387   2HB   ASP  55          1HB       ASP  55  -1.881  11.678  -5.970
  388    H    THR  56           H        THR  56   0.396  14.704  -6.458
  389    HA   THR  56           HA       THR  56  -1.326  16.382  -4.816
  390    HB   THR  56           HB       THR  56   1.003  17.103  -5.410
  391    HG1  THR  56           1HG      THR  56   0.249  19.046  -5.133
  392   1HG2  THR  56          1HG2      THR  56  -0.161  17.432  -8.178
  393   2HG2  THR  56          2HG2      THR  56   1.097  16.290  -7.705
  394   3HG2  THR  56          3HG2      THR  56   1.416  18.024  -7.655
  395    H    THR  57           H        THR  57  -1.295  14.900  -7.950
  396    HA   THR  57           HA       THR  57  -3.632  16.435  -8.799
  397    HB   THR  57           HB       THR  57  -2.639  13.995 -10.236
  398    HG1  THR  57           1HG      THR  57  -1.453  16.593 -10.216
  399   1HG2  THR  57          1HG2      THR  57  -3.386  15.263 -12.197
  400   2HG2  THR  57          2HG2      THR  57  -3.785  16.634 -11.164
  401   3HG2  THR  57          3HG2      THR  57  -4.681  15.124 -11.009
  402    H    ASN  58           H        ASN  58  -2.807  13.849  -6.928
  403    HA   ASN  58           HA       ASN  58  -4.079  12.745  -5.434
  404   1HB   ASN  58          2HB       ASN  58  -6.422  13.844  -6.978
  405   2HB   ASN  58          1HB       ASN  58  -6.564  12.886  -5.508
  406   1HD2  ASN  58          1HD2      ASN  58  -5.939  15.966  -6.829
  407   2HD2  ASN  58          2HD2      ASN  58  -5.661  16.802  -5.346
  408    H    LYS  59           H        LYS  59  -2.884  11.407  -7.512
  409    HA   LYS  59           HA       LYS  59  -4.522   9.045  -7.213
  410   1HB   LYS  59          2HB       LYS  59  -4.375   8.305  -9.462
  411   2HB   LYS  59          1HB       LYS  59  -4.915   9.967  -9.536
  412   1HG   LYS  59          2HG       LYS  59  -2.058   9.192  -9.948
  413   2HG   LYS  59          1HG       LYS  59  -3.241   9.240 -11.253
  414   1HD   LYS  59          2HD       LYS  59  -3.650  11.607 -10.788
  415   2HD   LYS  59          1HD       LYS  59  -2.458  11.550  -9.483
  416   1HE   LYS  59          2HE       LYS  59  -0.717  11.000 -11.029
  417   2HE   LYS  59          1HE       LYS  59  -1.877  10.863 -12.345
  418   1HZ   LYS  59          1HZ       LYS  59  -1.272  13.362 -10.865
  419   2HZ   LYS  59          2HZ       LYS  59  -2.323  13.208 -12.187
  420   3HZ   LYS  59          3HZ       LYS  59  -0.656  12.967 -12.393
  421    H    LYS  60           H        LYS  60  -3.068   8.491  -5.566
  422    HA   LYS  60           HA       LYS  60  -0.592   7.297  -6.578
  423   1HB   LYS  60          2HB       LYS  60  -0.105   9.580  -5.573
  424   2HB   LYS  60          1HB       LYS  60  -0.605   8.915  -4.027
  425   1HG   LYS  60          2HG       LYS  60   1.760   8.819  -4.097
  426   2HG   LYS  60          1HG       LYS  60   1.182   7.165  -4.307
  427   1HD   LYS  60          2HD       LYS  60   2.569   7.118  -6.057
  428   2HD   LYS  60          1HD       LYS  60   1.309   8.036  -6.879
  429   1HE   LYS  60          2HE       LYS  60   3.712   9.180  -5.453
  430   2HE   LYS  60          1HE       LYS  60   3.505   9.053  -7.196
  431   1HZ   LYS  60          1HZ       LYS  60   1.602  10.574  -7.021
  432   2HZ   LYS  60          2HZ       LYS  60   3.037  11.279  -6.454
  433   3HZ   LYS  60          3HZ       LYS  60   1.882  10.719  -5.353
  434    H    ILE  61           H        ILE  61  -0.504   5.274  -5.975
  435    HA   ILE  61           HA       ILE  61  -1.394   4.552  -3.267
  436    HB   ILE  61           HB       ILE  61  -2.100   2.320  -4.155
  437   1HG1  ILE  61          2HG1      ILE  61  -1.860   3.731  -6.821
  438   2HG1  ILE  61          1HG1      ILE  61  -0.989   2.286  -6.304
  439   1HG2  ILE  61          1HG2      ILE  61  -3.733   3.988  -3.542
  440   2HG2  ILE  61          2HG2      ILE  61  -4.285   3.089  -4.955
  441   3HG2  ILE  61          3HG2      ILE  61  -3.628   4.713  -5.146
  442   1HD1  ILE  61          1HD1      ILE  61  -2.781   1.741  -7.851
  443   2HD1  ILE  61          2HD1      ILE  61  -3.960   2.480  -6.767
  444   3HD1  ILE  61          3HD1      ILE  61  -3.080   1.036  -6.262
  445    H    THR  62           H        THR  62   0.170   3.658  -2.152
  446    HA   THR  62           HA       THR  62   2.558   2.806  -3.584
  447    HB   THR  62           HB       THR  62   2.104   3.229  -0.623
  448    HG1  THR  62           1HG      THR  62   2.310   5.221  -1.428
  449   1HG2  THR  62          1HG2      THR  62   4.506   2.966  -0.387
  450   2HG2  THR  62          2HG2      THR  62   4.665   2.652  -2.116
  451   3HG2  THR  62          3HG2      THR  62   3.806   1.507  -1.086
  452    H    ASN  63           H        ASN  63   2.597   0.833  -4.221
  453    HA   ASN  63           HA       ASN  63   2.576  -1.477  -2.778
  454   1HB   ASN  63          2HB       ASN  63   0.198  -0.888  -2.223
  455   2HB   ASN  63          1HB       ASN  63  -0.185  -1.036  -3.936
  456   1HD2  ASN  63          1HD2      ASN  63   0.673  -2.714  -1.035
  457   2HD2  ASN  63          2HD2      ASN  63   0.313  -4.305  -1.613
  458    HA   PRO  64           HA       PRO  64   1.766  -2.658  -7.284
  459   1HB   PRO  64          2HB       PRO  64   0.708  -0.720  -8.988
  460   2HB   PRO  64          1HB       PRO  64  -0.225  -1.915  -8.080
  461   1HG   PRO  64          2HG       PRO  64  -0.202   0.901  -7.723
  462   2HG   PRO  64          1HG       PRO  64  -1.031  -0.296  -6.721
  463   1HD   PRO  64          2HD       PRO  64   1.556   1.073  -6.290
  464   2HD   PRO  64          1HD       PRO  64   0.404   0.432  -5.092
  465    H    PHE  65           H        PHE  65   2.638  -2.449  -9.508
  466    HA   PHE  65           HA       PHE  65   4.701  -0.379  -9.784
  467   1HB   PHE  65          2HB       PHE  65   6.253  -2.211 -10.632
  468   2HB   PHE  65          1HB       PHE  65   5.955  -2.196  -8.897
  469    HD1  PHE  65           1HD      PHE  65   4.651  -3.959  -7.844
  470    HD2  PHE  65           2HD      PHE  65   5.417  -3.991 -12.033
  471    HE1  PHE  65           1HE      PHE  65   3.946  -6.312  -7.953
  472    HE2  PHE  65           2HE      PHE  65   4.712  -6.346 -12.145
  473    HZ   PHE  65           HZ       PHE  65   4.019  -7.524 -10.087
  474    H    GLY  66           H        GLY  66   2.191  -0.469 -11.016
  475   1HA   GLY  66          2HA       GLY  66   2.523  -1.845 -13.577
  476   2HA   GLY  66          1HA       GLY  66   1.036  -1.162 -12.940
  477    H    GLY  67           H        GLY  67   3.398   1.074 -12.471
  478   1HA   GLY  67          2HA       GLY  67   3.319   2.283 -15.097
  479   2HA   GLY  67          1HA       GLY  67   2.343   3.101 -13.881
  480    H    GLU  68           H        GLU  68   3.373   4.838 -13.150
  481    HA   GLU  68           HA       GLU  68   6.262   4.838 -12.903
  482   1HB   GLU  68          2HB       GLU  68   4.149   6.880 -12.210
  483   2HB   GLU  68          1HB       GLU  68   5.873   7.150 -11.985
  484   1HG   GLU  68          2HG       GLU  68   4.515   6.594 -14.613
  485   2HG   GLU  68          1HG       GLU  68   5.045   8.177 -14.039
  486    H    LEU  69           H        LEU  69   6.892   3.509 -11.334
  487    HA   LEU  69           HA       LEU  69   5.631   3.734  -8.691
  488   1HB   LEU  69          2HB       LEU  69   6.453   1.518  -8.215
  489   2HB   LEU  69          1HB       LEU  69   5.558   1.498  -9.722
  490    HG   LEU  69           HG       LEU  69   8.478   1.868  -9.998
  491   1HD1  LEU  69          1HD1      LEU  69   8.956  -0.505  -9.668
  492   2HD1  LEU  69          2HD1      LEU  69   7.308  -0.760  -9.093
  493   3HD1  LEU  69          3HD1      LEU  69   8.418   0.254  -8.170
  494   1HD2  LEU  69          1HD2      LEU  69   7.015   1.631 -11.938
  495   2HD2  LEU  69          2HD2      LEU  69   6.457   0.070 -11.339
  496   3HD2  LEU  69          3HD2      LEU  69   8.137   0.276 -11.831
  497    H    ASN  70           H        ASN  70   6.825   4.151  -6.894
  498    HA   ASN  70           HA       ASN  70   9.689   4.717  -7.256
  499   1HB   ASN  70          2HB       ASN  70   8.322   6.549  -6.271
  500   2HB   ASN  70          1HB       ASN  70   7.845   5.469  -4.964
  501   1HD2  ASN  70          1HD2      ASN  70   8.753   6.711  -3.333
  502   2HD2  ASN  70          2HD2      ASN  70  10.466   6.870  -3.148
  503    H    VAL  71           H        VAL  71  11.103   3.277  -6.490
  504    HA   VAL  71           HA       VAL  71  10.087   0.939  -5.119
  505    HB   VAL  71           HB       VAL  71  12.377   0.049  -5.348
  506   1HG1  VAL  71          1HG1      VAL  71  10.803  -0.319  -7.144
  507   2HG1  VAL  71          2HG1      VAL  71  12.412  -0.051  -7.816
  508   3HG1  VAL  71          3HG1      VAL  71  11.209   1.239  -7.862
  509   1HG2  VAL  71          1HG2      VAL  71  13.626   2.131  -5.123
  510   2HG2  VAL  71          2HG2      VAL  71  12.986   2.695  -6.667
  511   3HG2  VAL  71          3HG2      VAL  71  14.060   1.297  -6.614
  512    H    GLY  72           H        GLY  72  10.489   0.319  -3.038
  513   1HA   GLY  72          2HA       GLY  72  12.572   1.343  -1.437
  514   2HA   GLY  72          1HA       GLY  72  11.091   2.216  -1.084
  515    HA   PRO  73           HA       PRO  73  10.855  -2.262   0.691
  516   1HB   PRO  73          2HB       PRO  73  13.455  -2.347   2.009
  517   2HB   PRO  73          1HB       PRO  73  12.711  -3.541   0.942
  518   1HG   PRO  73          2HG       PRO  73  14.856  -2.072   0.201
  519   2HG   PRO  73          1HG       PRO  73  13.620  -2.612  -0.952
  520   1HD   PRO  73          2HD       PRO  73  13.939   0.069   0.357
  521   2HD   PRO  73          1HD       PRO  73  13.569  -0.314  -1.339
  522    H    ALA  74           H        ALA  74  10.874  -2.839   3.082
  523    HA   ALA  74           HA       ALA  74  10.562  -0.379   4.642
  524   1HB   ALA  74          1HB       ALA  74   9.280  -1.753   6.206
  525   2HB   ALA  74          2HB       ALA  74   9.613  -3.182   5.228
  526   3HB   ALA  74          3HB       ALA  74   8.633  -1.872   4.570
  527    H    ASN  75           H        ASN  75  11.075  -0.771   7.068
  528    HA   ASN  75           HA       ASN  75  13.727  -0.705   7.528
  529   1HB   ASN  75          2HB       ASN  75  12.133  -0.142   9.257
  530   2HB   ASN  75          1HB       ASN  75  11.613  -1.818   9.384
  531   1HD2  ASN  75          1HD2      ASN  75  12.109  -2.031  11.526
  532   2HD2  ASN  75          2HD2      ASN  75  13.740  -2.061  12.123
  533    H    ASN  76           H        ASN  76  11.869  -3.666   8.260
  534    HA   ASN  76           HA       ASN  76  14.146  -5.276   7.364
  535   1HB   ASN  76          2HB       ASN  76  12.845  -5.408  10.082
  536   2HB   ASN  76          1HB       ASN  76  13.666  -6.798   9.389
  537   1HD2  ASN  76          1HD2      ASN  76  15.745  -5.289   8.095
  538   2HD2  ASN  76          2HD2      ASN  76  16.782  -4.698   9.349
  539    H    ASN  77           H        ASN  77  13.578  -7.422   6.755
  540    HA   ASN  77           HA       ASN  77  10.958  -7.718   5.685
  541   1HB   ASN  77          2HB       ASN  77  13.017  -8.772   4.720
  542   2HB   ASN  77          1HB       ASN  77  13.044  -9.874   6.092
  543   1HD2  ASN  77          1HD2      ASN  77  10.102  -8.783   4.513
  544   2HD2  ASN  77          2HD2      ASN  77   9.687 -10.316   3.831
  545    H    THR  78           H        THR  78  12.414  -8.459   8.696
  546    HA   THR  78           HA       THR  78  10.704 -10.420   9.710
  547    HB   THR  78           HB       THR  78  11.832  -8.187  11.382
  548    HG1  THR  78           1HG      THR  78  13.432 -10.411  10.738
  549   1HG2  THR  78          1HG2      THR  78  10.532  -9.908  12.521
  550   2HG2  THR  78          2HG2      THR  78  12.236 -10.025  12.966
  551   3HG2  THR  78          3HG2      THR  78  11.545 -11.162  11.807
  552    H    ALA  79           H        ALA  79  10.353  -6.952   9.367
  553    HA   ALA  79           HA       ALA  79   7.855  -6.971  10.893
  554   1HB   ALA  79          1HB       ALA  79   9.416  -4.630   9.805
  555   2HB   ALA  79          2HB       ALA  79   9.516  -5.251  11.452
  556   3HB   ALA  79          3HB       ALA  79   8.009  -4.545  10.866
  557    H    PHE  80           H        PHE  80   9.103  -5.790   7.772
  558    HA   PHE  80           HA       PHE  80   6.473  -6.303   6.582
  559   1HB   PHE  80          2HB       PHE  80   8.036  -3.734   6.192
  560   2HB   PHE  80          1HB       PHE  80   6.541  -4.161   5.373
  561    HD1  PHE  80           1HD      PHE  80   8.024  -2.696   8.280
  562    HD2  PHE  80           2HD      PHE  80   4.447  -4.408   6.747
  563    HE1  PHE  80           1HE      PHE  80   6.745  -1.637  10.097
  564    HE2  PHE  80           2HE      PHE  80   3.158  -3.348   8.554
  565    HZ   PHE  80           HZ       PHE  80   4.306  -1.947  10.223
  566    H    GLY  81           H        GLY  81   7.443  -4.974   4.090
  567   1HA   GLY  81          2HA       GLY  81   9.725  -6.659   3.377
  568   2HA   GLY  81          1HA       GLY  81   8.240  -6.867   2.466
  569    H    TYR  82           H        TYR  82   7.458  -5.104   1.193
  570    HA   TYR  82           HA       TYR  82   9.385  -2.970   0.687
  571   1HB   TYR  82          2HB       TYR  82   9.389  -3.368  -1.711
  572   2HB   TYR  82          1HB       TYR  82   9.948  -4.812  -0.878
  573    HD1  TYR  82           1HD      TYR  82   8.407  -6.781  -0.665
  574    HD2  TYR  82           2HD      TYR  82   7.450  -3.413  -3.082
  575    HE1  TYR  82           1HE      TYR  82   6.715  -8.118  -1.847
  576    HE2  TYR  82           2HE      TYR  82   5.759  -4.741  -4.268
  577    HH   TYR  82           HH       TYR  82   5.256  -7.083  -4.745
  578    H    TYR  83           H        TYR  83   8.517  -1.176  -0.433
  579    HA   TYR  83           HA       TYR  83   5.648  -1.292  -0.998
  580   1HB   TYR  83          2HB       TYR  83   5.289   0.929  -0.090
  581   2HB   TYR  83          1HB       TYR  83   5.936  -0.118   1.158
  582    HD1  TYR  83           1HD      TYR  83   7.864   0.511   2.357
  583    HD2  TYR  83           2HD      TYR  83   6.880   2.567  -1.237
  584    HE1  TYR  83           1HE      TYR  83   9.642   2.142   2.812
  585    HE2  TYR  83           2HE      TYR  83   8.654   4.210  -0.788
  586    HH   TYR  83           HH       TYR  83   9.966   5.070   1.014
  587    H    LEU  84           H        LEU  84   4.996  -0.057  -2.768
  588    HA   LEU  84           HA       LEU  84   7.158   1.208  -4.304
  589   1HB   LEU  84          2HB       LEU  84   5.001  -0.598  -5.408
  590   2HB   LEU  84          1HB       LEU  84   6.193   0.265  -6.361
  591    HG   LEU  84           HG       LEU  84   6.846  -1.888  -4.347
  592   1HD1  LEU  84          1HD1      LEU  84   5.615  -2.784  -6.257
  593   2HD1  LEU  84          2HD1      LEU  84   7.303  -3.300  -6.280
  594   3HD1  LEU  84          3HD1      LEU  84   6.758  -2.014  -7.359
  595   1HD2  LEU  84          1HD2      LEU  84   8.642  -0.270  -4.655
  596   2HD2  LEU  84          2HD2      LEU  84   8.551  -0.484  -6.402
  597   3HD2  LEU  84          3HD2      LEU  84   9.064  -1.823  -5.375
  598    H    THR  85           H        THR  85   6.608   3.327  -4.328
  599    HA   THR  85           HA       THR  85   3.843   4.074  -4.056
  600    HB   THR  85           HB       THR  85   6.260   5.864  -4.415
  601    HG1  THR  85           1HG      THR  85   4.973   4.932  -2.039
  602   1HG2  THR  85          1HG2      THR  85   4.149   6.995  -4.844
  603   2HG2  THR  85          2HG2      THR  85   4.839   7.541  -3.313
  604   3HG2  THR  85          3HG2      THR  85   3.500   6.392  -3.317
  605    H    LEU  86           H        LEU  86   2.724   3.715  -5.815
  606    HA   LEU  86           HA       LEU  86   3.792   4.537  -8.422
  607   1HB   LEU  86          2HB       LEU  86   3.425   2.224  -8.423
  608   2HB   LEU  86          1HB       LEU  86   1.965   2.353  -7.482
  609    HG   LEU  86           HG       LEU  86   1.766   1.593  -9.901
  610   1HD1  LEU  86          1HD1      LEU  86  -0.340   2.773 -10.246
  611   2HD1  LEU  86          2HD1      LEU  86   0.098   3.922  -8.980
  612   3HD1  LEU  86          3HD1      LEU  86  -0.157   2.223  -8.580
  613   1HD2  LEU  86          1HD2      LEU  86   3.228   3.206 -10.942
  614   2HD2  LEU  86          2HD2      LEU  86   2.190   4.527 -10.407
  615   3HD2  LEU  86          3HD2      LEU  86   1.593   3.357 -11.585
  616    H    THR  87           H        THR  87   2.912   6.315  -9.287
  617    HA   THR  87           HA       THR  87   0.416   7.312  -8.227
  618    HB   THR  87           HB       THR  87   2.010   9.000  -8.770
  619    HG1  THR  87           1HG      THR  87   0.288  10.042  -9.392
  620   1HG2  THR  87          1HG2      THR  87   2.912   9.339 -11.033
  621   2HG2  THR  87          2HG2      THR  87   2.125   7.849 -11.552
  622   3HG2  THR  87          3HG2      THR  87   3.407   7.791 -10.343
  623    H    ARG  88           H        ARG  88  -1.459   6.771  -8.923
  624    HA   ARG  88           HA       ARG  88  -2.625   6.655 -11.293
  625   1HB   ARG  88          2HB       ARG  88  -0.767   4.885 -11.868
  626   2HB   ARG  88          1HB       ARG  88  -1.725   3.801 -10.873
  627   1HG   ARG  88          2HG       ARG  88  -3.686   4.298 -12.340
  628   2HG   ARG  88          1HG       ARG  88  -2.587   5.184 -13.401
  629   1HD   ARG  88          2HD       ARG  88  -2.923   2.911 -14.205
  630   2HD   ARG  88          1HD       ARG  88  -1.250   3.163 -13.709
  631    HE   ARG  88           HE       ARG  88  -3.268   1.706 -12.119
  632   1HH1  ARG  88          1HH1      ARG  88   0.033   2.298 -13.114
  633   2HH1  ARG  88          2HH1      ARG  88   0.690   0.986 -12.196
  634   1HH2  ARG  88          1HH2      ARG  88  -2.431  -0.022 -10.878
  635   2HH2  ARG  88          2HH2      ARG  88  -0.730  -0.368 -10.935
  636    H    LEU  89           H        LEU  89  -4.170   7.191  -9.652
  637    HA   LEU  89           HA       LEU  89  -5.485   4.778  -8.628
  638   1HB   LEU  89          2HB       LEU  89  -4.420   5.992  -6.755
  639   2HB   LEU  89          1HB       LEU  89  -5.338   7.423  -7.181
  640    HG   LEU  89           HG       LEU  89  -7.438   6.214  -6.696
  641   1HD1  LEU  89          1HD1      LEU  89  -6.581   3.939  -7.159
  642   2HD1  LEU  89          2HD1      LEU  89  -7.420   4.068  -5.613
  643   3HD1  LEU  89          3HD1      LEU  89  -5.658   4.017  -5.659
  644   1HD2  LEU  89          1HD2      LEU  89  -5.441   6.192  -4.442
  645   2HD2  LEU  89          2HD2      LEU  89  -7.196   6.161  -4.272
  646   3HD2  LEU  89          3HD2      LEU  89  -6.401   7.575  -4.967
  647    H    ASP  90           H        ASP  90  -7.732   4.885  -8.481
  648    HA   ASP  90           HA       ASP  90  -9.068   7.068  -9.894
  649   1HB   ASP  90          2HB       ASP  90  -8.772   5.486 -11.645
  650   2HB   ASP  90          1HB       ASP  90  -9.153   4.132 -10.592
  651    H    LYS  91           H        LYS  91 -11.341   7.205  -9.371
  652    HA   LYS  91           HA       LYS  91 -11.763   6.746  -6.620
  653   1HB   LYS  91          2HB       LYS  91 -12.727   8.626  -7.978
  654   2HB   LYS  91          1HB       LYS  91 -13.859   7.473  -8.666
  655   1HG   LYS  91          2HG       LYS  91 -14.759   8.859  -6.796
  656   2HG   LYS  91          1HG       LYS  91 -14.911   7.117  -6.570
  657   1HD   LYS  91          2HD       LYS  91 -14.183   8.304  -4.523
  658   2HD   LYS  91          1HD       LYS  91 -13.021   7.100  -5.075
  659   1HE   LYS  91          2HE       LYS  91 -11.913   9.156  -4.350
  660   2HE   LYS  91          1HE       LYS  91 -11.650   8.848  -6.065
  661   1HZ   LYS  91          1HZ       LYS  91 -12.188  11.196  -5.444
  662   2HZ   LYS  91          2HZ       LYS  91 -13.759  10.678  -5.072
  663   3HZ   LYS  91          3HZ       LYS  91 -13.166  10.530  -6.654
  664    H    ALA  92           H        ALA  92 -12.859   5.033  -9.505
  665    HA   ALA  92           HA       ALA  92 -14.560   3.246  -8.033
  666   1HB   ALA  92          1HB       ALA  92 -14.727   1.995 -10.132
  667   2HB   ALA  92          2HB       ALA  92 -13.455   2.995 -10.834
  668   3HB   ALA  92          3HB       ALA  92 -15.001   3.718 -10.389
  669    H    ALA  93           H        ALA  93 -11.212   3.362  -8.972
  670    HA   ALA  93           HA       ALA  93 -10.618   0.620  -8.417
  671   1HB   ALA  93          1HB       ALA  93  -9.184   1.949  -9.877
  672   2HB   ALA  93          2HB       ALA  93  -8.271   1.319  -8.506
  673   3HB   ALA  93          3HB       ALA  93  -8.775   3.009  -8.528
  674    H    CYS  94           H        CYS  94 -10.664   3.595  -6.577
  675    HA   CYS  94           HA       CYS  94  -9.459   2.801  -4.203
  676   1HB   CYS  94          2HB       CYS  94 -10.101   5.093  -4.498
  677   2HB   CYS  94          1HB       CYS  94 -11.787   4.655  -4.731
  678    H    VAL  95           H        VAL  95 -12.847   2.462  -5.213
  679    HA   VAL  95           HA       VAL  95 -13.752   1.135  -2.916
  680    HB   VAL  95           HB       VAL  95 -14.813   0.824  -5.727
  681   1HG1  VAL  95          1HG1      VAL  95 -16.936   0.279  -4.626
  682   2HG1  VAL  95          2HG1      VAL  95 -16.146   0.399  -3.054
  683   3HG1  VAL  95          3HG1      VAL  95 -15.666  -0.863  -4.186
  684   1HG2  VAL  95          1HG2      VAL  95 -15.571   2.830  -3.603
  685   2HG2  VAL  95          2HG2      VAL  95 -16.368   2.630  -5.163
  686   3HG2  VAL  95          3HG2      VAL  95 -14.693   3.179  -5.092
  687    H    SER  96           H        SER  96 -12.350  -0.028  -5.905
  688    HA   SER  96           HA       SER  96 -12.783  -2.768  -5.526
  689   1HB   SER  96          2HB       SER  96 -12.168  -1.700  -7.670
  690   2HB   SER  96          1HB       SER  96 -10.554  -1.394  -7.035
  691    HG   SER  96           HG       SER  96 -11.778  -3.918  -7.515
  692    H    LEU  97           H        LEU  97 -10.210  -0.631  -4.412
  693    HA   LEU  97           HA       LEU  97  -8.554  -2.770  -3.450
  694   1HB   LEU  97          2HB       LEU  97  -8.491   0.193  -2.899
  695   2HB   LEU  97          1HB       LEU  97  -7.271  -0.943  -2.353
  696    HG   LEU  97           HG       LEU  97  -7.936  -0.366  -5.244
  697   1HD1  LEU  97          1HD1      LEU  97  -6.858   1.529  -4.143
  698   2HD1  LEU  97          2HD1      LEU  97  -5.772   0.759  -5.300
  699   3HD1  LEU  97          3HD1      LEU  97  -5.569   0.470  -3.572
  700   1HD2  LEU  97          1HD2      LEU  97  -5.918  -1.667  -5.718
  701   2HD2  LEU  97          2HD2      LEU  97  -7.143  -2.641  -4.904
  702   3HD2  LEU  97          3HD2      LEU  97  -5.753  -2.036  -4.001
  703    H    ALA  98           H        ALA  98 -11.161  -0.895  -2.199
  704    HA   ALA  98           HA       ALA  98 -10.730  -1.660   0.547
  705   1HB   ALA  98          1HB       ALA  98 -11.832   0.450  -0.015
  706   2HB   ALA  98          2HB       ALA  98 -12.876  -0.585   0.960
  707   3HB   ALA  98          3HB       ALA  98 -13.148  -0.443  -0.777
  708    H    THR  99           H        THR  99 -12.393  -2.885  -2.223
  709    HA   THR  99           HA       THR  99 -13.899  -4.845  -0.709
  710    HB   THR  99           HB       THR  99 -14.620  -5.663  -2.945
  711    HG1  THR  99           1HG      THR  99 -12.481  -4.529  -3.821
  712   1HG2  THR  99          1HG2      THR  99 -15.907  -3.925  -1.814
  713   2HG2  THR  99          2HG2      THR  99 -15.926  -3.675  -3.560
  714   3HG2  THR  99          3HG2      THR  99 -14.887  -2.680  -2.539
  715    H    LEU 100           H        LEU 100 -10.778  -4.519  -1.739
  716    HA   LEU 100           HA       LEU 100 -10.285  -7.266  -2.500
  717   1HB   LEU 100          2HB       LEU 100  -9.079  -5.067  -3.289
  718   2HB   LEU 100          1HB       LEU 100  -8.146  -5.280  -1.822
  719    HG   LEU 100           HG       LEU 100  -8.341  -7.373  -3.987
  720   1HD1  LEU 100          1HD1      LEU 100  -6.184  -5.324  -3.510
  721   2HD1  LEU 100          2HD1      LEU 100  -7.312  -5.347  -4.865
  722   3HD1  LEU 100          3HD1      LEU 100  -6.126  -6.639  -4.686
  723   1HD2  LEU 100          1HD2      LEU 100  -6.472  -7.051  -1.642
  724   2HD2  LEU 100          2HD2      LEU 100  -6.331  -8.282  -2.897
  725   3HD2  LEU 100          3HD2      LEU 100  -7.728  -8.276  -1.820
  726    H    ASN 101           H        ASN 101 -10.119  -8.805  -1.003
  727    HA   ASN 101           HA       ASN 101  -9.815  -8.134   1.759
  728   1HB   ASN 101          2HB       ASN 101 -11.217 -10.004   1.092
  729   2HB   ASN 101          1HB       ASN 101  -9.818 -10.862   0.455
  730   1HD2  ASN 101          1HD2      ASN 101  -9.966  -8.934   3.382
  731   2HD2  ASN 101          2HD2      ASN 101  -9.726 -10.247   4.478
  732    H    LEU 102           H        LEU 102  -7.881  -7.191   2.048
  733    HA   LEU 102           HA       LEU 102  -5.604  -9.030   1.912
  734   1HB   LEU 102          2HB       LEU 102  -4.135  -7.042   1.713
  735   2HB   LEU 102          1HB       LEU 102  -5.183  -7.286   0.337
  736    HG   LEU 102           HG       LEU 102  -6.576  -5.518   2.004
  737   1HD1  LEU 102          1HD1      LEU 102  -4.576  -5.080   3.280
  738   2HD1  LEU 102          2HD1      LEU 102  -4.954  -3.682   2.274
  739   3HD1  LEU 102          3HD1      LEU 102  -3.660  -4.783   1.800
  740   1HD2  LEU 102          1HD2      LEU 102  -6.153  -3.927   0.184
  741   2HD2  LEU 102          2HD2      LEU 102  -6.606  -5.517  -0.426
  742   3HD2  LEU 102          3HD2      LEU 102  -4.918  -5.008  -0.466
  743    H    GLY 103           H        GLY 103  -6.063  -9.840   3.866
  744   1HA   GLY 103          2HA       GLY 103  -5.407  -8.057   6.128
  745   2HA   GLY 103          1HA       GLY 103  -6.554  -9.386   6.267
  746    H    THR 104           H        THR 104  -5.717 -11.570   5.844
  747    HA   THR 104           HA       THR 104  -3.312 -12.204   7.133
  748    HB   THR 104           HB       THR 104  -4.526 -13.902   4.958
  749    HG1  THR 104           1HG      THR 104  -5.541 -14.438   7.412
  750   1HG2  THR 104          1HG2      THR 104  -3.257 -14.601   7.608
  751   2HG2  THR 104          2HG2      THR 104  -2.457 -14.694   6.039
  752   3HG2  THR 104          3HG2      THR 104  -3.831 -15.742   6.395
  753    H    SER 105           H        SER 105  -4.058 -11.315   3.877
  754    HA   SER 105           HA       SER 105  -1.425 -12.001   2.850
  755   1HB   SER 105          2HB       SER 105  -2.545 -11.062   0.714
  756   2HB   SER 105          1HB       SER 105  -3.156 -12.583   1.373
  757    HG   SER 105           HG       SER 105  -4.830 -11.048   0.857
  758    H    ALA 106           H        ALA 106  -2.305  -9.622   4.726
  759    HA   ALA 106           HA       ALA 106  -0.806  -7.594   3.217
  760   1HB   ALA 106          1HB       ALA 106  -3.190  -7.029   3.202
  761   2HB   ALA 106          2HB       ALA 106  -2.233  -5.847   4.092
  762   3HB   ALA 106          3HB       ALA 106  -3.195  -7.043   4.965
  763    H    LYS 107           H        LYS 107   0.295  -6.029   4.503
  764    HA   LYS 107           HA       LYS 107   1.014  -6.985   7.157
  765   1HB   LYS 107          2HB       LYS 107   2.062  -4.515   5.771
  766   2HB   LYS 107          1HB       LYS 107   2.790  -5.378   7.111
  767   1HG   LYS 107          2HG       LYS 107   2.518  -6.432   4.306
  768   2HG   LYS 107          1HG       LYS 107   3.979  -5.743   5.012
  769   1HD   LYS 107          2HD       LYS 107   2.545  -8.214   5.985
  770   2HD   LYS 107          1HD       LYS 107   4.032  -8.192   5.036
  771   1HE   LYS 107          2HE       LYS 107   5.103  -6.896   6.867
  772   2HE   LYS 107          1HE       LYS 107   3.637  -7.111   7.821
  773   1HZ   LYS 107          1HZ       LYS 107   5.227  -8.765   8.452
  774   2HZ   LYS 107          2HZ       LYS 107   5.455  -9.248   6.846
  775   3HZ   LYS 107          3HZ       LYS 107   3.969  -9.537   7.614
  776    H    GLY 108           H        GLY 108  -0.381  -4.232   5.472
  777   1HA   GLY 108          2HA       GLY 108  -2.426  -3.743   7.264
  778   2HA   GLY 108          1HA       GLY 108  -1.097  -2.711   7.750
  779    H    TYR 109           H        TYR 109  -3.769  -2.180   6.546
  780    HA   TYR 109           HA       TYR 109  -2.935  -0.950   4.010
  781   1HB   TYR 109          2HB       TYR 109  -4.863  -2.568   4.088
  782   2HB   TYR 109          1HB       TYR 109  -5.717  -1.412   5.098
  783    HD1  TYR 109           1HD      TYR 109  -5.622  -2.637   1.948
  784    HD2  TYR 109           2HD      TYR 109  -5.531   1.084   3.964
  785    HE1  TYR 109           1HE      TYR 109  -6.457  -1.528  -0.091
  786    HE2  TYR 109           2HE      TYR 109  -6.371   2.222   1.946
  787    HH   TYR 109           HH       TYR 109  -6.372   1.791  -0.538
  788    H    GLY 110           H        GLY 110  -2.592   1.217   4.008
  789   1HA   GLY 110          2HA       GLY 110  -3.821   2.768   6.203
  790   2HA   GLY 110          1HA       GLY 110  -2.243   3.126   5.512
  791    H    VAL 111           H        VAL 111  -4.317   5.021   5.702
  792    HA   VAL 111           HA       VAL 111  -4.570   5.644   2.851
  793    HB   VAL 111           HB       VAL 111  -6.874   5.928   4.807
  794   1HG1  VAL 111          1HG1      VAL 111  -8.149   6.708   2.845
  795   2HG1  VAL 111          2HG1      VAL 111  -6.663   6.684   1.896
  796   3HG1  VAL 111          3HG1      VAL 111  -6.817   7.787   3.263
  797   1HG2  VAL 111          1HG2      VAL 111  -6.612   4.161   2.375
  798   2HG2  VAL 111          2HG2      VAL 111  -8.052   4.336   3.380
  799   3HG2  VAL 111          3HG2      VAL 111  -6.586   3.621   4.056
  800    H    ASN 112           H        ASN 112  -3.973   7.687   2.431
  801    HA   ASN 112           HA       ASN 112  -3.307   9.837   2.705
  802   1HB   ASN 112          2HB       ASN 112  -5.332   9.677   4.930
  803   2HB   ASN 112          1HB       ASN 112  -4.472  11.162   4.538
  804   1HD2  ASN 112          1HD2      ASN 112  -7.311  10.527   4.360
  805   2HD2  ASN 112          2HD2      ASN 112  -7.742  10.818   2.706
  806    H    ILE 113           H        ILE 113  -1.850   7.697   4.021
  807    HA   ILE 113           HA       ILE 113  -0.744   9.031   6.370
  808    HB   ILE 113           HB       ILE 113  -0.348   6.246   5.271
  809   1HG1  ILE 113          2HG1      ILE 113  -1.653   7.225   7.820
  810   2HG1  ILE 113          1HG1      ILE 113  -2.527   6.736   6.369
  811   1HG2  ILE 113          1HG2      ILE 113   1.721   7.077   6.308
  812   2HG2  ILE 113          2HG2      ILE 113   0.989   5.783   7.256
  813   3HG2  ILE 113          3HG2      ILE 113   0.824   7.459   7.778
  814   1HD1  ILE 113          1HD1      ILE 113  -2.526   4.974   8.034
  815   2HD1  ILE 113          2HD1      ILE 113  -0.762   4.979   8.063
  816   3HD1  ILE 113          3HD1      ILE 113  -1.618   4.478   6.604
  817    H    SER 114           H        SER 114   0.829  10.421   5.976
  818    HA   SER 114           HA       SER 114   2.609   9.998   3.706
  819   1HB   SER 114          2HB       SER 114   2.365  12.329   5.624
  820   2HB   SER 114          1HB       SER 114   3.488  12.259   4.267
  821    HG   SER 114           HG       SER 114   0.687  12.526   4.269
  822    H    GLY 115           H        GLY 115   3.695   8.188   4.479
  823   1HA   GLY 115          2HA       GLY 115   6.154   8.394   5.528
  824   2HA   GLY 115          1HA       GLY 115   5.158   8.329   6.978
  825    H    GLU 116           H        GLU 116   4.968   6.664   3.854
  826    HA   GLU 116           HA       GLU 116   3.975   4.258   4.788
  827   1HB   GLU 116          2HB       GLU 116   4.077   5.001   2.406
  828   2HB   GLU 116          1HB       GLU 116   5.795   4.640   2.409
  829   1HG   GLU 116          2HG       GLU 116   4.880   2.770   1.431
  830   2HG   GLU 116          1HG       GLU 116   5.070   2.273   3.111
  831    H    ASN 117           H        ASN 117   7.316   5.310   4.416
  832    HA   ASN 117           HA       ASN 117   8.718   2.963   4.752
  833   1HB   ASN 117          2HB       ASN 117   9.505   5.440   4.400
  834   2HB   ASN 117          1HB       ASN 117   9.640   5.437   6.154
  835   1HD2  ASN 117          1HD2      ASN 117  11.029   3.869   7.124
  836   2HD2  ASN 117          2HD2      ASN 117  12.413   3.297   6.262
  837    H    ASN 118           H        ASN 118   7.013   4.843   7.145
  838    HA   ASN 118           HA       ASN 118   7.433   2.685   9.071
  839   1HB   ASN 118          2HB       ASN 118   7.811   5.627   9.697
  840   2HB   ASN 118          1HB       ASN 118   7.676   4.366  10.916
  841   1HD2  ASN 118          1HD2      ASN 118   9.393   2.988  11.275
  842   2HD2  ASN 118          2HD2      ASN 118  10.962   3.260  10.602
  843    H    ILE 119           H        ILE 119   5.279   2.375   7.967
  844    HA   ILE 119           HA       ILE 119   3.097   4.055   8.368
  845    HB   ILE 119           HB       ILE 119   3.134   2.140   6.806
  846   1HG1  ILE 119          2HG1      ILE 119   0.838   1.946   8.768
  847   2HG1  ILE 119          1HG1      ILE 119   0.994   3.202   7.544
  848   1HG2  ILE 119          1HG2      ILE 119   2.748   0.428   9.256
  849   2HG2  ILE 119          2HG2      ILE 119   4.216   0.515   8.284
  850   3HG2  ILE 119          3HG2      ILE 119   2.730  -0.119   7.579
  851   1HD1  ILE 119          1HD1      ILE 119   0.783   0.252   6.995
  852   2HD1  ILE 119          2HD1      ILE 119   0.870   1.532   5.788
  853   3HD1  ILE 119          3HD1      ILE 119  -0.528   1.421   6.856
  854    H    THR 120           H        THR 120   1.322   3.937   9.820
  855    HA   THR 120           HA       THR 120   2.206   3.586  12.544
  856    HB   THR 120           HB       THR 120  -0.490   4.409  12.514
  857    HG1  THR 120           1HG      THR 120   1.070   5.820  10.571
  858   1HG2  THR 120          1HG2      THR 120   0.455   6.559  13.242
  859   2HG2  THR 120          2HG2      THR 120   2.055   6.026  12.726
  860   3HG2  THR 120          3HG2      THR 120   1.234   5.204  14.054
  861    H    SER 121           H        SER 121   0.376   2.836  14.114
  862    HA   SER 121           HA       SER 121   0.051   0.095  13.858
  863   1HB   SER 121          2HB       SER 121  -1.443   2.068  15.591
  864   2HB   SER 121          1HB       SER 121  -1.531   0.316  15.779
  865    HG   SER 121           HG       SER 121   0.367   0.309  16.681
  866    H    PHE 122           H        PHE 122  -2.042  -1.107  13.952
  867    HA   PHE 122           HA       PHE 122  -3.694  -0.131  11.718
  868   1HB   PHE 122          2HB       PHE 122  -3.096  -3.020  12.368
  869   2HB   PHE 122          1HB       PHE 122  -3.839  -2.380  10.905
  870    HD1  PHE 122           1HD      PHE 122  -2.413  -0.850   9.439
  871    HD2  PHE 122           2HD      PHE 122  -0.794  -3.355  12.474
  872    HE1  PHE 122           1HE      PHE 122  -0.211  -0.726   8.356
  873    HE2  PHE 122           2HE      PHE 122   1.418  -3.230  11.399
  874    HZ   PHE 122           HZ       PHE 122   1.734  -1.897   9.388
  875    H    GLY 123           H        GLY 123  -5.876  -0.407  11.769
  876   1HA   GLY 123          2HA       GLY 123  -7.080  -1.775  14.079
  877   2HA   GLY 123          1HA       GLY 123  -7.536  -0.109  13.733
  878    H    ASN 124           H        ASN 124  -9.516  -0.087  12.840
  879    HA   ASN 124           HA       ASN 124  -9.922  -1.792  10.480
  880   1HB   ASN 124          2HB       ASN 124 -11.715  -1.574  12.862
  881   2HB   ASN 124          1HB       ASN 124 -12.434  -1.781  11.269
  882   1HD2  ASN 124          1HD2      ASN 124 -12.162  -3.691  10.176
  883   2HD2  ASN 124          2HD2      ASN 124 -11.576  -5.131  10.932
  884    H    SER 125           H        SER 125  -9.491   1.194  11.374
  885    HA   SER 125           HA       SER 125 -11.611   2.300   9.653
  886   1HB   SER 125          2HB       SER 125 -11.672   3.156  11.964
  887   2HB   SER 125          1HB       SER 125  -9.992   3.669  11.828
  888    HG   SER 125           HG       SER 125 -10.616   5.403  10.828
  889    H    ALA 126           H        ALA 126 -10.885   4.283   8.441
  890    HA   ALA 126           HA       ALA 126  -8.134   3.915   7.449
  891   1HB   ALA 126          1HB       ALA 126  -8.946   4.427   5.199
  892   2HB   ALA 126          2HB       ALA 126 -10.595   4.533   5.817
  893   3HB   ALA 126          3HB       ALA 126  -9.734   2.993   5.857
  894    H    ASP 127           H        ASP 127  -7.707   5.918   5.879
  895    HA   ASP 127           HA       ASP 127  -7.294   8.117   5.625
  896   1HB   ASP 127          2HB       ASP 127  -9.644   8.434   5.308
  897   2HB   ASP 127          1HB       ASP 127  -9.947   8.360   7.041
  898    H    GLN 128           H        GLN 128  -5.529   8.648   6.628
  899    HA   GLN 128           HA       GLN 128  -4.114   9.599   8.115
  900   1HB   GLN 128          2HB       GLN 128  -6.585  10.225   9.744
  901   2HB   GLN 128          1HB       GLN 128  -4.990  10.940   9.961
  902   1HG   GLN 128          2HG       GLN 128  -5.103  12.045   7.866
  903   2HG   GLN 128          1HG       GLN 128  -6.544  11.147   7.398
  904   1HE2  GLN 128          1HE2      GLN 128  -7.825  12.855   7.044
  905   2HE2  GLN 128          2HE2      GLN 128  -8.354  13.955   8.274
  906    H    ALA 129           H        ALA 129  -5.587   6.869   8.429
  907    HA   ALA 129           HA       ALA 129  -3.879   5.961  10.571
  908   1HB   ALA 129          1HB       ALA 129  -5.920   6.570  11.782
  909   2HB   ALA 129          2HB       ALA 129  -5.676   4.823  11.784
  910   3HB   ALA 129          3HB       ALA 129  -6.869   5.546  10.704
  911    H    ALA 130           H        ALA 130  -4.013   3.516  10.703
  912    HA   ALA 130           HA       ALA 130  -4.564   2.420   8.025
  913   1HB   ALA 130          1HB       ALA 130  -2.702   0.880   8.375
  914   2HB   ALA 130          2HB       ALA 130  -2.392   1.601   9.956
  915   3HB   ALA 130          3HB       ALA 130  -2.167   2.557   8.487
  916    H    LYS 131           H        LYS 131  -5.144   0.130   7.975
  917    HA   LYS 131           HA       LYS 131  -6.215  -0.842  10.522
  918   1HB   LYS 131          2HB       LYS 131  -8.305  -1.392   9.693
  919   2HB   LYS 131          1HB       LYS 131  -7.992   0.159   8.928
  920   1HG   LYS 131          2HG       LYS 131  -7.473  -2.472   7.572
  921   2HG   LYS 131          1HG       LYS 131  -9.018  -1.626   7.481
  922   1HD   LYS 131          2HD       LYS 131  -6.336  -0.610   6.555
  923   2HD   LYS 131          1HD       LYS 131  -7.694  -1.108   5.541
  924   1HE   LYS 131          2HE       LYS 131  -9.040   0.702   6.677
  925   2HE   LYS 131          1HE       LYS 131  -7.518   1.276   7.364
  926   1HZ   LYS 131          1HZ       LYS 131  -8.118   2.435   5.321
  927   2HZ   LYS 131          2HZ       LYS 131  -8.097   0.972   4.470
  928   3HZ   LYS 131          3HZ       LYS 131  -6.665   1.591   5.142
  929    H    SER 132           H        SER 132  -6.755  -3.203  10.411
  930    HA   SER 132           HA       SER 132  -4.313  -4.459   9.554
  931   1HB   SER 132          2HB       SER 132  -5.300  -6.407  10.843
  932   2HB   SER 132          1HB       SER 132  -5.038  -4.928  11.762
  933    HG   SER 132           HG       SER 132  -7.078  -5.364  12.287
  934    H    THR 133           H        THR 133  -7.643  -4.452   8.519
  935    HA   THR 133           HA       THR 133  -6.966  -6.362   6.398
  936    HB   THR 133           HB       THR 133  -9.244  -7.407   6.693
  937    HG1  THR 133           1HG      THR 133  -9.631  -5.516   8.372
  938   1HG2  THR 133          1HG2      THR 133  -8.550  -8.919   8.487
  939   2HG2  THR 133          2HG2      THR 133  -7.298  -7.780   8.974
  940   3HG2  THR 133          3HG2      THR 133  -7.205  -8.572   7.402
  941    H    ALA 134           H        ALA 134  -7.986  -6.008   4.454
  942    HA   ALA 134           HA       ALA 134 -10.049  -3.904   4.381
  943   1HB   ALA 134          1HB       ALA 134  -9.416  -3.534   2.044
  944   2HB   ALA 134          2HB       ALA 134  -8.175  -4.780   2.178
  945   3HB   ALA 134          3HB       ALA 134  -8.035  -3.293   3.116
  946    H    ILE 135           H        ILE 135 -12.010  -4.480   3.550
  947    HA   ILE 135           HA       ILE 135 -12.758  -6.452   1.855
  948    HB   ILE 135           HB       ILE 135 -11.551  -8.057   3.358
  949   1HG1  ILE 135          2HG1      ILE 135 -13.344  -9.747   3.446
  950   2HG1  ILE 135          1HG1      ILE 135 -14.544  -8.485   3.187
  951   1HG2  ILE 135          1HG2      ILE 135 -13.719  -7.342   5.325
  952   2HG2  ILE 135          2HG2      ILE 135 -11.996  -7.001   5.489
  953   3HG2  ILE 135          3HG2      ILE 135 -12.569  -8.670   5.503
  954   1HD1  ILE 135          1HD1      ILE 135 -14.119  -9.682   1.140
  955   2HD1  ILE 135          2HD1      ILE 135 -12.396  -9.320   1.256
  956   3HD1  ILE 135          3HD1      ILE 135 -13.558  -8.017   0.998
  957    H    THR 136           H        THR 136 -13.318  -4.368   4.338
  958    HA   THR 136           HA       THR 136 -16.145  -5.061   4.598
  959    HB   THR 136           HB       THR 136 -16.069  -3.458   6.554
  960    HG1  THR 136           1HG      THR 136 -13.722  -3.340   7.317
  961   1HG2  THR 136          1HG2      THR 136 -14.236  -5.852   6.682
  962   2HG2  THR 136          2HG2      THR 136 -15.991  -5.897   6.843
  963   3HG2  THR 136          3HG2      THR 136 -15.015  -5.065   8.055
  964    HA   PRO 137           HA       PRO 137 -17.550  -1.472   2.281
  965   1HB   PRO 137          2HB       PRO 137 -19.716  -1.137   4.094
  966   2HB   PRO 137          1HB       PRO 137 -19.753  -1.902   2.510
  967   1HG   PRO 137          2HG       PRO 137 -19.595  -3.131   5.190
  968   2HG   PRO 137          1HG       PRO 137 -20.257  -3.790   3.685
  969   1HD   PRO 137          2HD       PRO 137 -17.918  -4.636   4.728
  970   2HD   PRO 137          1HD       PRO 137 -18.199  -4.564   2.972
  971    H    ALA 138           H        ALA 138 -17.319  -1.622   5.803
  972    HA   ALA 138           HA       ALA 138 -17.357   1.089   6.430
  973   1HB   ALA 138          1HB       ALA 138 -15.700  -1.070   7.732
  974   2HB   ALA 138          2HB       ALA 138 -17.371  -0.667   8.123
  975   3HB   ALA 138          3HB       ALA 138 -16.086   0.501   8.433
  976    H    GLU 139           H        GLU 139 -14.584  -0.932   5.502
  977    HA   GLU 139           HA       GLU 139 -12.580   0.994   5.531
  978   1HB   GLU 139          2HB       GLU 139 -11.888  -1.229   5.222
  979   2HB   GLU 139          1HB       GLU 139 -13.038  -1.508   3.926
  980   1HG   GLU 139          2HG       GLU 139 -10.879  -1.465   2.951
  981   2HG   GLU 139          1HG       GLU 139 -11.689   0.033   2.499
  982    H    ALA 140           H        ALA 140 -14.718   0.036   2.853
  983    HA   ALA 140           HA       ALA 140 -13.735   1.812   0.932
  984   1HB   ALA 140          1HB       ALA 140 -15.176  -0.093   0.401
  985   2HB   ALA 140          2HB       ALA 140 -15.814   1.409  -0.271
  986   3HB   ALA 140          3HB       ALA 140 -16.535   0.717   1.183
  987    H    ALA 141           H        ALA 141 -16.229   2.231   3.380
  988    HA   ALA 141           HA       ALA 141 -17.136   4.745   2.378
  989   1HB   ALA 141          1HB       ALA 141 -18.446   4.869   4.421
  990   2HB   ALA 141          2HB       ALA 141 -17.552   3.504   5.093
  991   3HB   ALA 141          3HB       ALA 141 -18.586   3.276   3.681
  992    H    THR 142           H        THR 142 -14.653   3.775   4.650
  993    HA   THR 142           HA       THR 142 -14.434   6.457   5.729
  994    HB   THR 142           HB       THR 142 -12.619   4.103   6.275
  995    HG1  THR 142           1HG      THR 142 -14.668   3.463   6.886
  996   1HG2  THR 142          1HG2      THR 142 -12.154   5.295   8.363
  997   2HG2  THR 142          2HG2      THR 142 -13.238   6.597   7.869
  998   3HG2  THR 142          3HG2      THR 142 -11.752   6.295   6.968
  999    H    ALA 143           H        ALA 143 -12.715   4.368   3.475
 1000    HA   ALA 143           HA       ALA 143 -10.355   5.894   3.266
 1001   1HB   ALA 143          1HB       ALA 143 -10.551   3.581   2.462
 1002   2HB   ALA 143          2HB       ALA 143  -9.934   4.666   1.216
 1003   3HB   ALA 143          3HB       ALA 143 -11.614   4.133   1.167
 1004    H    CYS 144           H        CYS 144 -12.877   5.668   0.741
 1005    HA   CYS 144           HA       CYS 144 -12.125   8.378  -0.074
 1006   1HB   CYS 144          2HB       CYS 144 -13.483   6.133  -1.563
 1007   2HB   CYS 144          1HB       CYS 144 -13.415   7.779  -2.188
 1008    H    LYS 145           H        LYS 145 -13.385   9.009   1.906
 1009    HA   LYS 145           HA       LYS 145 -16.266   9.097   1.424
 1010   1HB   LYS 145          2HB       LYS 145 -16.304  10.129   3.759
 1011   2HB   LYS 145          1HB       LYS 145 -15.826   8.442   3.646
 1012   1HG   LYS 145          2HG       LYS 145 -13.484   9.079   3.850
 1013   2HG   LYS 145          1HG       LYS 145 -13.951  10.780   3.929
 1014   1HD   LYS 145          2HD       LYS 145 -15.109  10.428   6.003
 1015   2HD   LYS 145          1HD       LYS 145 -14.885   8.680   5.886
 1016   1HE   LYS 145          2HE       LYS 145 -13.305   9.576   7.462
 1017   2HE   LYS 145          1HE       LYS 145 -12.441   9.024   6.031
 1018   1HZ   LYS 145          1HZ       LYS 145 -12.525  11.423   5.281
 1019   2HZ   LYS 145          2HZ       LYS 145 -11.512  11.086   6.596
 1020   3HZ   LYS 145          3HZ       LYS 145 -13.022  11.808   6.856
 1021    H    ASN 146           H        ASN 146 -13.666  11.365   2.323
 1022    HA   ASN 146           HA       ASN 146 -15.088  13.480   0.870
 1023   1HB   ASN 146          2HB       ASN 146 -14.720  15.047   2.716
 1024   2HB   ASN 146          1HB       ASN 146 -15.683  13.677   3.254
 1025   1HD2  ASN 146          1HD2      ASN 146 -14.129  15.499   4.844
 1026   2HD2  ASN 146          2HD2      ASN 146 -12.961  14.542   5.693
 1027    H    THR 147           H        THR 147 -12.632  11.809   0.453
 1028    HA   THR 147           HA       THR 147 -10.514  13.779   0.720
 1029    HB   THR 147           HB       THR 147  -9.959  11.515   1.400
 1030    HG1  THR 147           1HG      THR 147  -8.276  12.742   0.503
 1031   1HG2  THR 147          1HG2      THR 147 -10.533  10.722  -1.457
 1032   2HG2  THR 147          2HG2      THR 147 -11.445  10.228  -0.029
 1033   3HG2  THR 147          3HG2      THR 147  -9.779   9.689  -0.243
 1034    H    ASP 148           H        ASP 148 -10.456  15.272  -0.780
 1035    HA   ASP 148           HA       ASP 148 -10.807  14.470  -3.597
 1036   1HB   ASP 148          2HB       ASP 148 -12.474  16.121  -2.986
 1037   2HB   ASP 148          1HB       ASP 148 -11.241  17.169  -2.288
 1038    H    SER 149           H        SER 149  -9.248  17.124  -1.839
 1039    HA   SER 149           HA       SER 149  -7.065  17.140  -3.739
 1040   1HB   SER 149          2HB       SER 149  -7.377  18.879  -1.288
 1041   2HB   SER 149          1HB       SER 149  -6.486  19.236  -2.772
 1042    HG   SER 149           HG       SER 149  -8.980  18.728  -3.488
 1043    H    THR 150           H        THR 150  -7.631  15.115  -1.438
 1044    HA   THR 150           HA       THR 150  -4.842  14.985  -0.513
 1045    HB   THR 150           HB       THR 150  -5.752  13.929   1.593
 1046    HG1  THR 150           1HG      THR 150  -8.198  15.184   1.307
 1047   1HG2  THR 150          1HG2      THR 150  -6.377  16.063   2.652
 1048   2HG2  THR 150          2HG2      THR 150  -6.537  16.795   1.055
 1049   3HG2  THR 150          3HG2      THR 150  -4.961  16.231   1.612
 1050    H    ASN 151           H        ASN 151  -6.430  13.665  -2.760
 1051    HA   ASN 151           HA       ASN 151  -7.236  11.088  -1.752
 1052   1HB   ASN 151          2HB       ASN 151  -8.447  12.257  -3.565
 1053   2HB   ASN 151          1HB       ASN 151  -7.050  12.047  -4.611
 1054   1HD2  ASN 151          1HD2      ASN 151  -6.694  10.087  -5.582
 1055   2HD2  ASN 151          2HD2      ASN 151  -7.814   8.773  -5.485
 1056    H    LYS 152           H        LYS 152  -5.516   9.944  -0.999
 1057    HA   LYS 152           HA       LYS 152  -3.981   8.526  -2.950
 1058   1HB   LYS 152          2HB       LYS 152  -1.743   9.175  -1.861
 1059   2HB   LYS 152          1HB       LYS 152  -2.457  10.297  -3.005
 1060   1HG   LYS 152          2HG       LYS 152  -1.714  11.660  -1.283
 1061   2HG   LYS 152          1HG       LYS 152  -3.434  11.475  -0.950
 1062   1HD   LYS 152          2HD       LYS 152  -2.936   9.762   0.717
 1063   2HD   LYS 152          1HD       LYS 152  -1.212   9.914   0.371
 1064   1HE   LYS 152          2HE       LYS 152  -1.842  11.151   2.387
 1065   2HE   LYS 152          1HE       LYS 152  -1.251  12.229   1.124
 1066   1HZ   LYS 152          1HZ       LYS 152  -3.572  12.717   0.554
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.198  13.160   2.146
 1068   3HZ   LYS 152          3HZ       LYS 152  -4.095  11.751   1.840
 1069    H    VAL 153           H        VAL 153  -3.160   6.612  -2.161
 1070    HA   VAL 153           HA       VAL 153  -3.429   6.117   0.701
 1071    HB   VAL 153           HB       VAL 153  -5.567   5.432   0.119
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.385   5.663  -2.286
 1073   2HG1  VAL 153          2HG1      VAL 153  -6.137   4.121  -1.873
 1074   3HG1  VAL 153          3HG1      VAL 153  -4.446   4.172  -2.375
 1075   1HG2  VAL 153          1HG2      VAL 153  -3.877   2.959  -0.185
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.602   2.984   0.189
 1077   3HG2  VAL 153          3HG2      VAL 153  -4.439   3.663   1.331
 1078    H    THR 154           H        THR 154  -1.245   5.781   0.949
 1079    HA   THR 154           HA       THR 154   0.099   3.643  -0.409
 1080    HB   THR 154           HB       THR 154   1.870   4.020   1.213
 1081    HG1  THR 154           1HG      THR 154   1.043   4.373   3.166
 1082   1HG2  THR 154          1HG2      THR 154   1.650   5.682  -0.583
 1083   2HG2  THR 154          2HG2      THR 154   2.262   6.423   0.896
 1084   3HG2  THR 154          3HG2      THR 154   0.574   6.639   0.436
 1085    H    TYR 155           H        TYR 155   0.100   1.447   0.122
 1086    HA   TYR 155           HA       TYR 155  -0.631   0.722   2.851
 1087   1HB   TYR 155          2HB       TYR 155  -2.372  -0.870   2.196
 1088   2HB   TYR 155          1HB       TYR 155  -2.801   0.781   1.773
 1089    HD1  TYR 155           1HD      TYR 155  -2.312  -2.572   0.564
 1090    HD2  TYR 155           2HD      TYR 155  -2.573   1.502  -0.631
 1091    HE1  TYR 155           1HE      TYR 155  -2.720  -3.284  -1.751
 1092    HE2  TYR 155           2HE      TYR 155  -2.995   0.804  -2.947
 1093    HH   TYR 155           HH       TYR 155  -2.631  -1.113  -4.382
 1094    H    PHE 156           H        PHE 156   0.333  -1.016   3.634
 1095    HA   PHE 156           HA       PHE 156   2.178  -2.496   1.920
 1096   1HB   PHE 156          2HB       PHE 156   1.858  -2.103   4.859
 1097   2HB   PHE 156          1HB       PHE 156   2.634  -3.575   4.301
 1098    HD1  PHE 156           1HD      PHE 156   4.733  -3.465   3.040
 1099    HD2  PHE 156           2HD      PHE 156   2.977  -0.017   4.805
 1100    HE1  PHE 156           1HE      PHE 156   6.894  -2.297   2.896
 1101    HE2  PHE 156           2HE      PHE 156   5.129   1.159   4.653
 1102    HZ   PHE 156           HZ       PHE 156   7.090   0.020   3.702
 1103    H    MET 157           H        MET 157   2.039  -4.658   1.474
 1104    HA   MET 157           HA       MET 157   0.249  -6.308   3.038
 1105   1HB   MET 157          2HB       MET 157  -0.988  -7.209   1.179
 1106   2HB   MET 157          1HB       MET 157  -1.182  -5.466   1.206
 1107   1HG   MET 157          2HG       MET 157   0.545  -5.307  -0.569
 1108   2HG   MET 157          1HG       MET 157   0.543  -7.070  -0.657
 1109   1HE   MET 157          1HE       MET 157  -2.621  -7.488   0.026
 1110   2HE   MET 157          2HE       MET 157  -1.783  -8.465  -1.179
 1111   3HE   MET 157          3HE       MET 157  -3.292  -7.653  -1.596
 1112    H    LYS 158           H        LYS 158   0.665  -8.557   2.830
 1113    HA   LYS 158           HA       LYS 158   3.432  -9.062   2.031
 1114   1HB   LYS 158          2HB       LYS 158   2.855  -9.559   4.352
 1115   2HB   LYS 158          1HB       LYS 158   1.554 -10.617   3.819
 1116   1HG   LYS 158          2HG       LYS 158   3.435 -11.904   2.596
 1117   2HG   LYS 158          1HG       LYS 158   4.506 -11.044   3.704
 1118   1HD   LYS 158          2HD       LYS 158   3.861 -13.248   4.575
 1119   2HD   LYS 158          1HD       LYS 158   3.289 -11.936   5.609
 1120   1HE   LYS 158          2HE       LYS 158   1.593 -13.702   5.260
 1121   2HE   LYS 158          1HE       LYS 158   1.067 -12.117   4.700
 1122   1HZ   LYS 158          1HZ       LYS 158   1.550 -12.759   2.439
 1123   2HZ   LYS 158          2HZ       LYS 158   0.522 -13.910   3.143
 1124   3HZ   LYS 158          3HZ       LYS 158   2.164 -14.261   2.953
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1 -18.232   4.045  -1.018
    2   2H    MET   1          2HT       MET   1 -18.366   3.572   0.608
    3   3H    MET   1          3HT       MET   1 -18.366   5.210   0.209
    4    HA   MET   1           HA       MET   1 -20.589   4.280   0.764
    5   1HB   MET   1          2HB       MET   1 -20.155   5.422  -2.007
    6   2HB   MET   1          1HB       MET   1 -21.712   5.347  -1.192
    7   1HG   MET   1          2HG       MET   1 -20.899   6.823   0.548
    8   2HG   MET   1          1HG       MET   1 -19.304   6.855  -0.200
    9   1HE   MET   1          1HE       MET   1 -20.925   9.477   0.578
   10   2HE   MET   1          2HE       MET   1 -20.672  10.477  -0.853
   11   3HE   MET   1          3HE       MET   1 -19.339   9.524  -0.195
   12    H    GLU   2           H        GLU   2 -18.886   2.055  -0.362
   13    HA   GLU   2           HA       GLU   2 -20.844   0.786  -2.148
   14   1HB   GLU   2          2HB       GLU   2 -17.829   0.553  -2.098
   15   2HB   GLU   2          1HB       GLU   2 -18.874  -0.460  -3.078
   16   1HG   GLU   2          2HG       GLU   2 -18.003   1.229  -4.482
   17   2HG   GLU   2          1HG       GLU   2 -19.699   1.608  -4.204
   18    H    GLN   3           H        GLN   3 -19.573  -1.720  -2.169
   19    HA   GLN   3           HA       GLN   3 -19.552  -2.629   0.606
   20   1HB   GLN   3          2HB       GLN   3 -21.111  -4.448   0.117
   21   2HB   GLN   3          1HB       GLN   3 -21.879  -2.891  -0.163
   22   1HG   GLN   3          2HG       GLN   3 -21.547  -3.132  -2.553
   23   2HG   GLN   3          1HG       GLN   3 -20.713  -4.664  -2.299
   24   1HE2  GLN   3          1HE2      GLN   3 -22.166  -5.828  -3.508
   25   2HE2  GLN   3          2HE2      GLN   3 -23.772  -6.166  -2.969
   26    H    SER   4           H        SER   4 -18.936  -5.078   0.589
   27    HA   SER   4           HA       SER   4 -16.601  -5.326  -1.076
   28   1HB   SER   4          2HB       SER   4 -16.675  -7.676   0.220
   29   2HB   SER   4          1HB       SER   4 -16.064  -6.196   0.960
   30    HG   SER   4           HG       SER   4 -17.547  -6.559   2.400
   31    H    ALA   5           H        ALA   5 -17.504  -5.453  -3.133
   32    HA   ALA   5           HA       ALA   5 -19.288  -7.655  -3.764
   33   1HB   ALA   5          1HB       ALA   5 -19.351  -6.670  -6.003
   34   2HB   ALA   5          2HB       ALA   5 -18.114  -5.509  -5.526
   35   3HB   ALA   5          3HB       ALA   5 -19.701  -5.469  -4.758
   36    H    SER   6           H        SER   6 -15.997  -6.604  -4.524
   37    HA   SER   6           HA       SER   6 -15.522  -9.114  -5.957
   38   1HB   SER   6          2HB       SER   6 -13.628  -6.770  -5.720
   39   2HB   SER   6          1HB       SER   6 -13.632  -8.045  -6.939
   40    HG   SER   6           HG       SER   6 -14.652  -5.766  -7.290
   41    H    ASP   7           H        ASP   7 -15.741  -8.825  -3.006
   42    HA   ASP   7           HA       ASP   7 -13.296  -8.676  -1.685
   43   1HB   ASP   7          2HB       ASP   7 -14.412  -9.653   0.211
   44   2HB   ASP   7          1HB       ASP   7 -15.564  -8.606  -0.614
   45    H    SER   8           H        SER   8 -14.854 -11.430  -3.231
   46    HA   SER   8           HA       SER   8 -12.779 -13.207  -2.211
   47   1HB   SER   8          2HB       SER   8 -15.115 -13.893  -4.007
   48   2HB   SER   8          1HB       SER   8 -14.120 -15.011  -3.072
   49    HG   SER   8           HG       SER   8 -15.208 -13.066  -1.501
   50    H    ASN   9           H        ASN   9 -13.955 -11.857  -5.248
   51    HA   ASN   9           HA       ASN   9 -12.388 -13.526  -6.921
   52   1HB   ASN   9          2HB       ASN   9 -13.737 -10.888  -7.528
   53   2HB   ASN   9          1HB       ASN   9 -13.052 -11.970  -8.735
   54   1HD2  ASN   9          1HD2      ASN   9 -15.763 -11.055  -8.507
   55   2HD2  ASN   9          2HD2      ASN   9 -16.750 -12.469  -8.309
   56    H    LYS  10           H        LYS  10 -12.034 -10.047  -6.118
   57    HA   LYS  10           HA       LYS  10  -9.665  -9.893  -7.732
   58   1HB   LYS  10          2HB       LYS  10 -11.472  -8.067  -7.212
   59   2HB   LYS  10          1HB       LYS  10 -10.481  -7.755  -5.795
   60   1HG   LYS  10          2HG       LYS  10  -9.220  -7.823  -8.500
   61   2HG   LYS  10          1HG       LYS  10 -10.112  -6.395  -7.982
   62   1HD   LYS  10          2HD       LYS  10  -8.666  -6.152  -6.055
   63   2HD   LYS  10          1HD       LYS  10  -7.820  -7.645  -6.468
   64   1HE   LYS  10          2HE       LYS  10  -6.613  -5.558  -7.126
   65   2HE   LYS  10          1HE       LYS  10  -6.922  -6.674  -8.454
   66   1HZ   LYS  10          1HZ       LYS  10  -8.617  -5.313  -9.291
   67   2HZ   LYS  10          2HZ       LYS  10  -7.375  -4.234  -8.883
   68   3HZ   LYS  10          3HZ       LYS  10  -8.725  -4.397  -7.870
   69    H    SER  11           H        SER  11 -10.388 -10.348  -4.364
   70    HA   SER  11           HA       SER  11  -7.929  -9.622  -3.242
   71   1HB   SER  11          2HB       SER  11  -9.953 -10.055  -1.908
   72   2HB   SER  11          1HB       SER  11  -9.859 -11.768  -2.321
   73    HG   SER  11           HG       SER  11  -7.611 -10.572  -1.164
   74    H    GLN  12           H        GLN  12  -9.063 -12.809  -4.386
   75    HA   GLN  12           HA       GLN  12  -6.786 -14.269  -3.678
   76   1HB   GLN  12          2HB       GLN  12  -8.702 -14.750  -5.962
   77   2HB   GLN  12          1HB       GLN  12  -7.551 -15.926  -5.343
   78   1HG   GLN  12          2HG       GLN  12  -8.686 -15.962  -3.213
   79   2HG   GLN  12          1HG       GLN  12  -9.800 -14.709  -3.758
   80   1HE2  GLN  12          1HE2      GLN  12 -11.610 -15.946  -3.508
   81   2HE2  GLN  12          2HE2      GLN  12 -11.992 -17.292  -4.530
   82    H    ASN  13           H        ASN  13  -7.604 -12.614  -6.693
   83    HA   ASN  13           HA       ASN  13  -5.432 -13.505  -8.214
   84   1HB   ASN  13          2HB       ASN  13  -6.898 -10.869  -8.443
   85   2HB   ASN  13          1HB       ASN  13  -5.868 -11.582  -9.682
   86   1HD2  ASN  13          1HD2      ASN  13  -8.609 -10.839  -9.917
   87   2HD2  ASN  13          2HD2      ASN  13  -9.498 -12.276 -10.291
   88    H    ALA  14           H        ALA  14  -5.809 -10.474  -6.392
   89    HA   ALA  14           HA       ALA  14  -3.267  -9.449  -7.023
   90   1HB   ALA  14          1HB       ALA  14  -4.964  -8.834  -4.612
   91   2HB   ALA  14          2HB       ALA  14  -5.124  -8.074  -6.196
   92   3HB   ALA  14          3HB       ALA  14  -3.652  -7.844  -5.250
   93    H    ILE  15           H        ILE  15  -4.404 -11.331  -4.239
   94    HA   ILE  15           HA       ILE  15  -1.960 -11.211  -2.807
   95    HB   ILE  15           HB       ILE  15  -4.222 -13.206  -2.632
   96   1HG1  ILE  15          2HG1      ILE  15  -4.888 -10.933  -2.079
   97   2HG1  ILE  15          1HG1      ILE  15  -4.828 -11.910  -0.614
   98   1HG2  ILE  15          1HG2      ILE  15  -3.306 -13.834  -0.450
   99   2HG2  ILE  15          2HG2      ILE  15  -1.916 -12.785  -0.733
  100   3HG2  ILE  15          3HG2      ILE  15  -2.178 -14.199  -1.755
  101   1HD1  ILE  15          1HD1      ILE  15  -3.910  -9.705  -0.222
  102   2HD1  ILE  15          2HD1      ILE  15  -2.744  -9.935  -1.523
  103   3HD1  ILE  15          3HD1      ILE  15  -2.648 -10.929  -0.070
  104    H    SER  16           H        SER  16  -3.266 -13.485  -5.167
  105    HA   SER  16           HA       SER  16  -1.289 -15.449  -5.035
  106   1HB   SER  16          2HB       SER  16  -3.403 -15.662  -6.317
  107   2HB   SER  16          1HB       SER  16  -2.799 -14.486  -7.483
  108    HG   SER  16           HG       SER  16  -2.467 -17.070  -7.540
  109    H    GLU  17           H        GLU  17  -1.417 -12.408  -6.831
  110    HA   GLU  17           HA       GLU  17   1.031 -12.797  -8.225
  111   1HB   GLU  17          2HB       GLU  17  -0.434 -10.226  -7.599
  112   2HB   GLU  17          1HB       GLU  17   0.844 -10.416  -8.791
  113   1HG   GLU  17          2HG       GLU  17  -0.583 -11.987 -10.032
  114   2HG   GLU  17          1HG       GLU  17  -1.869 -11.710  -8.859
  115    H    VAL  18           H        VAL  18   0.158 -10.953  -5.311
  116    HA   VAL  18           HA       VAL  18   2.726  -9.822  -4.972
  117    HB   VAL  18           HB       VAL  18   0.564  -8.960  -3.986
  118   1HG1  VAL  18          1HG1      VAL  18  -0.066  -9.734  -1.762
  119   2HG1  VAL  18          2HG1      VAL  18   1.140 -11.019  -1.865
  120   3HG1  VAL  18          3HG1      VAL  18  -0.241 -11.014  -2.963
  121   1HG2  VAL  18          1HG2      VAL  18   2.967  -9.203  -2.191
  122   2HG2  VAL  18          2HG2      VAL  18   1.673  -8.019  -2.009
  123   3HG2  VAL  18          3HG2      VAL  18   2.706  -7.985  -3.439
  124    H    MET  19           H        MET  19   1.307 -12.838  -3.863
  125    HA   MET  19           HA       MET  19   3.198 -13.546  -1.927
  126   1HB   MET  19          2HB       MET  19   1.046 -14.751  -2.421
  127   2HB   MET  19          1HB       MET  19   1.814 -15.434  -3.845
  128   1HG   MET  19          2HG       MET  19   2.941 -15.817  -1.091
  129   2HG   MET  19          1HG       MET  19   1.696 -16.875  -1.752
  130   1HE   MET  19          1HE       MET  19   2.073 -18.495  -3.835
  131   2HE   MET  19          2HE       MET  19   3.534 -18.471  -4.824
  132   3HE   MET  19          3HE       MET  19   2.464 -17.071  -4.798
  133    H    SER  20           H        SER  20   3.204 -13.934  -5.429
  134    HA   SER  20           HA       SER  20   5.734 -15.250  -5.531
  135   1HB   SER  20          2HB       SER  20   4.082 -15.507  -7.337
  136   2HB   SER  20          1HB       SER  20   4.196 -13.785  -7.692
  137    HG   SER  20           HG       SER  20   6.200 -14.054  -8.505
  138    H    ALA  21           H        ALA  21   4.626 -11.948  -5.496
  139    HA   ALA  21           HA       ALA  21   6.952 -10.734  -6.548
  140   1HB   ALA  21          1HB       ALA  21   4.798  -9.593  -6.479
  141   2HB   ALA  21          2HB       ALA  21   6.048  -8.654  -5.661
  142   3HB   ALA  21          3HB       ALA  21   4.867  -9.562  -4.716
  143    H    THR  22           H        THR  22   5.836 -11.083  -3.160
  144    HA   THR  22           HA       THR  22   8.076  -9.856  -2.016
  145    HB   THR  22           HB       THR  22   6.036 -10.184  -0.726
  146    HG1  THR  22           1HG      THR  22   8.386 -10.338   0.190
  147   1HG2  THR  22          1HG2      THR  22   5.489 -12.398   0.228
  148   2HG2  THR  22          2HG2      THR  22   6.744 -13.121  -0.779
  149   3HG2  THR  22          3HG2      THR  22   5.338 -12.367  -1.529
  150    H    SER  23           H        SER  23   7.531 -13.229  -2.906
  151    HA   SER  23           HA       SER  23   9.922 -14.163  -1.665
  152   1HB   SER  23          2HB       SER  23   9.451 -16.199  -3.184
  153   2HB   SER  23          1HB       SER  23   8.266 -15.803  -1.938
  154    HG   SER  23           HG       SER  23   6.854 -15.280  -3.424
  155    H    ALA  24           H        ALA  24   9.046 -13.057  -4.889
  156    HA   ALA  24           HA       ALA  24  11.466 -13.783  -6.161
  157   1HB   ALA  24          1HB       ALA  24   9.538 -11.578  -6.885
  158   2HB   ALA  24          2HB       ALA  24   9.437 -13.255  -7.416
  159   3HB   ALA  24          3HB       ALA  24  10.788 -12.248  -7.933
  160    H    ILE  25           H        ILE  25  10.375 -10.731  -4.671
  161    HA   ILE  25           HA       ILE  25  12.776  -9.357  -5.340
  162    HB   ILE  25           HB       ILE  25  10.732  -8.097  -4.972
  163   1HG1  ILE  25          2HG1      ILE  25  12.856  -7.458  -2.914
  164   2HG1  ILE  25          1HG1      ILE  25  12.911  -7.010  -4.615
  165   1HG2  ILE  25          1HG2      ILE  25  10.954  -8.924  -2.081
  166   2HG2  ILE  25          2HG2      ILE  25   9.728  -9.470  -3.226
  167   3HG2  ILE  25          3HG2      ILE  25   9.792  -7.775  -2.746
  168   1HD1  ILE  25          1HD1      ILE  25  10.882  -6.056  -2.608
  169   2HD1  ILE  25          2HD1      ILE  25  10.940  -5.606  -4.311
  170   3HD1  ILE  25          3HD1      ILE  25  12.248  -5.132  -3.229
  171    H    ASN  26           H        ASN  26  11.744 -11.175  -2.494
  172    HA   ASN  26           HA       ASN  26  13.931 -10.370  -0.871
  173   1HB   ASN  26          2HB       ASN  26  11.781 -11.532  -0.090
  174   2HB   ASN  26          1HB       ASN  26  12.530 -13.033  -0.632
  175   1HD2  ASN  26          1HD2      ASN  26  14.241 -13.899   0.531
  176   2HD2  ASN  26          2HD2      ASN  26  14.699 -13.300   2.094
  177    H    GLY  27           H        GLY  27  13.436 -12.871  -3.261
  178   1HA   GLY  27          2HA       GLY  27  15.890 -14.237  -2.896
  179   2HA   GLY  27          1HA       GLY  27  14.917 -14.235  -4.362
  180    H    LEU  28           H        LEU  28  15.062 -11.241  -4.419
  181    HA   LEU  28           HA       LEU  28  17.500 -11.052  -5.953
  182   1HB   LEU  28          2HB       LEU  28  15.541  -8.861  -5.255
  183   2HB   LEU  28          1HB       LEU  28  16.748  -8.821  -6.524
  184    HG   LEU  28           HG       LEU  28  14.298 -10.586  -6.458
  185   1HD1  LEU  28          1HD1      LEU  28  15.000  -8.217  -8.183
  186   2HD1  LEU  28          2HD1      LEU  28  13.794  -8.243  -6.895
  187   3HD1  LEU  28          3HD1      LEU  28  13.561  -9.224  -8.343
  188   1HD2  LEU  28          1HD2      LEU  28  16.411 -10.286  -8.589
  189   2HD2  LEU  28          2HD2      LEU  28  14.939 -11.248  -8.714
  190   3HD2  LEU  28          3HD2      LEU  28  16.188 -11.693  -7.550
  191    H    TYR  29           H        TYR  29  16.482 -10.366  -2.757
  192    HA   TYR  29           HA       TYR  29  18.970  -8.869  -2.260
  193   1HB   TYR  29          2HB       TYR  29  16.222  -8.408  -1.092
  194   2HB   TYR  29          1HB       TYR  29  17.681  -7.752  -0.369
  195    HD1  TYR  29           1HD      TYR  29  15.863  -7.816  -3.640
  196    HD2  TYR  29           2HD      TYR  29  18.389  -5.647  -0.997
  197    HE1  TYR  29           1HE      TYR  29  15.726  -5.860  -5.121
  198    HE2  TYR  29           2HE      TYR  29  18.257  -3.690  -2.464
  199    HH   TYR  29           HH       TYR  29  17.764  -3.085  -4.705
  200    H    ILE  30           H        ILE  30  18.694 -11.690  -2.098
  201    HA   ILE  30           HA       ILE  30  18.199 -12.583   0.529
  202    HB   ILE  30           HB       ILE  30  19.990 -13.808  -1.580
  203   1HG1  ILE  30          2HG1      ILE  30  17.136 -14.408  -0.762
  204   2HG1  ILE  30          1HG1      ILE  30  17.637 -13.621  -2.256
  205   1HG2  ILE  30          1HG2      ILE  30  20.588 -14.593   0.655
  206   2HG2  ILE  30          2HG2      ILE  30  19.815 -15.876  -0.276
  207   3HG2  ILE  30          3HG2      ILE  30  18.904 -15.016   0.966
  208   1HD1  ILE  30          1HD1      ILE  30  17.065 -15.952  -2.626
  209   2HD1  ILE  30          2HD1      ILE  30  18.281 -16.449  -1.449
  210   3HD1  ILE  30          3HD1      ILE  30  18.775 -15.664  -2.950
  211    H    GLY  31           H        GLY  31  19.213 -11.961   2.264
  212   1HA   GLY  31          2HA       GLY  31  21.365 -12.185   3.485
  213   2HA   GLY  31          1HA       GLY  31  22.113 -11.409   2.094
  214    H    GLN  32           H        GLN  32  19.396  -9.822   2.109
  215    HA   GLN  32           HA       GLN  32  20.449  -7.674   3.790
  216   1HB   GLN  32          2HB       GLN  32  18.051  -7.542   1.967
  217   2HB   GLN  32          1HB       GLN  32  18.977  -6.202   2.623
  218   1HG   GLN  32          2HG       GLN  32  19.963  -8.198   0.610
  219   2HG   GLN  32          1HG       GLN  32  19.434  -6.555   0.270
  220   1HE2  GLN  32          1HE2      GLN  32  20.734  -4.833   0.856
  221   2HE2  GLN  32          2HE2      GLN  32  22.404  -5.040   1.262
  222    H    THR  33           H        THR  33  17.839  -9.925   3.567
  223    HA   THR  33           HA       THR  33  16.216 -10.548   5.026
  224    HB   THR  33           HB       THR  33  17.395  -8.485   6.895
  225    HG1  THR  33           1HG      THR  33  18.906  -9.964   7.019
  226   1HG2  THR  33          1HG2      THR  33  15.458 -10.746   7.431
  227   2HG2  THR  33          2HG2      THR  33  15.087  -9.022   7.499
  228   3HG2  THR  33          3HG2      THR  33  16.210  -9.730   8.661
  229    H    SER  34           H        SER  34  16.636  -7.007   5.144
  230    HA   SER  34           HA       SER  34  13.734  -6.771   4.713
  231   1HB   SER  34          2HB       SER  34  14.165  -4.484   5.915
  232   2HB   SER  34          1HB       SER  34  14.024  -5.964   6.866
  233    HG   SER  34           HG       SER  34  16.378  -4.574   6.113
  234    H    TYR  35           H        TYR  35  16.029  -6.777   2.725
  235    HA   TYR  35           HA       TYR  35  16.556  -5.702   0.769
  236   1HB   TYR  35          2HB       TYR  35  14.162  -3.921   1.231
  237   2HB   TYR  35          1HB       TYR  35  14.885  -4.400  -0.302
  238    HD1  TYR  35           1HD      TYR  35  14.839  -6.984  -0.801
  239    HD2  TYR  35           2HD      TYR  35  12.260  -5.024   1.962
  240    HE1  TYR  35           1HE      TYR  35  13.236  -8.832  -1.000
  241    HE2  TYR  35           2HE      TYR  35  10.648  -6.872   1.770
  242    HH   TYR  35           HH       TYR  35  10.067  -8.642   0.082
  243    H    SER  36           H        SER  36  17.349  -4.721   3.464
  244    HA   SER  36           HA       SER  36  17.676  -1.988   3.560
  245   1HB   SER  36          2HB       SER  36  19.738  -4.034   4.413
  246   2HB   SER  36          1HB       SER  36  19.498  -2.415   5.077
  247    HG   SER  36           HG       SER  36  18.154  -3.312   6.414
  248    H    GLY  37           H        GLY  37  19.310  -0.601   2.837
  249   1HA   GLY  37          2HA       GLY  37  21.214  -0.244   1.327
  250   2HA   GLY  37          1HA       GLY  37  20.590  -1.585   0.368
  251    H    LEU  38           H        LEU  38  17.916  -1.068   0.278
  252    HA   LEU  38           HA       LEU  38  17.728   1.294  -1.381
  253   1HB   LEU  38          2HB       LEU  38  15.554  -0.525  -0.332
  254   2HB   LEU  38          1HB       LEU  38  15.341   0.713  -1.551
  255    HG   LEU  38           HG       LEU  38  17.026  -1.774  -1.858
  256   1HD1  LEU  38          1HD1      LEU  38  15.270  -2.467  -3.422
  257   2HD1  LEU  38          2HD1      LEU  38  14.338  -1.030  -3.008
  258   3HD1  LEU  38          3HD1      LEU  38  14.642  -2.264  -1.787
  259   1HD2  LEU  38          1HD2      LEU  38  17.180  -1.112  -4.203
  260   2HD2  LEU  38          2HD2      LEU  38  17.889   0.115  -3.151
  261   3HD2  LEU  38          3HD2      LEU  38  16.291   0.369  -3.851
  262    H    ASP  39           H        ASP  39  16.914   0.331   1.847
  263    HA   ASP  39           HA       ASP  39  14.973   2.030   2.673
  264   1HB   ASP  39          2HB       ASP  39  15.689   0.402   4.201
  265   2HB   ASP  39          1HB       ASP  39  17.365   0.928   4.122
  266    H    SER  40           H        SER  40  18.340   2.770   3.507
  267    HA   SER  40           HA       SER  40  17.700   5.408   4.231
  268   1HB   SER  40          2HB       SER  40  20.440   4.314   3.581
  269   2HB   SER  40          1HB       SER  40  20.052   5.662   4.653
  270    HG   SER  40           HG       SER  40  18.658   3.548   5.479
  271    H    THR  41           H        THR  41  18.913   3.967   1.279
  272    HA   THR  41           HA       THR  41  19.906   6.263   0.032
  273    HB   THR  41           HB       THR  41  18.704   3.829  -1.294
  274    HG1  THR  41           1HG      THR  41  20.496   2.812  -0.759
  275   1HG2  THR  41          1HG2      THR  41  20.242   4.382  -3.135
  276   2HG2  THR  41          2HG2      THR  41  20.733   5.843  -2.277
  277   3HG2  THR  41          3HG2      THR  41  19.074   5.671  -2.850
  278    H    ILE  42           H        ILE  42  16.687   4.740  -0.219
  279    HA   ILE  42           HA       ILE  42  15.706   6.693  -2.057
  280    HB   ILE  42           HB       ILE  42  14.199   4.711  -0.342
  281   1HG1  ILE  42          2HG1      ILE  42  15.739   3.634  -1.906
  282   2HG1  ILE  42          1HG1      ILE  42  14.074   3.378  -2.409
  283   1HG2  ILE  42          1HG2      ILE  42  13.263   6.349  -2.693
  284   2HG2  ILE  42          2HG2      ILE  42  12.730   6.505  -1.018
  285   3HG2  ILE  42          3HG2      ILE  42  12.349   5.045  -1.933
  286   1HD1  ILE  42          1HD1      ILE  42  16.003   5.365  -3.589
  287   2HD1  ILE  42          2HD1      ILE  42  14.322   5.153  -4.083
  288   3HD1  ILE  42          3HD1      ILE  42  15.483   3.844  -4.315
  289    H    LEU  43           H        LEU  43  15.665   6.318   1.417
  290    HA   LEU  43           HA       LEU  43  13.749   8.287   2.030
  291   1HB   LEU  43          2HB       LEU  43  14.586   6.567   3.592
  292   2HB   LEU  43          1HB       LEU  43  16.130   7.396   3.657
  293    HG   LEU  43           HG       LEU  43  14.882   9.403   4.570
  294   1HD1  LEU  43          1HD1      LEU  43  12.688   7.355   4.843
  295   2HD1  LEU  43          2HD1      LEU  43  12.649   8.812   3.849
  296   3HD1  LEU  43          3HD1      LEU  43  12.703   8.946   5.607
  297   1HD2  LEU  43          1HD2      LEU  43  16.212   7.947   5.993
  298   2HD2  LEU  43          2HD2      LEU  43  14.846   6.844   6.167
  299   3HD2  LEU  43          3HD2      LEU  43  14.757   8.474   6.835
  300    H    LEU  44           H        LEU  44  17.324   8.497   2.133
  301    HA   LEU  44           HA       LEU  44  17.254  11.321   2.583
  302   1HB   LEU  44          2HB       LEU  44  19.701  11.227   2.349
  303   2HB   LEU  44          1HB       LEU  44  19.081  10.054   3.488
  304    HG   LEU  44           HG       LEU  44  19.252   8.385   1.498
  305   1HD1  LEU  44          1HD1      LEU  44  21.163  10.533   0.593
  306   2HD1  LEU  44          2HD1      LEU  44  19.718   9.987  -0.258
  307   3HD1  LEU  44          3HD1      LEU  44  21.085   8.894  -0.049
  308   1HD2  LEU  44          1HD2      LEU  44  21.581   7.903   2.101
  309   2HD2  LEU  44          2HD2      LEU  44  20.581   8.241   3.513
  310   3HD2  LEU  44          3HD2      LEU  44  21.686   9.471   2.901
  311    H    ASN  45           H        ASN  45  16.831   9.495  -0.168
  312    HA   ASN  45           HA       ASN  45  18.202  10.906  -2.159
  313   1HB   ASN  45          2HB       ASN  45  17.095   8.724  -2.539
  314   2HB   ASN  45          1HB       ASN  45  15.527   9.512  -2.362
  315   1HD2  ASN  45          1HD2      ASN  45  18.335   9.127  -4.394
  316   2HD2  ASN  45          2HD2      ASN  45  17.628   9.818  -5.823
  317    H    THR  46           H        THR  46  14.943  11.356  -0.842
  318    HA   THR  46           HA       THR  46  14.733  13.820  -2.440
  319    HB   THR  46           HB       THR  46  12.466  12.067  -1.484
  320    HG1  THR  46           1HG      THR  46  14.151  11.658  -3.480
  321   1HG2  THR  46          1HG2      THR  46  11.119  13.382  -3.067
  322   2HG2  THR  46          2HG2      THR  46  12.524  14.391  -3.413
  323   3HG2  THR  46          3HG2      THR  46  11.810  14.394  -1.798
  324    H    SER  47           H        SER  47  15.491  15.263  -0.934
  325    HA   SER  47           HA       SER  47  15.240  16.847   0.677
  326   1HB   SER  47          2HB       SER  47  13.019  17.039  -0.395
  327   2HB   SER  47          1HB       SER  47  12.383  15.842   0.730
  328    HG   SER  47           HG       SER  47  12.880  17.292   2.434
  329    H    ALA  48           H        ALA  48  15.805  13.962   1.431
  330    HA   ALA  48           HA       ALA  48  16.273  12.753   3.292
  331   1HB   ALA  48          1HB       ALA  48  15.352  15.151   4.874
  332   2HB   ALA  48          2HB       ALA  48  16.999  14.864   4.311
  333   3HB   ALA  48          3HB       ALA  48  16.268  13.776   5.491
  334    H    ILE  49           H        ILE  49  13.188  14.449   3.362
  335    HA   ILE  49           HA       ILE  49  11.918  11.936   4.239
  336    HB   ILE  49           HB       ILE  49  10.847  14.751   4.524
  337   1HG1  ILE  49          2HG1      ILE  49  12.640  14.237   6.137
  338   2HG1  ILE  49          1HG1      ILE  49  11.080  14.405   6.935
  339   1HG2  ILE  49          1HG2      ILE  49   9.652  12.114   5.363
  340   2HG2  ILE  49          2HG2      ILE  49   9.057  13.184   4.095
  341   3HG2  ILE  49          3HG2      ILE  49   9.007  13.701   5.780
  342   1HD1  ILE  49          1HD1      ILE  49  10.884  11.971   7.039
  343   2HD1  ILE  49          2HD1      ILE  49  12.330  12.556   7.864
  344   3HD1  ILE  49          3HD1      ILE  49  12.462  11.819   6.266
  345    HA   PRO  50           HA       PRO  50  10.938  12.049  -0.177
  346   1HB   PRO  50          2HB       PRO  50   9.485   9.599   0.722
  347   2HB   PRO  50          1HB       PRO  50  10.582   9.827  -0.648
  348   1HG   PRO  50          2HG       PRO  50  11.418   8.558   1.517
  349   2HG   PRO  50          1HG       PRO  50  12.486   9.694   0.670
  350   1HD   PRO  50          2HD       PRO  50  10.951  10.069   3.207
  351   2HD   PRO  50          1HD       PRO  50  12.582  10.628   2.781
  352    H    ASP  51           H        ASP  51   9.430  13.496  -0.730
  353    HA   ASP  51           HA       ASP  51   6.923  13.722   0.663
  354   1HB   ASP  51          2HB       ASP  51   6.532  15.657  -0.603
  355   2HB   ASP  51          1HB       ASP  51   8.284  15.630  -0.429
  356    H    ASN  52           H        ASN  52   8.056  11.771  -1.789
  357    HA   ASN  52           HA       ASN  52   5.828  11.631  -3.524
  358   1HB   ASN  52          2HB       ASN  52   6.816   9.403  -4.188
  359   2HB   ASN  52          1HB       ASN  52   7.903  10.779  -4.331
  360   1HD2  ASN  52          1HD2      ASN  52   7.189   7.852  -2.578
  361   2HD2  ASN  52          2HD2      ASN  52   8.701   7.757  -1.748
  362    H    TYR  53           H        TYR  53   6.323  10.536  -0.374
  363    HA   TYR  53           HA       TYR  53   4.740   8.229  -0.186
  364   1HB   TYR  53          2HB       TYR  53   5.259  10.443   1.803
  365   2HB   TYR  53          1HB       TYR  53   4.457   8.932   2.201
  366    HD1  TYR  53           1HD      TYR  53   6.459   7.458   0.136
  367    HD2  TYR  53           2HD      TYR  53   6.908   9.908   3.578
  368    HE1  TYR  53           1HE      TYR  53   8.614   6.381   0.610
  369    HE2  TYR  53           2HE      TYR  53   9.067   8.841   4.066
  370    HH   TYR  53           HH       TYR  53  10.575   6.621   1.827
  371    H    LYS  54           H        LYS  54   3.808  11.387  -0.950
  372    HA   LYS  54           HA       LYS  54   1.010  10.551  -0.813
  373   1HB   LYS  54          2HB       LYS  54   0.399  12.822   0.055
  374   2HB   LYS  54          1HB       LYS  54   1.278  11.820   1.199
  375   1HG   LYS  54          2HG       LYS  54   3.348  13.017   0.635
  376   2HG   LYS  54          1HG       LYS  54   2.428  14.051  -0.459
  377   1HD   LYS  54          2HD       LYS  54   1.103  14.874   1.410
  378   2HD   LYS  54          1HD       LYS  54   1.967  13.799   2.513
  379   1HE   LYS  54          2HE       LYS  54   4.055  14.959   2.021
  380   2HE   LYS  54          1HE       LYS  54   3.217  16.015   0.887
  381   1HZ   LYS  54          1HZ       LYS  54   3.529  17.102   3.012
  382   2HZ   LYS  54          2HZ       LYS  54   2.714  15.851   3.810
  383   3HZ   LYS  54          3HZ       LYS  54   1.877  16.852   2.724
  384    H    ASP  55           H        ASP  55  -0.228  11.416  -2.478
  385    HA   ASP  55           HA       ASP  55   1.147  13.181  -4.369
  386   1HB   ASP  55          2HB       ASP  55   0.052  12.129  -6.098
  387   2HB   ASP  55          1HB       ASP  55   0.125  10.791  -4.975
  388    H    THR  56           H        THR  56  -0.423  14.715  -5.524
  389    HA   THR  56           HA       THR  56  -2.566  15.590  -3.706
  390    HB   THR  56           HB       THR  56  -1.954  17.945  -4.736
  391    HG1  THR  56           1HG      THR  56   0.618  16.753  -4.612
  392   1HG2  THR  56          1HG2      THR  56  -0.554  18.391  -2.776
  393   2HG2  THR  56          2HG2      THR  56  -0.365  16.657  -2.516
  394   3HG2  THR  56          3HG2      THR  56  -1.953  17.406  -2.351
  395    H    THR  57           H        THR  57  -2.168  14.113  -6.426
  396    HA   THR  57           HA       THR  57  -3.767  15.794  -8.186
  397    HB   THR  57           HB       THR  57  -2.722  12.997  -8.675
  398    HG1  THR  57           1HG      THR  57  -1.431  15.402  -8.594
  399   1HG2  THR  57          1HG2      THR  57  -4.525  13.654 -10.178
  400   2HG2  THR  57          2HG2      THR  57  -2.992  13.599 -11.046
  401   3HG2  THR  57          3HG2      THR  57  -3.678  15.150 -10.564
  402    H    ASN  58           H        ASN  58  -3.852  12.645  -6.625
  403    HA   ASN  58           HA       ASN  58  -6.125  12.254  -5.455
  404   1HB   ASN  58          2HB       ASN  58  -6.873  12.601  -8.304
  405   2HB   ASN  58          1HB       ASN  58  -7.557  11.189  -7.509
  406   1HD2  ASN  58          1HD2      ASN  58  -6.858  14.205  -5.877
  407   2HD2  ASN  58          2HD2      ASN  58  -8.505  14.637  -5.580
  408    H    LYS  59           H        LYS  59  -3.491  11.077  -6.731
  409    HA   LYS  59           HA       LYS  59  -4.331   8.314  -6.673
  410   1HB   LYS  59          2HB       LYS  59  -3.171   8.111  -9.067
  411   2HB   LYS  59          1HB       LYS  59  -4.893   8.386  -8.864
  412   1HG   LYS  59          2HG       LYS  59  -4.164   9.881 -10.544
  413   2HG   LYS  59          1HG       LYS  59  -4.427  10.851  -9.098
  414   1HD   LYS  59          2HD       LYS  59  -2.404  11.628 -10.023
  415   2HD   LYS  59          1HD       LYS  59  -1.936  10.608  -8.659
  416   1HE   LYS  59          2HE       LYS  59  -0.487   9.952 -10.362
  417   2HE   LYS  59          1HE       LYS  59  -1.753   8.726 -10.395
  418   1HZ   LYS  59          1HZ       LYS  59  -1.356  10.989 -12.260
  419   2HZ   LYS  59          2HZ       LYS  59  -2.819  10.133 -12.182
  420   3HZ   LYS  59          3HZ       LYS  59  -1.391   9.331 -12.617
  421    H    LYS  60           H        LYS  60  -2.672   8.501  -4.886
  422    HA   LYS  60           HA       LYS  60  -0.394   7.126  -6.104
  423   1HB   LYS  60          2HB       LYS  60   0.234   9.477  -5.266
  424   2HB   LYS  60          1HB       LYS  60  -0.030   8.847  -3.652
  425   1HG   LYS  60          2HG       LYS  60   1.958   7.670  -5.598
  426   2HG   LYS  60          1HG       LYS  60   2.352   8.902  -4.397
  427   1HD   LYS  60          2HD       LYS  60   1.212   6.190  -3.758
  428   2HD   LYS  60          1HD       LYS  60   2.927   6.609  -3.692
  429   1HE   LYS  60          2HE       LYS  60   2.233   8.489  -2.126
  430   2HE   LYS  60          1HE       LYS  60   0.678   7.664  -2.013
  431   1HZ   LYS  60          1HZ       LYS  60   2.066   6.970  -0.229
  432   2HZ   LYS  60          2HZ       LYS  60   3.339   6.573  -1.269
  433   3HZ   LYS  60          3HZ       LYS  60   1.906   5.664  -1.292
  434    H    ILE  61           H        ILE  61  -0.365   5.097  -5.385
  435    HA   ILE  61           HA       ILE  61  -1.127   4.618  -2.588
  436    HB   ILE  61           HB       ILE  61  -2.067   2.415  -3.212
  437   1HG1  ILE  61          2HG1      ILE  61  -1.788   3.451  -6.043
  438   2HG1  ILE  61          1HG1      ILE  61  -1.007   2.036  -5.345
  439   1HG2  ILE  61          1HG2      ILE  61  -4.200   3.251  -4.050
  440   2HG2  ILE  61          2HG2      ILE  61  -3.425   4.778  -4.480
  441   3HG2  ILE  61          3HG2      ILE  61  -3.532   4.287  -2.788
  442   1HD1  ILE  61          1HD1      ILE  61  -3.966   2.357  -5.758
  443   2HD1  ILE  61          2HD1      ILE  61  -3.148   0.932  -5.115
  444   3HD1  ILE  61          3HD1      ILE  61  -2.873   1.429  -6.785
  445    H    THR  62           H        THR  62   0.038   3.001  -1.520
  446    HA   THR  62           HA       THR  62   2.583   2.364  -2.811
  447    HB   THR  62           HB       THR  62   1.747   2.110   0.077
  448    HG1  THR  62           1HG      THR  62   3.654   3.951  -0.610
  449   1HG2  THR  62          1HG2      THR  62   4.132   1.900   0.529
  450   2HG2  THR  62          2HG2      THR  62   4.463   1.914  -1.204
  451   3HG2  THR  62          3HG2      THR  62   3.555   0.579  -0.491
  452    H    ASN  63           H        ASN  63   3.301   0.324  -3.137
  453    HA   ASN  63           HA       ASN  63   3.305  -1.910  -3.503
  454   1HB   ASN  63          2HB       ASN  63   1.385  -1.802  -1.217
  455   2HB   ASN  63          1HB       ASN  63   1.604  -3.309  -2.098
  456   1HD2  ASN  63          1HD2      ASN  63   4.437  -2.682  -2.655
  457   2HD2  ASN  63          2HD2      ASN  63   5.270  -2.985  -1.170
  458    HA   PRO  64           HA       PRO  64  -0.690  -1.743  -5.974
  459   1HB   PRO  64          2HB       PRO  64   0.354  -0.088  -8.063
  460   2HB   PRO  64          1HB       PRO  64  -0.982   0.263  -6.968
  461   1HG   PRO  64          2HG       PRO  64   1.427   1.590  -6.982
  462   2HG   PRO  64          1HG       PRO  64   0.319   1.527  -5.610
  463   1HD   PRO  64          2HD       PRO  64   2.802  -0.050  -6.102
  464   2HD   PRO  64          1HD       PRO  64   2.168   0.635  -4.576
  465    H    PHE  65           H        PHE  65  -0.427  -1.759  -8.754
  466    HA   PHE  65           HA       PHE  65   0.804  -4.362  -8.923
  467   1HB   PHE  65          2HB       PHE  65  -1.038  -2.897 -10.799
  468   2HB   PHE  65          1HB       PHE  65  -0.404  -4.511 -11.107
  469    HD1  PHE  65           1HD      PHE  65  -0.880  -6.315  -9.368
  470    HD2  PHE  65           2HD      PHE  65  -2.964  -2.612  -9.525
  471    HE1  PHE  65           1HE      PHE  65  -2.703  -7.290  -8.035
  472    HE2  PHE  65           2HE      PHE  65  -4.792  -3.579  -8.193
  473    HZ   PHE  65           HZ       PHE  65  -4.662  -5.924  -7.445
  474    H    GLY  66           H        GLY  66   1.171  -1.246 -10.762
  475   1HA   GLY  66          2HA       GLY  66   3.791  -1.493 -11.378
  476   2HA   GLY  66          1HA       GLY  66   3.047  -2.604 -12.510
  477    H    GLY  67           H        GLY  67   3.294   0.712 -11.514
  478   1HA   GLY  67          2HA       GLY  67   3.031   1.458 -14.340
  479   2HA   GLY  67          1HA       GLY  67   2.097   2.344 -13.142
  480    H    GLU  68           H        GLU  68   2.997   4.198 -12.574
  481    HA   GLU  68           HA       GLU  68   5.876   4.543 -12.764
  482   1HB   GLU  68          2HB       GLU  68   4.251   6.329 -13.439
  483   2HB   GLU  68          1HB       GLU  68   3.753   6.452 -11.759
  484   1HG   GLU  68          2HG       GLU  68   5.954   7.198 -11.122
  485   2HG   GLU  68          1HG       GLU  68   6.536   6.978 -12.773
  486    H    LEU  69           H        LEU  69   6.921   3.481 -11.151
  487    HA   LEU  69           HA       LEU  69   5.862   3.821  -8.431
  488   1HB   LEU  69          2HB       LEU  69   6.508   1.472  -7.955
  489   2HB   LEU  69          1HB       LEU  69   5.199   1.646  -9.106
  490    HG   LEU  69           HG       LEU  69   7.168   1.422 -10.860
  491   1HD1  LEU  69          1HD1      LEU  69   8.842  -0.205 -10.096
  492   2HD1  LEU  69          2HD1      LEU  69   8.237  -0.031  -8.448
  493   3HD1  LEU  69          3HD1      LEU  69   8.980   1.345  -9.264
  494   1HD2  LEU  69          1HD2      LEU  69   6.713  -0.989 -10.942
  495   2HD2  LEU  69          2HD2      LEU  69   5.242  -0.039 -10.737
  496   3HD2  LEU  69          3HD2      LEU  69   5.945  -0.887  -9.359
  497    H    ASN  70           H        ASN  70   7.213   4.077  -6.810
  498    HA   ASN  70           HA       ASN  70  10.108   4.151  -7.325
  499   1HB   ASN  70          2HB       ASN  70   9.202   6.235  -6.440
  500   2HB   ASN  70          1HB       ASN  70   8.419   5.371  -5.122
  501   1HD2  ASN  70          1HD2      ASN  70   9.446   6.508  -3.524
  502   2HD2  ASN  70          2HD2      ASN  70  11.130   6.330  -3.177
  503    H    VAL  71           H        VAL  71  11.409   2.666  -6.348
  504    HA   VAL  71           HA       VAL  71  10.068   0.583  -4.813
  505    HB   VAL  71           HB       VAL  71  12.170  -0.702  -5.087
  506   1HG1  VAL  71          1HG1      VAL  71  11.944  -1.070  -7.505
  507   2HG1  VAL  71          2HG1      VAL  71  11.006   0.418  -7.635
  508   3HG1  VAL  71          3HG1      VAL  71  10.377  -0.942  -6.707
  509   1HG2  VAL  71          1HG2      VAL  71  13.059   1.671  -6.728
  510   2HG2  VAL  71          2HG2      VAL  71  13.897   0.120  -6.625
  511   3HG2  VAL  71          3HG2      VAL  71  13.756   1.145  -5.196
  512    H    GLY  72           H        GLY  72  10.414   0.135  -2.710
  513   1HA   GLY  72          2HA       GLY  72  12.742   1.110  -1.315
  514   2HA   GLY  72          1HA       GLY  72  11.250   1.922  -0.862
  515    HA   PRO  73           HA       PRO  73  11.208  -2.130   1.400
  516   1HB   PRO  73          2HB       PRO  73  13.399  -2.374   2.874
  517   2HB   PRO  73          1HB       PRO  73  13.454  -2.703   1.138
  518   1HG   PRO  73          2HG       PRO  73  14.547  -0.415   2.652
  519   2HG   PRO  73          1HG       PRO  73  15.046  -1.067   1.082
  520   1HD   PRO  73          2HD       PRO  73  13.272   1.164   1.640
  521   2HD   PRO  73          1HD       PRO  73  13.890   0.603   0.072
  522    H    ALA  74           H        ALA  74  11.292  -2.604   3.857
  523    HA   ALA  74           HA       ALA  74  10.790  -0.141   5.388
  524   1HB   ALA  74          1HB       ALA  74  10.036  -2.990   6.034
  525   2HB   ALA  74          2HB       ALA  74   8.952  -1.741   5.417
  526   3HB   ALA  74          3HB       ALA  74   9.663  -1.577   7.022
  527    H    ASN  75           H        ASN  75  11.398  -0.556   7.846
  528    HA   ASN  75           HA       ASN  75  14.200  -0.634   7.969
  529   1HB   ASN  75          2HB       ASN  75  12.932   0.613   9.616
  530   2HB   ASN  75          1HB       ASN  75  12.157  -0.860  10.190
  531   1HD2  ASN  75          1HD2      ASN  75  13.215  -2.179  11.580
  532   2HD2  ASN  75          2HD2      ASN  75  14.742  -1.801  12.306
  533    H    ASN  76           H        ASN  76  11.789  -3.082   8.921
  534    HA   ASN  76           HA       ASN  76  13.724  -5.132   8.293
  535   1HB   ASN  76          2HB       ASN  76  14.075  -4.600  10.749
  536   2HB   ASN  76          1HB       ASN  76  12.444  -5.208  11.030
  537   1HD2  ASN  76          1HD2      ASN  76  15.695  -6.023  10.150
  538   2HD2  ASN  76          2HD2      ASN  76  15.530  -7.736  10.305
  539    H    ASN  77           H        ASN  77  12.788  -7.133   7.858
  540    HA   ASN  77           HA       ASN  77  10.333  -6.928   6.537
  541   1HB   ASN  77          2HB       ASN  77  12.125  -8.496   5.882
  542   2HB   ASN  77          1HB       ASN  77  11.819  -9.443   7.334
  543   1HD2  ASN  77          1HD2      ASN  77  10.674  -8.596   4.171
  544   2HD2  ASN  77          2HD2      ASN  77   9.447  -9.815   4.060
  545    H    THR  78           H        THR  78  11.077  -8.036   9.781
  546    HA   THR  78           HA       THR  78   8.762  -9.558  10.243
  547    HB   THR  78           HB       THR  78   9.193  -9.017  12.685
  548    HG1  THR  78           1HG      THR  78  10.560  -7.465  13.121
  549   1HG2  THR  78          1HG2      THR  78  11.495 -10.070  11.038
  550   2HG2  THR  78          2HG2      THR  78  10.102 -11.004  11.583
  551   3HG2  THR  78          3HG2      THR  78  11.244 -10.354  12.761
  552    H    ALA  79           H        ALA  79   9.378  -6.111  10.504
  553    HA   ALA  79           HA       ALA  79   6.721  -5.561  11.505
  554   1HB   ALA  79          1HB       ALA  79   8.839  -3.671  10.480
  555   2HB   ALA  79          2HB       ALA  79   8.597  -4.129  12.164
  556   3HB   ALA  79          3HB       ALA  79   7.355  -3.210  11.313
  557    H    PHE  80           H        PHE  80   8.509  -4.633   8.578
  558    HA   PHE  80           HA       PHE  80   6.146  -5.162   6.953
  559   1HB   PHE  80          2HB       PHE  80   7.598  -2.499   6.902
  560   2HB   PHE  80          1HB       PHE  80   6.320  -2.987   5.796
  561    HD1  PHE  80           1HD      PHE  80   7.101  -1.495   8.946
  562    HD2  PHE  80           2HD      PHE  80   4.023  -3.444   6.747
  563    HE1  PHE  80           1HE      PHE  80   5.421  -0.564  10.481
  564    HE2  PHE  80           2HE      PHE  80   2.335  -2.516   8.280
  565    HZ   PHE  80           HZ       PHE  80   3.040  -1.117  10.182
  566    H    GLY  81           H        GLY  81   6.744  -5.186   4.603
  567   1HA   GLY  81          2HA       GLY  81   9.427  -6.357   4.427
  568   2HA   GLY  81          1HA       GLY  81   8.093  -6.694   3.336
  569    H    TYR  82           H        TYR  82   7.482  -5.078   1.826
  570    HA   TYR  82           HA       TYR  82   9.545  -3.082   1.247
  571   1HB   TYR  82          2HB       TYR  82   9.448  -3.746  -1.166
  572   2HB   TYR  82          1HB       TYR  82  10.143  -4.992  -0.133
  573    HD1  TYR  82           1HD      TYR  82   8.741  -6.986   0.484
  574    HD2  TYR  82           2HD      TYR  82   7.489  -4.168  -2.452
  575    HE1  TYR  82           1HE      TYR  82   7.103  -8.607  -0.367
  576    HE2  TYR  82           2HE      TYR  82   5.847  -5.787  -3.308
  577    HH   TYR  82           HH       TYR  82   4.953  -8.588  -1.634
  578    H    TYR  83           H        TYR  83   8.782  -1.334  -0.049
  579    HA   TYR  83           HA       TYR  83   5.880  -1.275  -0.444
  580   1HB   TYR  83          2HB       TYR  83   5.651   0.878   0.487
  581   2HB   TYR  83          1HB       TYR  83   6.613  -0.022   1.643
  582    HD1  TYR  83           1HD      TYR  83   8.832   0.638   2.178
  583    HD2  TYR  83           2HD      TYR  83   6.705   2.631  -0.918
  584    HE1  TYR  83           1HE      TYR  83  10.553   2.402   2.135
  585    HE2  TYR  83           2HE      TYR  83   8.419   4.394  -0.974
  586    HH   TYR  83           HH       TYR  83  10.139   5.338   0.374
  587    H    LEU  84           H        LEU  84   5.176   0.211  -2.064
  588    HA   LEU  84           HA       LEU  84   7.261   1.117  -3.918
  589   1HB   LEU  84          2HB       LEU  84   4.769  -0.423  -4.668
  590   2HB   LEU  84          1HB       LEU  84   5.853   0.341  -5.813
  591    HG   LEU  84           HG       LEU  84   6.635  -1.909  -3.956
  592   1HD1  LEU  84          1HD1      LEU  84   6.000  -1.964  -6.905
  593   2HD1  LEU  84          2HD1      LEU  84   4.987  -2.626  -5.622
  594   3HD1  LEU  84          3HD1      LEU  84   6.576  -3.323  -5.938
  595   1HD2  LEU  84          1HD2      LEU  84   8.501  -0.471  -4.585
  596   2HD2  LEU  84          2HD2      LEU  84   8.070  -0.641  -6.289
  597   3HD2  LEU  84          3HD2      LEU  84   8.625  -2.044  -5.373
  598    H    THR  85           H        THR  85   6.986   3.270  -4.068
  599    HA   THR  85           HA       THR  85   4.400   4.462  -3.603
  600    HB   THR  85           HB       THR  85   6.930   5.837  -4.525
  601    HG1  THR  85           1HG      THR  85   6.116   5.053  -1.908
  602   1HG2  THR  85          1HG2      THR  85   5.942   7.782  -3.428
  603   2HG2  THR  85          2HG2      THR  85   4.526   6.818  -3.004
  604   3HG2  THR  85          3HG2      THR  85   4.895   7.146  -4.698
  605    H    LEU  86           H        LEU  86   3.065   4.064  -5.283
  606    HA   LEU  86           HA       LEU  86   4.061   4.665  -7.989
  607   1HB   LEU  86          2HB       LEU  86   3.721   2.245  -7.426
  608   2HB   LEU  86          1HB       LEU  86   2.024   2.589  -7.202
  609    HG   LEU  86           HG       LEU  86   3.428   3.028  -9.833
  610   1HD1  LEU  86          1HD1      LEU  86   2.532   0.848 -10.489
  611   2HD1  LEU  86          2HD1      LEU  86   1.948   0.593  -8.844
  612   3HD1  LEU  86          3HD1      LEU  86   3.680   0.699  -9.158
  613   1HD2  LEU  86          1HD2      LEU  86   0.524   2.641  -9.102
  614   2HD2  LEU  86          2HD2      LEU  86   1.160   2.860 -10.733
  615   3HD2  LEU  86          3HD2      LEU  86   1.278   4.171  -9.557
  616    H    THR  87           H        THR  87   3.019   6.280  -8.935
  617    HA   THR  87           HA       THR  87   0.566   7.257  -7.759
  618    HB   THR  87           HB       THR  87   0.966   8.768 -10.007
  619    HG1  THR  87           1HG      THR  87   3.010   8.689 -10.598
  620   1HG2  THR  87          1HG2      THR  87   2.294   9.147  -7.319
  621   2HG2  THR  87          2HG2      THR  87   0.648   9.623  -7.733
  622   3HG2  THR  87          3HG2      THR  87   2.017  10.410  -8.520
  623    H    ARG  88           H        ARG  88  -1.333   6.620  -8.358
  624    HA   ARG  88           HA       ARG  88  -2.552   6.571 -10.744
  625   1HB   ARG  88          2HB       ARG  88  -0.766   4.677 -11.269
  626   2HB   ARG  88          1HB       ARG  88  -1.839   3.684 -10.290
  627   1HG   ARG  88          2HG       ARG  88  -3.683   4.081 -11.759
  628   2HG   ARG  88          1HG       ARG  88  -2.747   5.252 -12.689
  629   1HD   ARG  88          2HD       ARG  88  -2.839   3.133 -13.852
  630   2HD   ARG  88          1HD       ARG  88  -1.189   3.476 -13.331
  631    HE   ARG  88           HE       ARG  88  -2.978   1.646 -11.856
  632   1HH1  ARG  88          1HH1      ARG  88   0.153   2.515 -13.151
  633   2HH1  ARG  88          2HH1      ARG  88   0.890   1.004 -12.722
  634   1HH2  ARG  88          1HH2      ARG  88  -2.026  -0.303 -11.234
  635   2HH2  ARG  88          2HH2      ARG  88  -0.380  -0.638 -11.663
  636    H    LEU  89           H        LEU  89  -4.671   6.390 -10.263
  637    HA   LEU  89           HA       LEU  89  -5.655   4.365  -8.500
  638   1HB   LEU  89          2HB       LEU  89  -5.058   6.970  -7.415
  639   2HB   LEU  89          1HB       LEU  89  -6.777   6.646  -7.319
  640    HG   LEU  89           HG       LEU  89  -4.532   5.071  -6.074
  641   1HD1  LEU  89          1HD1      LEU  89  -5.691   5.594  -4.010
  642   2HD1  LEU  89          2HD1      LEU  89  -6.950   6.440  -4.912
  643   3HD1  LEU  89          3HD1      LEU  89  -5.301   7.073  -4.889
  644   1HD2  LEU  89          1HD2      LEU  89  -6.114   3.472  -6.994
  645   2HD2  LEU  89          2HD2      LEU  89  -7.455   4.339  -6.243
  646   3HD2  LEU  89          3HD2      LEU  89  -6.250   3.530  -5.238
  647    H    ASP  90           H        ASP  90  -7.935   4.368  -8.329
  648    HA   ASP  90           HA       ASP  90  -9.410   6.110 -10.151
  649   1HB   ASP  90          2HB       ASP  90  -9.417   3.088 -10.184
  650   2HB   ASP  90          1HB       ASP  90 -10.758   4.032 -10.819
  651    H    LYS  91           H        LYS  91 -11.630   6.319  -9.561
  652    HA   LYS  91           HA       LYS  91 -12.215   6.042  -6.818
  653   1HB   LYS  91          2HB       LYS  91 -13.278   7.567  -8.667
  654   2HB   LYS  91          1HB       LYS  91 -14.364   6.206  -8.907
  655   1HG   LYS  91          2HG       LYS  91 -13.955   7.369  -6.183
  656   2HG   LYS  91          1HG       LYS  91 -15.068   8.113  -7.330
  657   1HD   LYS  91          2HD       LYS  91 -16.305   6.019  -7.498
  658   2HD   LYS  91          1HD       LYS  91 -15.178   5.253  -6.373
  659   1HE   LYS  91          2HE       LYS  91 -15.893   6.599  -4.583
  660   2HE   LYS  91          1HE       LYS  91 -16.720   7.726  -5.655
  661   1HZ   LYS  91          1HZ       LYS  91 -18.434   6.487  -4.774
  662   2HZ   LYS  91          2HZ       LYS  91 -17.564   5.035  -4.796
  663   3HZ   LYS  91          3HZ       LYS  91 -18.148   5.689  -6.245
  664    H    ALA  92           H        ALA  92 -12.869   4.050  -9.643
  665    HA   ALA  92           HA       ALA  92 -14.381   2.060  -8.276
  666   1HB   ALA  92          1HB       ALA  92 -14.437   2.312 -10.718
  667   2HB   ALA  92          2HB       ALA  92 -13.995   0.675 -10.237
  668   3HB   ALA  92          3HB       ALA  92 -12.754   1.793 -10.804
  669    H    ALA  93           H        ALA  93 -10.963   2.675  -8.685
  670    HA   ALA  93           HA       ALA  93 -10.070   0.097  -7.863
  671   1HB   ALA  93          1HB       ALA  93  -7.874   1.129  -7.637
  672   2HB   ALA  93          2HB       ALA  93  -8.597   2.730  -7.794
  673   3HB   ALA  93          3HB       ALA  93  -8.636   1.607  -9.154
  674    H    CYS  94           H        CYS  94 -10.917   3.074  -6.247
  675    HA   CYS  94           HA       CYS  94 -10.059   2.544  -3.656
  676   1HB   CYS  94          2HB       CYS  94 -11.038   4.684  -4.296
  677   2HB   CYS  94          1HB       CYS  94 -12.591   3.917  -4.602
  678    H    VAL  95           H        VAL  95 -13.062   1.613  -5.284
  679    HA   VAL  95           HA       VAL  95 -14.171   0.154  -3.137
  680    HB   VAL  95           HB       VAL  95 -14.650  -0.334  -6.077
  681   1HG1  VAL  95          1HG1      VAL  95 -16.859  -1.074  -5.355
  682   2HG1  VAL  95          2HG1      VAL  95 -16.423  -0.763  -3.676
  683   3HG1  VAL  95          3HG1      VAL  95 -15.587  -2.022  -4.584
  684   1HG2  VAL  95          1HG2      VAL  95 -16.487   1.307  -5.889
  685   2HG2  VAL  95          2HG2      VAL  95 -14.895   2.034  -5.670
  686   3HG2  VAL  95          3HG2      VAL  95 -15.922   1.720  -4.270
  687    H    SER  96           H        SER  96 -12.108  -0.715  -5.834
  688    HA   SER  96           HA       SER  96 -12.146  -3.496  -5.498
  689   1HB   SER  96          2HB       SER  96 -11.296  -2.152  -7.473
  690   2HB   SER  96          1HB       SER  96  -9.826  -1.872  -6.542
  691    HG   SER  96           HG       SER  96 -10.897  -4.366  -7.375
  692    H    LEU  97           H        LEU  97 -10.015  -0.993  -4.142
  693    HA   LEU  97           HA       LEU  97  -8.302  -2.769  -2.752
  694   1HB   LEU  97          2HB       LEU  97  -8.996   0.119  -2.183
  695   2HB   LEU  97          1HB       LEU  97  -7.684  -0.763  -1.421
  696    HG   LEU  97           HG       LEU  97  -7.897  -0.167  -4.380
  697   1HD1  LEU  97          1HD1      LEU  97  -6.119   1.023  -2.258
  698   2HD1  LEU  97          2HD1      LEU  97  -7.443   1.840  -3.089
  699   3HD1  LEU  97          3HD1      LEU  97  -6.012   1.342  -3.990
  700   1HD2  LEU  97          1HD2      LEU  97  -5.636  -1.039  -4.524
  701   2HD2  LEU  97          2HD2      LEU  97  -6.732  -2.273  -3.900
  702   3HD2  LEU  97          3HD2      LEU  97  -5.649  -1.414  -2.802
  703    H    ALA  98           H        ALA  98 -11.354  -1.250  -1.979
  704    HA   ALA  98           HA       ALA  98 -11.398  -2.085   0.755
  705   1HB   ALA  98          1HB       ALA  98 -13.723  -1.350   0.729
  706   2HB   ALA  98          2HB       ALA  98 -13.654  -1.178  -1.026
  707   3HB   ALA  98          3HB       ALA  98 -12.664  -0.143   0.003
  708    H    THR  99           H        THR  99 -11.656  -3.793  -2.076
  709    HA   THR  99           HA       THR  99 -13.152  -5.925  -0.703
  710    HB   THR  99           HB       THR  99 -13.729  -6.834  -2.925
  711    HG1  THR  99           1HG      THR  99 -11.952  -4.952  -3.750
  712   1HG2  THR  99          1HG2      THR  99 -14.544  -3.950  -2.556
  713   2HG2  THR  99          2HG2      THR  99 -15.292  -5.340  -1.766
  714   3HG2  THR  99          3HG2      THR  99 -15.400  -5.156  -3.518
  715    H    LEU 100           H        LEU 100 -10.164  -4.986  -1.296
  716    HA   LEU 100           HA       LEU 100  -9.104  -7.564  -2.187
  717   1HB   LEU 100          2HB       LEU 100  -8.329  -5.083  -2.839
  718   2HB   LEU 100          1HB       LEU 100  -7.352  -5.297  -1.399
  719    HG   LEU 100           HG       LEU 100  -7.289  -7.103  -3.823
  720   1HD1  LEU 100          1HD1      LEU 100  -5.122  -6.093  -4.275
  721   2HD1  LEU 100          2HD1      LEU 100  -5.328  -5.007  -2.901
  722   3HD1  LEU 100          3HD1      LEU 100  -6.402  -4.878  -4.294
  723   1HD2  LEU 100          1HD2      LEU 100  -5.307  -8.076  -2.798
  724   2HD2  LEU 100          2HD2      LEU 100  -6.706  -8.264  -1.742
  725   3HD2  LEU 100          3HD2      LEU 100  -5.498  -7.028  -1.393
  726    H    ASN 101           H        ASN 101  -9.495  -8.843  -0.339
  727    HA   ASN 101           HA       ASN 101  -9.133  -7.929   2.281
  728   1HB   ASN 101          2HB       ASN 101 -10.508  -9.885   1.780
  729   2HB   ASN 101          1HB       ASN 101  -9.069 -10.785   1.295
  730   1HD2  ASN 101          1HD2      ASN 101 -10.675  -9.210   3.977
  731   2HD2  ASN 101          2HD2      ASN 101  -9.890 -10.116   5.233
  732    H    LEU 102           H        LEU 102  -7.335  -7.150   2.993
  733    HA   LEU 102           HA       LEU 102  -4.755  -8.244   2.259
  734   1HB   LEU 102          2HB       LEU 102  -5.529  -5.939   4.053
  735   2HB   LEU 102          1HB       LEU 102  -3.885  -6.359   3.625
  736    HG   LEU 102           HG       LEU 102  -6.033  -5.362   1.757
  737   1HD1  LEU 102          1HD1      LEU 102  -5.054  -3.630   3.143
  738   2HD1  LEU 102          2HD1      LEU 102  -4.513  -3.462   1.473
  739   3HD1  LEU 102          3HD1      LEU 102  -3.434  -4.154   2.684
  740   1HD2  LEU 102          1HD2      LEU 102  -3.191  -6.147   1.123
  741   2HD2  LEU 102          2HD2      LEU 102  -4.358  -5.445   0.000
  742   3HD2  LEU 102          3HD2      LEU 102  -4.632  -7.057   0.664
  743    H    GLY 103           H        GLY 103  -6.914  -9.428   4.226
  744   1HA   GLY 103          2HA       GLY 103  -5.275  -9.787   6.600
  745   2HA   GLY 103          1HA       GLY 103  -6.881 -10.448   6.330
  746    H    THR 104           H        THR 104  -5.333 -11.095   3.579
  747    HA   THR 104           HA       THR 104  -4.831 -13.847   4.335
  748    HB   THR 104           HB       THR 104  -4.395 -14.025   1.793
  749    HG1  THR 104           1HG      THR 104  -5.950 -11.795   1.377
  750   1HG2  THR 104          1HG2      THR 104  -6.800 -14.063   1.306
  751   2HG2  THR 104          2HG2      THR 104  -7.118 -13.177   2.797
  752   3HG2  THR 104          3HG2      THR 104  -6.455 -14.809   2.867
  753    H    SER 105           H        SER 105  -3.039 -11.553   2.257
  754    HA   SER 105           HA       SER 105  -0.593 -12.182   3.710
  755   1HB   SER 105          2HB       SER 105  -0.793 -13.765   1.738
  756   2HB   SER 105          1HB       SER 105  -0.669 -12.352   0.690
  757    HG   SER 105           HG       SER 105   1.407 -12.063   1.264
  758    H    ALA 106           H        ALA 106  -1.292  -9.974   4.358
  759    HA   ALA 106           HA       ALA 106   0.270  -8.094   2.772
  760   1HB   ALA 106          1HB       ALA 106  -1.419  -6.337   3.037
  761   2HB   ALA 106          2HB       ALA 106  -2.516  -7.519   3.753
  762   3HB   ALA 106          3HB       ALA 106  -2.014  -7.687   2.072
  763    H    LYS 107           H        LYS 107   0.518  -5.989   4.106
  764    HA   LYS 107           HA       LYS 107   1.158  -6.845   6.832
  765   1HB   LYS 107          2HB       LYS 107   2.170  -4.370   5.456
  766   2HB   LYS 107          1HB       LYS 107   2.816  -5.136   6.894
  767   1HG   LYS 107          2HG       LYS 107   2.887  -6.297   4.119
  768   2HG   LYS 107          1HG       LYS 107   4.231  -5.519   4.952
  769   1HD   LYS 107          2HD       LYS 107   2.810  -8.025   5.855
  770   2HD   LYS 107          1HD       LYS 107   4.387  -7.961   5.065
  771   1HE   LYS 107          2HE       LYS 107   5.278  -6.664   6.925
  772   2HE   LYS 107          1HE       LYS 107   3.700  -6.687   7.709
  773   1HZ   LYS 107          1HZ       LYS 107   3.913  -9.189   7.664
  774   2HZ   LYS 107          2HZ       LYS 107   4.943  -8.376   8.729
  775   3HZ   LYS 107          3HZ       LYS 107   5.544  -8.965   7.255
  776    H    GLY 108           H        GLY 108  -0.305  -4.161   5.011
  777   1HA   GLY 108          2HA       GLY 108  -2.363  -3.658   6.809
  778   2HA   GLY 108          1HA       GLY 108  -1.030  -2.619   7.283
  779    H    TYR 109           H        TYR 109  -3.149  -1.272   6.642
  780    HA   TYR 109           HA       TYR 109  -2.569  -0.174   3.988
  781   1HB   TYR 109          2HB       TYR 109  -4.357  -1.897   3.808
  782   2HB   TYR 109          1HB       TYR 109  -5.319  -0.978   4.956
  783    HD1  TYR 109           1HD      TYR 109  -4.467  -1.454   1.532
  784    HD2  TYR 109           2HD      TYR 109  -6.065   1.351   4.285
  785    HE1  TYR 109           1HE      TYR 109  -5.407  -0.173  -0.342
  786    HE2  TYR 109           2HE      TYR 109  -7.024   2.646   2.421
  787    HH   TYR 109           HH       TYR 109  -6.670   2.969   0.032
  788    H    GLY 110           H        GLY 110  -2.427   2.046   4.142
  789   1HA   GLY 110          2HA       GLY 110  -3.845   3.321   6.403
  790   2HA   GLY 110          1HA       GLY 110  -2.140   3.629   6.126
  791    H    VAL 111           H        VAL 111  -5.175   4.809   5.668
  792    HA   VAL 111           HA       VAL 111  -4.724   5.981   3.047
  793    HB   VAL 111           HB       VAL 111  -7.065   6.469   4.891
  794   1HG1  VAL 111          1HG1      VAL 111  -6.757   8.066   3.032
  795   2HG1  VAL 111          2HG1      VAL 111  -8.237   7.122   2.882
  796   3HG1  VAL 111          3HG1      VAL 111  -6.832   6.723   1.893
  797   1HG2  VAL 111          1HG2      VAL 111  -6.853   4.077   4.495
  798   2HG2  VAL 111          2HG2      VAL 111  -6.774   4.360   2.756
  799   3HG2  VAL 111          3HG2      VAL 111  -8.252   4.731   3.644
  800    H    ASN 112           H        ASN 112  -3.965   7.938   2.706
  801    HA   ASN 112           HA       ASN 112  -3.492  10.139   2.923
  802   1HB   ASN 112          2HB       ASN 112  -5.166   9.830   5.356
  803   2HB   ASN 112          1HB       ASN 112  -4.094  11.226   5.277
  804   1HD2  ASN 112          1HD2      ASN 112  -6.899   9.693   3.982
  805   2HD2  ASN 112          2HD2      ASN 112  -7.422  11.011   2.996
  806    H    ILE 113           H        ILE 113  -2.363   7.734   4.990
  807    HA   ILE 113           HA       ILE 113  -0.495   9.145   6.538
  808    HB   ILE 113           HB       ILE 113  -0.559   6.297   5.559
  809   1HG1  ILE 113          2HG1      ILE 113  -0.636   5.866   8.050
  810   2HG1  ILE 113          1HG1      ILE 113  -0.786   7.605   8.277
  811   1HG2  ILE 113          1HG2      ILE 113   1.424   5.814   6.914
  812   2HG2  ILE 113          2HG2      ILE 113   1.625   7.538   7.225
  813   3HG2  ILE 113          3HG2      ILE 113   1.788   6.914   5.585
  814   1HD1  ILE 113          1HD1      ILE 113  -2.941   6.531   8.420
  815   2HD1  ILE 113          2HD1      ILE 113  -2.721   5.827   6.816
  816   3HD1  ILE 113          3HD1      ILE 113  -2.874   7.575   7.000
  817    H    SER 114           H        SER 114   1.294  10.199   5.998
  818    HA   SER 114           HA       SER 114   2.649   9.450   3.498
  819   1HB   SER 114          2HB       SER 114   1.717  11.815   3.609
  820   2HB   SER 114          1HB       SER 114   2.882  12.127   4.896
  821    HG   SER 114           HG       SER 114   4.311  12.443   3.397
  822    H    GLY 115           H        GLY 115   4.425   8.338   3.867
  823   1HA   GLY 115          2HA       GLY 115   6.630   8.575   5.208
  824   2HA   GLY 115          1HA       GLY 115   5.546   8.374   6.581
  825    H    GLU 116           H        GLU 116   6.195   6.839   3.438
  826    HA   GLU 116           HA       GLU 116   5.023   4.387   4.157
  827   1HB   GLU 116          2HB       GLU 116   6.934   5.114   1.934
  828   2HB   GLU 116          1HB       GLU 116   6.070   3.591   2.048
  829   1HG   GLU 116          2HG       GLU 116   3.969   4.657   1.803
  830   2HG   GLU 116          1HG       GLU 116   4.692   6.250   1.983
  831    H    ASN 117           H        ASN 117   8.239   5.648   4.582
  832    HA   ASN 117           HA       ASN 117   9.552   3.146   4.904
  833   1HB   ASN 117          2HB       ASN 117  10.378   5.787   4.782
  834   2HB   ASN 117          1HB       ASN 117  10.713   5.339   6.453
  835   1HD2  ASN 117          1HD2      ASN 117  12.174   3.640   6.868
  836   2HD2  ASN 117          2HD2      ASN 117  13.327   3.119   5.679
  837    H    ASN 118           H        ASN 118   7.406   4.916   6.859
  838    HA   ASN 118           HA       ASN 118   7.414   2.861   8.858
  839   1HB   ASN 118          2HB       ASN 118   9.237   4.475   9.618
  840   2HB   ASN 118          1HB       ASN 118   7.973   5.678   9.818
  841   1HD2  ASN 118          1HD2      ASN 118   5.975   3.825  10.843
  842   2HD2  ASN 118          2HD2      ASN 118   6.488   3.371  12.432
  843    H    ILE 119           H        ILE 119   5.333   2.690   7.897
  844    HA   ILE 119           HA       ILE 119   3.481   4.825   7.839
  845    HB   ILE 119           HB       ILE 119   3.294   2.911   6.335
  846   1HG1  ILE 119          2HG1      ILE 119   0.899   3.051   8.179
  847   2HG1  ILE 119          1HG1      ILE 119   1.263   4.223   6.918
  848   1HG2  ILE 119          1HG2      ILE 119   2.527   0.733   7.133
  849   2HG2  ILE 119          2HG2      ILE 119   2.622   1.312   8.796
  850   3HG2  ILE 119          3HG2      ILE 119   4.089   1.171   7.827
  851   1HD1  ILE 119          1HD1      ILE 119   1.009   2.513   5.223
  852   2HD1  ILE 119          2HD1      ILE 119  -0.438   2.614   6.228
  853   3HD1  ILE 119          3HD1      ILE 119   0.714   1.301   6.467
  854    H    THR 120           H        THR 120   1.632   5.144   9.110
  855    HA   THR 120           HA       THR 120   2.098   4.965  11.897
  856    HB   THR 120           HB       THR 120  -0.542   5.649  10.604
  857    HG1  THR 120           1HG      THR 120   1.841   7.219  10.809
  858   1HG2  THR 120          1HG2      THR 120  -0.500   5.597  13.060
  859   2HG2  THR 120          2HG2      THR 120  -0.716   7.240  12.462
  860   3HG2  THR 120          3HG2      THR 120   0.858   6.721  13.061
  861    H    SER 121           H        SER 121   0.672   3.997  13.497
  862    HA   SER 121           HA       SER 121   0.150   1.292  13.162
  863   1HB   SER 121          2HB       SER 121  -1.463   1.985  15.254
  864   2HB   SER 121          1HB       SER 121   0.276   1.718  15.377
  865    HG   SER 121           HG       SER 121  -1.155   4.154  15.220
  866    H    PHE 122           H        PHE 122  -2.021   0.212  13.475
  867    HA   PHE 122           HA       PHE 122  -3.821   1.409  11.460
  868   1HB   PHE 122          2HB       PHE 122  -3.264  -1.531  11.858
  869   2HB   PHE 122          1HB       PHE 122  -4.173  -0.788  10.549
  870    HD1  PHE 122           1HD      PHE 122  -3.003   0.487   8.799
  871    HD2  PHE 122           2HD      PHE 122  -0.888  -1.654  11.804
  872    HE1  PHE 122           1HE      PHE 122  -0.958   0.613   7.441
  873    HE2  PHE 122           2HE      PHE 122   1.162  -1.533  10.453
  874    HZ   PHE 122           HZ       PHE 122   1.129  -0.440   8.269
  875    H    GLY 123           H        GLY 123  -6.000   0.528  11.438
  876   1HA   GLY 123          2HA       GLY 123  -6.948  -0.621  13.963
  877   2HA   GLY 123          1HA       GLY 123  -7.687   0.866  13.380
  878    H    ASN 124           H        ASN 124  -9.597   0.488  12.403
  879    HA   ASN 124           HA       ASN 124  -9.657  -1.618  10.367
  880   1HB   ASN 124          2HB       ASN 124 -11.682  -2.609  11.113
  881   2HB   ASN 124          1HB       ASN 124 -10.628  -2.528  12.518
  882   1HD2  ASN 124          1HD2      ASN 124 -13.551  -2.694  12.264
  883   2HD2  ASN 124          2HD2      ASN 124 -14.176  -1.350  13.163
  884    H    SER 125           H        SER 125  -9.894   1.488  10.851
  885    HA   SER 125           HA       SER 125 -12.165   1.853   8.994
  886   1HB   SER 125          2HB       SER 125 -12.772   2.599  11.281
  887   2HB   SER 125          1HB       SER 125 -11.380   3.683  11.286
  888    HG   SER 125           HG       SER 125 -12.528   5.076  10.244
  889    H    ALA 126           H        ALA 126 -11.981   4.076   7.902
  890    HA   ALA 126           HA       ALA 126  -9.190   4.877   7.541
  891   1HB   ALA 126          1HB       ALA 126  -9.405   4.866   5.121
  892   2HB   ALA 126          2HB       ALA 126 -11.044   4.230   5.253
  893   3HB   ALA 126          3HB       ALA 126  -9.674   3.251   5.774
  894    H    ASP 127           H        ASP 127  -9.395   6.869   8.332
  895    HA   ASP 127           HA       ASP 127 -10.734   8.812   6.675
  896   1HB   ASP 127          2HB       ASP 127 -12.463   8.173   8.395
  897   2HB   ASP 127          1HB       ASP 127 -11.354   8.731   9.641
  898    H    GLN 128           H        GLN 128  -8.617   9.352   6.217
  899    HA   GLN 128           HA       GLN 128  -6.500  10.136   6.458
  900   1HB   GLN 128          2HB       GLN 128  -7.732  11.592   8.810
  901   2HB   GLN 128          1HB       GLN 128  -6.165  11.959   8.100
  902   1HG   GLN 128          2HG       GLN 128  -7.290  12.471   5.965
  903   2HG   GLN 128          1HG       GLN 128  -8.845  12.202   6.751
  904   1HE2  GLN 128          1HE2      GLN 128  -7.811  14.608   5.502
  905   2HE2  GLN 128          2HE2      GLN 128  -7.823  15.834   6.722
  906    H    ALA 129           H        ALA 129  -7.117   7.627   7.612
  907    HA   ALA 129           HA       ALA 129  -5.115   7.419   9.705
  908   1HB   ALA 129          1HB       ALA 129  -7.208   7.827  10.926
  909   2HB   ALA 129          2HB       ALA 129  -6.588   6.204  11.223
  910   3HB   ALA 129          3HB       ALA 129  -7.945   6.441  10.122
  911    H    ALA 130           H        ALA 130  -4.873   5.015  10.317
  912    HA   ALA 130           HA       ALA 130  -4.887   3.504   7.796
  913   1HB   ALA 130          1HB       ALA 130  -3.074   3.209  10.188
  914   2HB   ALA 130          2HB       ALA 130  -2.669   4.021   8.674
  915   3HB   ALA 130          3HB       ALA 130  -2.974   2.284   8.691
  916    H    LYS 131           H        LYS 131  -5.191   1.188   7.911
  917    HA   LYS 131           HA       LYS 131  -6.479   0.146  10.311
  918   1HB   LYS 131          2HB       LYS 131  -8.494  -0.454   9.329
  919   2HB   LYS 131          1HB       LYS 131  -8.193   1.112   8.590
  920   1HG   LYS 131          2HG       LYS 131  -7.530  -1.525   7.297
  921   2HG   LYS 131          1HG       LYS 131  -9.015  -0.619   7.015
  922   1HD   LYS 131          2HD       LYS 131  -6.332   0.645   6.616
  923   2HD   LYS 131          1HD       LYS 131  -7.057  -0.358   5.359
  924   1HE   LYS 131          2HE       LYS 131  -8.346   2.055   6.616
  925   2HE   LYS 131          1HE       LYS 131  -7.530   2.037   5.052
  926   1HZ   LYS 131          1HZ       LYS 131 -10.029   0.681   5.828
  927   2HZ   LYS 131          2HZ       LYS 131  -9.161   0.198   4.464
  928   3HZ   LYS 131          3HZ       LYS 131  -9.779   1.773   4.563
  929    H    SER 132           H        SER 132  -6.807  -2.274  10.090
  930    HA   SER 132           HA       SER 132  -4.508  -3.373   8.630
  931   1HB   SER 132          2HB       SER 132  -6.037  -4.429  11.003
  932   2HB   SER 132          1HB       SER 132  -4.681  -5.256  10.241
  933    HG   SER 132           HG       SER 132  -3.393  -3.445  10.774
  934    H    THR 133           H        THR 133  -7.646  -2.998   8.052
  935    HA   THR 133           HA       THR 133  -7.953  -5.649   6.817
  936    HB   THR 133           HB       THR 133 -10.412  -5.187   6.863
  937    HG1  THR 133           1HG      THR 133 -10.664  -3.044   7.126
  938   1HG2  THR 133          1HG2      THR 133 -10.705  -5.617   9.271
  939   2HG2  THR 133          2HG2      THR 133  -9.019  -5.179   9.546
  940   3HG2  THR 133          3HG2      THR 133  -9.416  -6.601   8.578
  941    H    ALA 134           H        ALA 134  -9.181  -5.673   4.796
  942    HA   ALA 134           HA       ALA 134  -9.921  -3.215   3.539
  943   1HB   ALA 134          1HB       ALA 134  -8.656  -3.644   1.458
  944   2HB   ALA 134          2HB       ALA 134  -7.802  -4.956   2.272
  945   3HB   ALA 134          3HB       ALA 134  -7.602  -3.294   2.825
  946    H    ILE 135           H        ILE 135 -11.979  -4.088   3.671
  947    HA   ILE 135           HA       ILE 135 -12.905  -5.834   1.711
  948    HB   ILE 135           HB       ILE 135 -11.574  -7.520   2.958
  949   1HG1  ILE 135          2HG1      ILE 135 -14.577  -7.909   3.009
  950   2HG1  ILE 135          1HG1      ILE 135 -13.493  -8.271   1.669
  951   1HG2  ILE 135          1HG2      ILE 135 -13.513  -6.946   5.195
  952   2HG2  ILE 135          2HG2      ILE 135 -11.783  -6.600   5.191
  953   3HG2  ILE 135          3HG2      ILE 135 -12.348  -8.270   5.164
  954   1HD1  ILE 135          1HD1      ILE 135 -13.456  -9.617   4.353
  955   2HD1  ILE 135          2HD1      ILE 135 -12.428 -10.007   2.974
  956   3HD1  ILE 135          3HD1      ILE 135 -14.168 -10.277   2.879
  957    H    THR 136           H        THR 136 -13.216  -4.126   4.534
  958    HA   THR 136           HA       THR 136 -15.898  -4.721   5.246
  959    HB   THR 136           HB       THR 136 -14.556  -2.125   5.925
  960    HG1  THR 136           1HG      THR 136 -12.894  -3.286   6.575
  961   1HG2  THR 136          1HG2      THR 136 -16.816  -2.556   6.770
  962   2HG2  THR 136          2HG2      THR 136 -15.644  -2.496   8.086
  963   3HG2  THR 136          3HG2      THR 136 -16.253  -4.051   7.519
  964    HA   PRO 137           HA       PRO 137 -17.964  -2.289   2.053
  965   1HB   PRO 137          2HB       PRO 137 -20.143  -2.342   4.075
  966   2HB   PRO 137          1HB       PRO 137 -20.184  -2.785   2.364
  967   1HG   PRO 137          2HG       PRO 137 -20.210  -4.660   4.254
  968   2HG   PRO 137          1HG       PRO 137 -19.294  -4.892   2.753
  969   1HD   PRO 137          2HD       PRO 137 -18.315  -4.174   5.485
  970   2HD   PRO 137          1HD       PRO 137 -17.582  -5.242   4.267
  971    H    ALA 138           H        ALA 138 -18.557  -1.465   5.484
  972    HA   ALA 138           HA       ALA 138 -19.021   1.285   5.040
  973   1HB   ALA 138          1HB       ALA 138 -18.044  -0.055   7.557
  974   2HB   ALA 138          2HB       ALA 138 -19.731   0.104   7.070
  975   3HB   ALA 138          3HB       ALA 138 -18.781   1.543   7.440
  976    H    GLU 139           H        GLU 139 -16.138  -0.549   5.171
  977    HA   GLU 139           HA       GLU 139 -14.281   1.399   5.983
  978   1HB   GLU 139          2HB       GLU 139 -13.926  -1.100   5.710
  979   2HB   GLU 139          1HB       GLU 139 -13.801  -0.809   3.986
  980   1HG   GLU 139          2HG       GLU 139 -11.869   0.592   4.330
  981   2HG   GLU 139          1HG       GLU 139 -12.006   0.369   6.077
  982    H    ALA 140           H        ALA 140 -15.450   0.434   2.765
  983    HA   ALA 140           HA       ALA 140 -14.019   2.401   1.314
  984   1HB   ALA 140          1HB       ALA 140 -15.493   1.847  -0.535
  985   2HB   ALA 140          2HB       ALA 140 -16.586   1.002   0.563
  986   3HB   ALA 140          3HB       ALA 140 -14.960   0.379   0.282
  987    H    ALA 141           H        ALA 141 -16.920   2.486   3.178
  988    HA   ALA 141           HA       ALA 141 -18.070   4.810   2.005
  989   1HB   ALA 141          1HB       ALA 141 -18.487   3.686   4.769
  990   2HB   ALA 141          2HB       ALA 141 -19.387   3.217   3.326
  991   3HB   ALA 141          3HB       ALA 141 -19.514   4.863   3.951
  992    H    THR 142           H        THR 142 -15.915   4.240   4.774
  993    HA   THR 142           HA       THR 142 -15.888   7.044   5.453
  994    HB   THR 142           HB       THR 142 -13.950   5.008   6.523
  995    HG1  THR 142           1HG      THR 142 -16.632   4.838   6.608
  996   1HG2  THR 142          1HG2      THR 142 -14.174   6.349   8.565
  997   2HG2  THR 142          2HG2      THR 142 -15.350   7.386   7.758
  998   3HG2  THR 142          3HG2      THR 142 -13.676   7.350   7.202
  999    H    ALA 143           H        ALA 143 -13.773   4.746   3.795
 1000    HA   ALA 143           HA       ALA 143 -11.431   6.282   3.742
 1001   1HB   ALA 143          1HB       ALA 143 -10.687   4.817   1.958
 1002   2HB   ALA 143          2HB       ALA 143 -12.339   4.256   1.703
 1003   3HB   ALA 143          3HB       ALA 143 -11.507   3.886   3.212
 1004    H    CYS 144           H        CYS 144 -13.551   5.720   0.923
 1005    HA   CYS 144           HA       CYS 144 -12.613   8.237  -0.183
 1006   1HB   CYS 144          2HB       CYS 144 -14.208   5.965  -1.349
 1007   2HB   CYS 144          1HB       CYS 144 -13.987   7.492  -2.200
 1008    H    LYS 145           H        LYS 145 -13.686   9.289   1.618
 1009    HA   LYS 145           HA       LYS 145 -16.564   9.697   1.218
 1010   1HB   LYS 145          2HB       LYS 145 -15.806   9.102   3.487
 1011   2HB   LYS 145          1HB       LYS 145 -14.740  10.497   3.496
 1012   1HG   LYS 145          2HG       LYS 145 -16.864  11.884   3.162
 1013   2HG   LYS 145          1HG       LYS 145 -17.728  10.420   3.640
 1014   1HD   LYS 145          2HD       LYS 145 -15.617  11.862   5.243
 1015   2HD   LYS 145          1HD       LYS 145 -17.351  11.844   5.571
 1016   1HE   LYS 145          2HE       LYS 145 -17.317   9.556   6.145
 1017   2HE   LYS 145          1HE       LYS 145 -15.706   9.329   5.466
 1018   1HZ   LYS 145          1HZ       LYS 145 -16.150  11.181   7.723
 1019   2HZ   LYS 145          2HZ       LYS 145 -14.712  10.412   7.248
 1020   3HZ   LYS 145          3HZ       LYS 145 -15.949   9.519   7.991
 1021    H    ASN 146           H        ASN 146 -13.994  11.795   2.423
 1022    HA   ASN 146           HA       ASN 146 -14.664  13.791   0.367
 1023   1HB   ASN 146          2HB       ASN 146 -14.320  15.554   2.051
 1024   2HB   ASN 146          1HB       ASN 146 -15.619  14.470   2.531
 1025   1HD2  ASN 146          1HD2      ASN 146 -12.469  15.667   3.271
 1026   2HD2  ASN 146          2HD2      ASN 146 -12.304  14.881   4.810
 1027    H    THR 147           H        THR 147 -12.619  11.730   0.503
 1028    HA   THR 147           HA       THR 147 -10.121  12.450   1.386
 1029    HB   THR 147           HB       THR 147 -10.190  11.123  -1.247
 1030    HG1  THR 147           1HG      THR 147 -11.140   9.374   0.576
 1031   1HG2  THR 147          1HG2      THR 147  -8.224  11.067   0.225
 1032   2HG2  THR 147          2HG2      THR 147  -8.874   9.448  -0.030
 1033   3HG2  THR 147          3HG2      THR 147  -9.189  10.296   1.483
 1034    H    ASP 148           H        ASP 148 -11.535  13.174  -1.811
 1035    HA   ASP 148           HA       ASP 148 -11.099  14.800  -3.336
 1036   1HB   ASP 148          2HB       ASP 148 -11.756  16.129  -1.264
 1037   2HB   ASP 148          1HB       ASP 148 -10.037  16.410  -1.007
 1038    H    SER 149           H        SER 149  -8.738  16.781  -2.478
 1039    HA   SER 149           HA       SER 149  -6.873  15.742  -4.305
 1040   1HB   SER 149          2HB       SER 149  -5.377  17.554  -3.352
 1041   2HB   SER 149          1HB       SER 149  -6.944  18.100  -3.946
 1042    HG   SER 149           HG       SER 149  -6.216  18.876  -1.792
 1043    H    THR 150           H        THR 150  -7.191  15.406  -0.857
 1044    HA   THR 150           HA       THR 150  -4.598  14.202  -0.523
 1045    HB   THR 150           HB       THR 150  -5.750  13.631   1.796
 1046    HG1  THR 150           1HG      THR 150  -7.824  14.468   0.842
 1047   1HG2  THR 150          1HG2      THR 150  -5.045  15.828   2.628
 1048   2HG2  THR 150          2HG2      THR 150  -4.959  16.426   0.971
 1049   3HG2  THR 150          3HG2      THR 150  -3.862  15.155   1.507
 1050    H    ASN 151           H        ASN 151  -6.185  12.921  -2.476
 1051    HA   ASN 151           HA       ASN 151  -7.308  10.513  -1.321
 1052   1HB   ASN 151          2HB       ASN 151  -8.108  11.817  -3.440
 1053   2HB   ASN 151          1HB       ASN 151  -6.831  10.928  -4.267
 1054   1HD2  ASN 151          1HD2      ASN 151  -7.027   8.709  -4.524
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.531   7.886  -4.284
 1056    H    LYS 152           H        LYS 152  -4.692  10.721  -0.590
 1057    HA   LYS 152           HA       LYS 152  -3.333   8.740  -2.281
 1058   1HB   LYS 152          2HB       LYS 152  -1.290   9.660  -0.817
 1059   2HB   LYS 152          1HB       LYS 152  -1.762  10.356  -2.357
 1060   1HG   LYS 152          2HG       LYS 152  -1.387  12.163  -0.898
 1061   2HG   LYS 152          1HG       LYS 152  -3.135  12.020  -1.054
 1062   1HD   LYS 152          2HD       LYS 152  -3.300  10.981   1.107
 1063   2HD   LYS 152          1HD       LYS 152  -1.543  10.882   1.243
 1064   1HE   LYS 152          2HE       LYS 152  -1.376  13.297   1.289
 1065   2HE   LYS 152          1HE       LYS 152  -3.111  13.449   1.028
 1066   1HZ   LYS 152          1HZ       LYS 152  -1.929  12.121   3.408
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.548  12.559   3.167
 1068   3HZ   LYS 152          3HZ       LYS 152  -2.371  13.758   3.366
 1069    H    VAL 153           H        VAL 153  -2.783   6.837  -1.451
 1070    HA   VAL 153           HA       VAL 153  -2.841   6.501   1.449
 1071    HB   VAL 153           HB       VAL 153  -5.043   5.857   1.026
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.753   4.392  -0.802
 1073   2HG1  VAL 153          2HG1      VAL 153  -4.089   4.324  -1.390
 1074   3HG1  VAL 153          3HG1      VAL 153  -4.970   5.853  -1.407
 1075   1HG2  VAL 153          1HG2      VAL 153  -3.841   4.188   2.334
 1076   2HG2  VAL 153          2HG2      VAL 153  -3.432   3.315   0.856
 1077   3HG2  VAL 153          3HG2      VAL 153  -5.116   3.443   1.368
 1078    H    THR 154           H        THR 154  -0.752   5.934   1.751
 1079    HA   THR 154           HA       THR 154   0.555   3.917   0.210
 1080    HB   THR 154           HB       THR 154   2.320   4.109   1.733
 1081    HG1  THR 154           1HG      THR 154   0.342   4.152   3.565
 1082   1HG2  THR 154          1HG2      THR 154   0.845   6.726   2.026
 1083   2HG2  THR 154          2HG2      THR 154   1.843   6.270   0.646
 1084   3HG2  THR 154          3HG2      THR 154   2.578   6.477   2.234
 1085    H    TYR 155           H        TYR 155   0.424   1.653   0.452
 1086    HA   TYR 155           HA       TYR 155  -0.294   0.744   3.129
 1087   1HB   TYR 155          2HB       TYR 155  -1.873  -0.937   2.324
 1088   2HB   TYR 155          1HB       TYR 155  -2.420   0.691   1.965
 1089    HD1  TYR 155           1HD      TYR 155  -1.389  -2.507   0.596
 1090    HD2  TYR 155           2HD      TYR 155  -2.449   1.499  -0.361
 1091    HE1  TYR 155           1HE      TYR 155  -1.767  -3.173  -1.749
 1092    HE2  TYR 155           2HE      TYR 155  -2.826   0.851  -2.703
 1093    HH   TYR 155           HH       TYR 155  -2.004  -0.997  -4.252
 1094    H    PHE 156           H        PHE 156   0.121  -1.580   3.446
 1095    HA   PHE 156           HA       PHE 156   2.453  -2.410   1.857
 1096   1HB   PHE 156          2HB       PHE 156   2.058  -2.335   4.823
 1097   2HB   PHE 156          1HB       PHE 156   3.088  -3.573   4.119
 1098    HD1  PHE 156           1HD      PHE 156   5.282  -3.082   3.422
 1099    HD2  PHE 156           2HD      PHE 156   2.613   0.055   4.484
 1100    HE1  PHE 156           1HE      PHE 156   7.145  -1.478   3.356
 1101    HE2  PHE 156           2HE      PHE 156   4.470   1.665   4.423
 1102    HZ   PHE 156           HZ       PHE 156   6.811   0.810   3.964
 1103    H    MET 157           H        MET 157   2.497  -4.453   1.170
 1104    HA   MET 157           HA       MET 157   0.732  -6.408   2.398
 1105   1HB   MET 157          2HB       MET 157  -0.195  -7.140   0.263
 1106   2HB   MET 157          1HB       MET 157  -0.607  -5.459   0.580
 1107   1HG   MET 157          2HG       MET 157   1.263  -4.801  -0.935
 1108   2HG   MET 157          1HG       MET 157   1.465  -6.507  -1.337
 1109   1HE   MET 157          1HE       MET 157  -2.107  -7.280  -2.897
 1110   2HE   MET 157          2HE       MET 157  -1.694  -7.368  -1.185
 1111   3HE   MET 157          3HE       MET 157  -0.568  -7.985  -2.395
 1112    H    LYS 158           H        LYS 158   1.615  -8.374   2.510
 1113    HA   LYS 158           HA       LYS 158   4.397  -8.548   1.808
 1114   1HB   LYS 158          2HB       LYS 158   3.407  -9.343   3.992
 1115   2HB   LYS 158          1HB       LYS 158   2.684 -10.672   3.095
 1116   1HG   LYS 158          2HG       LYS 158   4.911 -11.392   2.389
 1117   2HG   LYS 158          1HG       LYS 158   5.618 -10.079   3.329
 1118   1HD   LYS 158          2HD       LYS 158   5.758 -12.134   4.584
 1119   2HD   LYS 158          1HD       LYS 158   4.612 -11.045   5.367
 1120   1HE   LYS 158          2HE       LYS 158   2.751 -12.263   4.480
 1121   2HE   LYS 158          1HE       LYS 158   3.814 -13.248   3.473
 1122   1HZ   LYS 158          1HZ       LYS 158   3.779 -13.241   6.447
 1123   2HZ   LYS 158          2HZ       LYS 158   4.780 -14.193   5.464
 1124   3HZ   LYS 158          3HZ       LYS 158   3.104 -14.441   5.455
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1 -23.425  -3.098  -1.520
    2   2H    MET   1          2HT       MET   1 -24.523  -1.925  -2.049
    3   3H    MET   1          3HT       MET   1 -24.740  -2.674  -0.545
    4    HA   MET   1           HA       MET   1 -22.423  -0.979  -1.264
    5   1HB   MET   1          2HB       MET   1 -24.999  -0.333   0.143
    6   2HB   MET   1          1HB       MET   1 -23.536   0.584   0.472
    7   1HG   MET   1          2HG       MET   1 -24.941   1.691  -1.179
    8   2HG   MET   1          1HG       MET   1 -23.384   1.228  -1.859
    9   1HE   MET   1          1HE       MET   1 -25.982   2.069  -3.573
   10   2HE   MET   1          2HE       MET   1 -25.877   0.890  -4.881
   11   3HE   MET   1          3HE       MET   1 -24.416   1.675  -4.283
   12    H    GLU   2           H        GLU   2 -24.341  -1.963   1.605
   13    HA   GLU   2           HA       GLU   2 -22.075  -1.945   3.310
   14   1HB   GLU   2          2HB       GLU   2 -24.728  -3.342   3.710
   15   2HB   GLU   2          1HB       GLU   2 -23.527  -3.047   4.958
   16   1HG   GLU   2          2HG       GLU   2 -24.861  -1.285   5.387
   17   2HG   GLU   2          1HG       GLU   2 -23.879  -0.539   4.129
   18    H    GLN   3           H        GLN   3 -23.500  -4.362   1.265
   19    HA   GLN   3           HA       GLN   3 -21.792  -6.455   2.297
   20   1HB   GLN   3          2HB       GLN   3 -23.989  -7.056   1.406
   21   2HB   GLN   3          1HB       GLN   3 -23.562  -6.370  -0.157
   22   1HG   GLN   3          2HG       GLN   3 -21.833  -8.048  -0.445
   23   2HG   GLN   3          1HG       GLN   3 -22.198  -8.718   1.144
   24   1HE2  GLN   3          1HE2      GLN   3 -22.285  -9.953  -1.505
   25   2HE2  GLN   3          2HE2      GLN   3 -23.893 -10.564  -1.691
   26    H    SER   4           H        SER   4 -19.749  -6.697   1.741
   27    HA   SER   4           HA       SER   4 -18.512  -5.030  -0.207
   28   1HB   SER   4          2HB       SER   4 -16.500  -6.584   0.363
   29   2HB   SER   4          1HB       SER   4 -17.147  -5.550   1.638
   30    HG   SER   4           HG       SER   4 -17.770  -8.290   1.210
   31    H    ALA   5           H        ALA   5 -19.089  -5.393  -2.278
   32    HA   ALA   5           HA       ALA   5 -19.353  -8.053  -3.354
   33   1HB   ALA   5          1HB       ALA   5 -19.870  -6.939  -5.455
   34   2HB   ALA   5          2HB       ALA   5 -19.376  -5.390  -4.772
   35   3HB   ALA   5          3HB       ALA   5 -20.793  -6.225  -4.133
   36    H    SER   6           H        SER   6 -17.986  -9.083  -4.759
   37    HA   SER   6           HA       SER   6 -16.048  -9.717  -5.743
   38   1HB   SER   6          2HB       SER   6 -15.301  -6.784  -5.628
   39   2HB   SER   6          1HB       SER   6 -14.475  -8.023  -6.571
   40    HG   SER   6           HG       SER   6 -16.003  -6.805  -7.802
   41    H    ASP   7           H        ASP   7 -16.459  -9.279  -2.791
   42    HA   ASP   7           HA       ASP   7 -14.056  -8.615  -1.500
   43   1HB   ASP   7          2HB       ASP   7 -15.015  -9.644   0.460
   44   2HB   ASP   7          1HB       ASP   7 -16.298  -8.804  -0.408
   45    H    SER   8           H        SER   8 -15.111 -11.506  -3.070
   46    HA   SER   8           HA       SER   8 -12.615 -12.848  -2.275
   47   1HB   SER   8          2HB       SER   8 -15.123 -14.074  -3.464
   48   2HB   SER   8          1HB       SER   8 -13.712 -14.945  -2.862
   49    HG   SER   8           HG       SER   8 -15.222 -13.202  -1.211
   50    H    ASN   9           H        ASN   9 -14.749 -12.049  -4.957
   51    HA   ASN   9           HA       ASN   9 -13.458 -13.315  -7.050
   52   1HB   ASN   9          2HB       ASN   9 -15.695 -12.213  -7.146
   53   2HB   ASN   9          1HB       ASN   9 -14.880 -10.653  -7.193
   54   1HD2  ASN   9          1HD2      ASN   9 -13.763 -10.041  -9.063
   55   2HD2  ASN   9          2HD2      ASN   9 -13.995 -10.858 -10.571
   56    H    LYS  10           H        LYS  10 -12.958  -9.961  -5.914
   57    HA   LYS  10           HA       LYS  10 -10.844  -9.619  -7.880
   58   1HB   LYS  10          2HB       LYS  10 -12.514  -7.817  -7.376
   59   2HB   LYS  10          1HB       LYS  10 -11.790  -7.658  -5.781
   60   1HG   LYS  10          2HG       LYS  10  -9.753  -6.865  -6.678
   61   2HG   LYS  10          1HG       LYS  10 -10.210  -7.334  -8.316
   62   1HD   LYS  10          2HD       LYS  10 -12.123  -5.686  -8.105
   63   2HD   LYS  10          1HD       LYS  10 -11.330  -5.100  -6.640
   64   1HE   LYS  10          2HE       LYS  10  -9.480  -4.310  -7.811
   65   2HE   LYS  10          1HE       LYS  10  -9.828  -5.305  -9.224
   66   1HZ   LYS  10          1HZ       LYS  10 -11.718  -3.926  -9.722
   67   2HZ   LYS  10          2HZ       LYS  10 -10.337  -2.947  -9.577
   68   3HZ   LYS  10          3HZ       LYS  10 -11.476  -3.003  -8.318
   69    H    SER  11           H        SER  11 -11.222 -10.136  -4.471
   70    HA   SER  11           HA       SER  11  -8.726  -9.319  -3.543
   71   1HB   SER  11          2HB       SER  11 -10.718  -9.941  -2.144
   72   2HB   SER  11          1HB       SER  11 -10.361 -11.633  -2.482
   73    HG   SER  11           HG       SER  11  -9.132 -11.471  -0.788
   74    H    GLN  12           H        GLN  12  -9.772 -12.451  -4.850
   75    HA   GLN  12           HA       GLN  12  -7.467 -13.923  -4.296
   76   1HB   GLN  12          2HB       GLN  12  -9.489 -14.184  -6.517
   77   2HB   GLN  12          1HB       GLN  12  -8.210 -15.359  -6.239
   78   1HG   GLN  12          2HG       GLN  12  -9.088 -15.917  -4.098
   79   2HG   GLN  12          1HG       GLN  12 -10.243 -14.588  -4.166
   80   1HE2  GLN  12          1HE2      GLN  12  -9.524 -16.597  -6.922
   81   2HE2  GLN  12          2HE2      GLN  12 -11.063 -17.393  -6.986
   82    H    ASN  13           H        ASN  13  -8.195 -11.795  -7.011
   83    HA   ASN  13           HA       ASN  13  -5.984 -12.543  -8.615
   84   1HB   ASN  13          2HB       ASN  13  -7.697 -10.065  -8.551
   85   2HB   ASN  13          1HB       ASN  13  -6.351 -10.237  -9.672
   86   1HD2  ASN  13          1HD2      ASN  13  -9.558 -11.213  -8.880
   87   2HD2  ASN  13          2HD2      ASN  13  -9.863 -12.117 -10.322
   88    H    ALA  14           H        ALA  14  -6.422 -10.106  -6.115
   89    HA   ALA  14           HA       ALA  14  -3.868  -8.887  -6.532
   90   1HB   ALA  14          1HB       ALA  14  -4.331  -7.658  -4.488
   91   2HB   ALA  14          2HB       ALA  14  -5.695  -8.721  -4.141
   92   3HB   ALA  14          3HB       ALA  14  -5.740  -7.659  -5.549
   93    H    ILE  15           H        ILE  15  -5.163 -11.187  -4.153
   94    HA   ILE  15           HA       ILE  15  -2.949 -11.430  -2.495
   95    HB   ILE  15           HB       ILE  15  -4.895 -13.605  -3.298
   96   1HG1  ILE  15          2HG1      ILE  15  -4.900 -11.771  -0.891
   97   2HG1  ILE  15          1HG1      ILE  15  -5.926 -11.567  -2.307
   98   1HG2  ILE  15          1HG2      ILE  15  -4.249 -14.707  -1.214
   99   2HG2  ILE  15          2HG2      ILE  15  -3.054 -13.447  -0.914
  100   3HG2  ILE  15          3HG2      ILE  15  -2.866 -14.526  -2.294
  101   1HD1  ILE  15          1HD1      ILE  15  -5.965 -13.923  -0.434
  102   2HD1  ILE  15          2HD1      ILE  15  -7.006 -13.697  -1.840
  103   3HD1  ILE  15          3HD1      ILE  15  -7.129 -12.601  -0.464
  104    H    SER  16           H        SER  16  -3.744 -13.336  -5.386
  105    HA   SER  16           HA       SER  16  -1.464 -14.969  -5.355
  106   1HB   SER  16          2HB       SER  16  -2.996 -14.104  -7.814
  107   2HB   SER  16          1HB       SER  16  -2.092 -15.602  -7.581
  108    HG   SER  16           HG       SER  16  -4.615 -14.864  -6.649
  109    H    GLU  17           H        GLU  17  -2.066 -11.800  -6.755
  110    HA   GLU  17           HA       GLU  17   0.290 -11.676  -8.324
  111   1HB   GLU  17          2HB       GLU  17  -1.813 -10.265  -8.568
  112   2HB   GLU  17          1HB       GLU  17  -1.225  -9.320  -7.208
  113   1HG   GLU  17          2HG       GLU  17  -0.649  -8.203  -9.243
  114   2HG   GLU  17          1HG       GLU  17   0.825  -8.817  -8.492
  115    H    VAL  18           H        VAL  18  -0.544 -10.455  -5.093
  116    HA   VAL  18           HA       VAL  18   1.927  -9.156  -4.633
  117    HB   VAL  18           HB       VAL  18  -0.071 -10.211  -2.623
  118   1HG1  VAL  18          1HG1      VAL  18   0.982  -8.667  -1.045
  119   2HG1  VAL  18          2HG1      VAL  18   2.184  -8.240  -2.263
  120   3HG1  VAL  18          3HG1      VAL  18   2.127  -9.880  -1.618
  121   1HG2  VAL  18          1HG2      VAL  18  -0.840  -7.884  -2.514
  122   2HG2  VAL  18          2HG2      VAL  18  -1.034  -8.561  -4.132
  123   3HG2  VAL  18          3HG2      VAL  18   0.296  -7.453  -3.791
  124    H    MET  19           H        MET  19   0.728 -12.381  -3.736
  125    HA   MET  19           HA       MET  19   2.963 -13.207  -2.273
  126   1HB   MET  19          2HB       MET  19   0.957 -14.767  -3.890
  127   2HB   MET  19          1HB       MET  19   2.227 -15.545  -2.957
  128   1HG   MET  19          2HG       MET  19   0.089 -13.735  -1.859
  129   2HG   MET  19          1HG       MET  19   0.122 -15.493  -1.740
  130   1HE   MET  19          1HE       MET  19   3.221 -16.030  -1.223
  131   2HE   MET  19          2HE       MET  19   1.943 -16.844  -0.322
  132   3HE   MET  19          3HE       MET  19   3.271 -16.069   0.539
  133    H    SER  20           H        SER  20   2.382 -13.148  -5.730
  134    HA   SER  20           HA       SER  20   4.786 -14.569  -6.380
  135   1HB   SER  20          2HB       SER  20   2.744 -14.440  -7.867
  136   2HB   SER  20          1HB       SER  20   3.173 -12.762  -8.195
  137    HG   SER  20           HG       SER  20   4.965 -13.407  -9.265
  138    H    ALA  21           H        ALA  21   3.836 -11.223  -5.952
  139    HA   ALA  21           HA       ALA  21   6.108 -10.038  -7.167
  140   1HB   ALA  21          1HB       ALA  21   5.374  -7.975  -6.108
  141   2HB   ALA  21          2HB       ALA  21   4.267  -8.881  -5.078
  142   3HB   ALA  21          3HB       ALA  21   4.004  -8.828  -6.821
  143    H    THR  22           H        THR  22   5.281 -10.640  -3.750
  144    HA   THR  22           HA       THR  22   7.644  -9.593  -2.673
  145    HB   THR  22           HB       THR  22   5.611 -10.066  -1.338
  146    HG1  THR  22           1HG      THR  22   6.778 -10.308   0.431
  147   1HG2  THR  22          1HG2      THR  22   5.183 -12.321  -0.505
  148   2HG2  THR  22          2HG2      THR  22   6.475 -12.951  -1.526
  149   3HG2  THR  22          3HG2      THR  22   5.032 -12.255  -2.261
  150    H    SER  23           H        SER  23   6.867 -12.821  -3.853
  151    HA   SER  23           HA       SER  23   9.324 -14.011  -3.049
  152   1HB   SER  23          2HB       SER  23   7.416 -14.897  -5.230
  153   2HB   SER  23          1HB       SER  23   8.647 -15.890  -4.448
  154    HG   SER  23           HG       SER  23   6.168 -15.020  -3.491
  155    H    ALA  24           H        ALA  24   8.242 -12.242  -5.856
  156    HA   ALA  24           HA       ALA  24  10.461 -12.975  -7.513
  157   1HB   ALA  24          1HB       ALA  24   9.602 -11.296  -9.065
  158   2HB   ALA  24          2HB       ALA  24   8.470 -10.733  -7.835
  159   3HB   ALA  24          3HB       ALA  24   8.316 -12.360  -8.495
  160    H    ILE  25           H        ILE  25   9.648 -10.164  -5.485
  161    HA   ILE  25           HA       ILE  25  11.951  -8.707  -6.359
  162    HB   ILE  25           HB       ILE  25  10.037  -7.454  -5.583
  163   1HG1  ILE  25          2HG1      ILE  25  12.405  -7.146  -3.724
  164   2HG1  ILE  25          1HG1      ILE  25  12.280  -6.474  -5.345
  165   1HG2  ILE  25          1HG2      ILE  25   9.176  -9.018  -3.927
  166   2HG2  ILE  25          2HG2      ILE  25   9.366  -7.407  -3.239
  167   3HG2  ILE  25          3HG2      ILE  25  10.543  -8.666  -2.872
  168   1HD1  ILE  25          1HD1      ILE  25  11.858  -4.792  -3.637
  169   2HD1  ILE  25          2HD1      ILE  25  10.517  -5.755  -3.014
  170   3HD1  ILE  25          3HD1      ILE  25  10.430  -5.064  -4.634
  171    H    ASN  26           H        ASN  26  11.195 -10.583  -3.421
  172    HA   ASN  26           HA       ASN  26  13.731 -10.104  -2.220
  173   1HB   ASN  26          2HB       ASN  26  11.696 -10.878  -0.974
  174   2HB   ASN  26          1HB       ASN  26  11.883 -12.456  -1.733
  175   1HD2  ASN  26          1HD2      ASN  26  12.149 -13.458   0.260
  176   2HD2  ASN  26          2HD2      ASN  26  13.604 -13.313   1.177
  177    H    GLY  27           H        GLY  27  12.641 -12.137  -4.739
  178   1HA   GLY  27          2HA       GLY  27  14.855 -13.982  -4.605
  179   2HA   GLY  27          1HA       GLY  27  13.657 -13.875  -5.886
  180    H    LEU  28           H        LEU  28  14.356 -10.848  -5.870
  181    HA   LEU  28           HA       LEU  28  16.553 -11.106  -7.762
  182   1HB   LEU  28          2HB       LEU  28  15.668  -9.324  -8.795
  183   2HB   LEU  28          1HB       LEU  28  14.278  -9.599  -7.774
  184    HG   LEU  28           HG       LEU  28  15.484  -7.973  -6.142
  185   1HD1  LEU  28          1HD1      LEU  28  16.728  -7.214  -8.786
  186   2HD1  LEU  28          2HD1      LEU  28  17.582  -7.815  -7.364
  187   3HD1  LEU  28          3HD1      LEU  28  16.776  -6.247  -7.312
  188   1HD2  LEU  28          1HD2      LEU  28  14.184  -7.027  -8.692
  189   2HD2  LEU  28          2HD2      LEU  28  14.316  -6.109  -7.192
  190   3HD2  LEU  28          3HD2      LEU  28  13.341  -7.577  -7.245
  191    H    TYR  29           H        TYR  29  15.844  -9.825  -4.596
  192    HA   TYR  29           HA       TYR  29  18.466  -8.616  -4.293
  193   1HB   TYR  29          2HB       TYR  29  16.138  -8.962  -2.401
  194   2HB   TYR  29          1HB       TYR  29  17.680  -8.286  -1.896
  195    HD1  TYR  29           1HD      TYR  29  15.200  -7.799  -4.660
  196    HD2  TYR  29           2HD      TYR  29  17.810  -5.991  -1.821
  197    HE1  TYR  29           1HE      TYR  29  14.465  -5.572  -5.415
  198    HE2  TYR  29           2HE      TYR  29  17.082  -3.770  -2.559
  199    HH   TYR  29           HH       TYR  29  14.365  -3.228  -4.434
  200    H    ILE  30           H        ILE  30  16.697 -11.037  -2.390
  201    HA   ILE  30           HA       ILE  30  17.268 -13.023  -1.490
  202    HB   ILE  30           HB       ILE  30  19.755 -12.863  -3.192
  203   1HG1  ILE  30          2HG1      ILE  30  17.106 -14.252  -3.682
  204   2HG1  ILE  30          1HG1      ILE  30  17.657 -12.789  -4.496
  205   1HG2  ILE  30          1HG2      ILE  30  19.886 -15.283  -2.858
  206   2HG2  ILE  30          2HG2      ILE  30  18.484 -15.218  -1.792
  207   3HG2  ILE  30          3HG2      ILE  30  19.986 -14.421  -1.323
  208   1HD1  ILE  30          1HD1      ILE  30  19.512 -14.038  -5.475
  209   2HD1  ILE  30          2HD1      ILE  30  17.954 -14.751  -5.895
  210   3HD1  ILE  30          3HD1      ILE  30  18.963 -15.501  -4.656
  211    H    GLY  31           H        GLY  31  17.590 -12.785   0.608
  212   1HA   GLY  31          2HA       GLY  31  18.900 -12.998   2.517
  213   2HA   GLY  31          1HA       GLY  31  20.324 -12.677   1.539
  214    H    GLN  32           H        GLN  32  17.379 -10.760   2.099
  215    HA   GLN  32           HA       GLN  32  19.112  -8.626   3.153
  216   1HB   GLN  32          2HB       GLN  32  16.516  -8.409   1.617
  217   2HB   GLN  32          1HB       GLN  32  17.288  -7.053   2.425
  218   1HG   GLN  32          2HG       GLN  32  18.524  -8.685   0.228
  219   2HG   GLN  32          1HG       GLN  32  17.734  -7.126   0.019
  220   1HE2  GLN  32          1HE2      GLN  32  18.769  -5.268   0.720
  221   2HE2  GLN  32          2HE2      GLN  32  20.446  -5.240   1.137
  222    H    THR  33           H        THR  33  18.518  -7.600   5.013
  223    HA   THR  33           HA       THR  33  16.974  -8.966   6.912
  224    HB   THR  33           HB       THR  33  17.708  -6.034   6.869
  225    HG1  THR  33           1HG      THR  33  19.433  -7.140   8.353
  226   1HG2  THR  33          1HG2      THR  33  17.088  -7.899   9.166
  227   2HG2  THR  33          2HG2      THR  33  16.066  -6.578   8.598
  228   3HG2  THR  33          3HG2      THR  33  17.634  -6.230   9.324
  229    H    SER  34           H        SER  34  16.269  -6.017   5.080
  230    HA   SER  34           HA       SER  34  13.518  -6.748   4.728
  231   1HB   SER  34          2HB       SER  34  13.572  -5.723   7.049
  232   2HB   SER  34          1HB       SER  34  14.096  -4.219   6.293
  233    HG   SER  34           HG       SER  34  12.139  -4.337   5.025
  234    H    TYR  35           H        TYR  35  15.626  -6.348   2.976
  235    HA   TYR  35           HA       TYR  35  16.392  -5.180   1.163
  236   1HB   TYR  35          2HB       TYR  35  13.854  -3.545   1.409
  237   2HB   TYR  35          1HB       TYR  35  14.847  -3.750  -0.031
  238    HD1  TYR  35           1HD      TYR  35  14.702  -5.758  -1.372
  239    HD2  TYR  35           2HD      TYR  35  12.366  -5.343   2.165
  240    HE1  TYR  35           1HE      TYR  35  13.325  -7.672  -2.064
  241    HE2  TYR  35           2HE      TYR  35  10.980  -7.255   1.477
  242    HH   TYR  35           HH       TYR  35  11.855  -9.333  -1.093
  243    H    SER  36           H        SER  36  16.718  -4.393   3.974
  244    HA   SER  36           HA       SER  36  16.930  -1.648   4.314
  245   1HB   SER  36          2HB       SER  36  18.810  -2.568   5.983
  246   2HB   SER  36          1HB       SER  36  17.086  -2.771   6.304
  247    HG   SER  36           HG       SER  36  18.985  -4.648   5.791
  248    H    GLY  37           H        GLY  37  18.571  -0.221   4.042
  249   1HA   GLY  37          2HA       GLY  37  20.895   0.189   3.270
  250   2HA   GLY  37          1HA       GLY  37  20.617  -1.088   2.084
  251    H    LEU  38           H        LEU  38  18.085  -0.566   1.247
  252    HA   LEU  38           HA       LEU  38  18.373   1.816  -0.332
  253   1HB   LEU  38          2HB       LEU  38  15.919   0.114   0.103
  254   2HB   LEU  38          1HB       LEU  38  16.144   1.298  -1.169
  255    HG   LEU  38           HG       LEU  38  17.667  -1.288  -0.869
  256   1HD1  LEU  38          1HD1      LEU  38  15.344  -1.573  -1.568
  257   2HD1  LEU  38          2HD1      LEU  38  16.465  -1.951  -2.875
  258   3HD1  LEU  38          3HD1      LEU  38  15.596  -0.418  -2.875
  259   1HD2  LEU  38          1HD2      LEU  38  17.793   0.800  -3.045
  260   2HD2  LEU  38          2HD2      LEU  38  18.646  -0.743  -3.032
  261   3HD2  LEU  38          3HD2      LEU  38  19.046   0.495  -1.842
  262    H    ASP  39           H        ASP  39  16.854   0.923   2.657
  263    HA   ASP  39           HA       ASP  39  14.850   2.899   2.773
  264   1HB   ASP  39          2HB       ASP  39  14.640   2.313   5.134
  265   2HB   ASP  39          1HB       ASP  39  14.790   0.861   4.155
  266    H    SER  40           H        SER  40  17.988   2.760   4.439
  267    HA   SER  40           HA       SER  40  17.783   5.297   5.635
  268   1HB   SER  40          2HB       SER  40  20.332   3.834   4.918
  269   2HB   SER  40          1HB       SER  40  20.100   5.006   6.217
  270    HG   SER  40           HG       SER  40  18.302   3.039   6.495
  271    H    THR  41           H        THR  41  18.491   4.364   2.435
  272    HA   THR  41           HA       THR  41  19.942   6.764   1.757
  273    HB   THR  41           HB       THR  41  18.832   4.653  -0.101
  274    HG1  THR  41           1HG      THR  41  20.325   3.444   0.823
  275   1HG2  THR  41          1HG2      THR  41  20.562   5.467  -1.645
  276   2HG2  THR  41          2HG2      THR  41  21.028   6.697  -0.471
  277   3HG2  THR  41          3HG2      THR  41  19.431   6.749  -1.215
  278    H    ILE  42           H        ILE  42  16.775   5.333   0.912
  279    HA   ILE  42           HA       ILE  42  15.969   7.296  -0.878
  280    HB   ILE  42           HB       ILE  42  14.273   5.480   0.822
  281   1HG1  ILE  42          2HG1      ILE  42  15.763   4.292  -0.693
  282   2HG1  ILE  42          1HG1      ILE  42  14.099   4.150  -1.253
  283   1HG2  ILE  42          1HG2      ILE  42  12.936   7.382   0.078
  284   2HG2  ILE  42          2HG2      ILE  42  12.453   5.904  -0.756
  285   3HG2  ILE  42          3HG2      ILE  42  13.447   7.100  -1.587
  286   1HD1  ILE  42          1HD1      ILE  42  14.522   5.880  -2.924
  287   2HD1  ILE  42          2HD1      ILE  42  15.626   4.517  -3.102
  288   3HD1  ILE  42          3HD1      ILE  42  16.187   6.016  -2.361
  289    H    LEU  43           H        LEU  43  15.721   7.302   2.587
  290    HA   LEU  43           HA       LEU  43  13.669   9.203   2.837
  291   1HB   LEU  43          2HB       LEU  43  15.892   8.545   4.761
  292   2HB   LEU  43          1HB       LEU  43  14.350   9.274   5.148
  293    HG   LEU  43           HG       LEU  43  14.558   6.550   3.914
  294   1HD1  LEU  43          1HD1      LEU  43  14.272   5.641   6.190
  295   2HD1  LEU  43          2HD1      LEU  43  14.435   7.267   6.856
  296   3HD1  LEU  43          3HD1      LEU  43  15.796   6.513   6.024
  297   1HD2  LEU  43          1HD2      LEU  43  12.313   6.282   4.891
  298   2HD2  LEU  43          2HD2      LEU  43  12.388   7.612   3.734
  299   3HD2  LEU  43          3HD2      LEU  43  12.377   7.950   5.465
  300    H    LEU  44           H        LEU  44  17.156   9.606   3.516
  301    HA   LEU  44           HA       LEU  44  16.961  12.444   3.472
  302   1HB   LEU  44          2HB       LEU  44  19.438  12.389   3.552
  303   2HB   LEU  44          1HB       LEU  44  18.663  11.468   4.823
  304    HG   LEU  44           HG       LEU  44  19.071   9.432   3.224
  305   1HD1  LEU  44          1HD1      LEU  44  21.097   9.635   1.893
  306   2HD1  LEU  44          2HD1      LEU  44  21.193  11.352   2.281
  307   3HD1  LEU  44          3HD1      LEU  44  19.849  10.741   1.318
  308   1HD2  LEU  44          1HD2      LEU  44  20.052   9.684   5.426
  309   2HD2  LEU  44          2HD2      LEU  44  21.285  10.763   4.773
  310   3HD2  LEU  44          3HD2      LEU  44  21.247   9.068   4.283
  311    H    ASN  45           H        ASN  45  17.427  10.024   1.096
  312    HA   ASN  45           HA       ASN  45  18.638  11.439  -0.978
  313   1HB   ASN  45          2HB       ASN  45  18.118   9.012  -1.060
  314   2HB   ASN  45          1HB       ASN  45  16.405   9.417  -1.171
  315   1HD2  ASN  45          1HD2      ASN  45  15.573  10.179  -3.094
  316   2HD2  ASN  45          2HD2      ASN  45  16.463  10.146  -4.581
  317    H    THR  46           H        THR  46  15.186  11.003  -0.262
  318    HA   THR  46           HA       THR  46  14.555  13.131  -2.161
  319    HB   THR  46           HB       THR  46  12.634  11.551  -0.445
  320    HG1  THR  46           1HG      THR  46  13.323   9.913  -1.620
  321   1HG2  THR  46          1HG2      THR  46  12.264  12.973  -3.086
  322   2HG2  THR  46          2HG2      THR  46  11.739  13.576  -1.516
  323   3HG2  THR  46          3HG2      THR  46  11.016  12.112  -2.181
  324    H    SER  47           H        SER  47  15.284  14.970  -1.160
  325    HA   SER  47           HA       SER  47  15.235  16.810   0.152
  326   1HB   SER  47          2HB       SER  47  12.767  16.540  -0.246
  327   2HB   SER  47          1HB       SER  47  12.670  15.710   1.306
  328    HG   SER  47           HG       SER  47  13.248  18.410   0.745
  329    H    ALA  48           H        ALA  48  14.107  14.051   2.074
  330    HA   ALA  48           HA       ALA  48  15.787  13.789   4.135
  331   1HB   ALA  48          1HB       ALA  48  15.023  15.332   5.914
  332   2HB   ALA  48          2HB       ALA  48  14.006  16.169   4.740
  333   3HB   ALA  48          3HB       ALA  48  15.761  16.209   4.573
  334    H    ILE  49           H        ILE  49  12.513  14.613   3.305
  335    HA   ILE  49           HA       ILE  49  11.527  12.145   4.582
  336    HB   ILE  49           HB       ILE  49   9.990  14.748   4.307
  337   1HG1  ILE  49          2HG1      ILE  49  11.698  14.879   6.084
  338   2HG1  ILE  49          1HG1      ILE  49  10.067  14.896   6.747
  339   1HG2  ILE  49          1HG2      ILE  49   8.256  13.614   5.629
  340   2HG2  ILE  49          2HG2      ILE  49   9.204  12.126   5.571
  341   3HG2  ILE  49          3HG2      ILE  49   8.553  12.816   4.083
  342   1HD1  ILE  49          1HD1      ILE  49  11.575  13.516   8.072
  343   2HD1  ILE  49          2HD1      ILE  49  11.901  12.508   6.660
  344   3HD1  ILE  49          3HD1      ILE  49  10.282  12.554   7.358
  345    HA   PRO  50           HA       PRO  50  10.656  11.493   0.248
  346   1HB   PRO  50          2HB       PRO  50   9.248   9.058   1.061
  347   2HB   PRO  50          1HB       PRO  50  10.722   9.239   0.106
  348   1HG   PRO  50          2HG       PRO  50  10.730   8.258   2.631
  349   2HG   PRO  50          1HG       PRO  50  12.092   9.162   1.942
  350   1HD   PRO  50          2HD       PRO  50   9.960  10.084   3.831
  351   2HD   PRO  50          1HD       PRO  50  11.696  10.468   3.813
  352    H    ASP  51           H        ASP  51   9.207  12.876  -0.431
  353    HA   ASP  51           HA       ASP  51   6.558  13.148   0.633
  354   1HB   ASP  51          2HB       ASP  51   8.079  14.967  -0.328
  355   2HB   ASP  51          1HB       ASP  51   7.662  14.340  -1.916
  356    H    ASN  52           H        ASN  52   7.936  11.036  -1.507
  357    HA   ASN  52           HA       ASN  52   6.157  11.074  -3.700
  358   1HB   ASN  52          2HB       ASN  52   8.232   9.118  -2.754
  359   2HB   ASN  52          1HB       ASN  52   7.261   8.822  -4.193
  360   1HD2  ASN  52          1HD2      ASN  52   9.211   8.816  -5.369
  361   2HD2  ASN  52          2HD2      ASN  52   9.967  10.304  -5.834
  362    H    TYR  53           H        TYR  53   5.365  10.069  -0.651
  363    HA   TYR  53           HA       TYR  53   4.047   7.604  -1.532
  364   1HB   TYR  53          2HB       TYR  53   4.089   8.701   1.280
  365   2HB   TYR  53          1HB       TYR  53   3.688   7.071   0.764
  366    HD1  TYR  53           1HD      TYR  53   5.951   6.875  -1.310
  367    HD2  TYR  53           2HD      TYR  53   5.891   8.041   2.781
  368    HE1  TYR  53           1HE      TYR  53   8.295   6.197  -1.098
  369    HE2  TYR  53           2HE      TYR  53   8.243   7.357   3.007
  370    HH   TYR  53           HH       TYR  53   9.785   5.580   1.663
  371    H    LYS  54           H        LYS  54   3.263  10.516  -2.056
  372    HA   LYS  54           HA       LYS  54   0.418   9.916  -1.747
  373   1HB   LYS  54          2HB       LYS  54  -0.016  12.352  -1.321
  374   2HB   LYS  54          1HB       LYS  54   0.790  11.526  -0.001
  375   1HG   LYS  54          2HG       LYS  54   2.943  12.453  -0.799
  376   2HG   LYS  54          1HG       LYS  54   2.056  13.352  -2.031
  377   1HD   LYS  54          2HD       LYS  54   0.777  14.481  -0.252
  378   2HD   LYS  54          1HD       LYS  54   1.731  13.617   0.957
  379   1HE   LYS  54          2HE       LYS  54   3.771  14.646   0.044
  380   2HE   LYS  54          1HE       LYS  54   2.785  15.549  -1.104
  381   1HZ   LYS  54          1HZ       LYS  54   1.650  16.564   0.835
  382   2HZ   LYS  54          2HZ       LYS  54   3.297  16.947   0.730
  383   3HZ   LYS  54          3HZ       LYS  54   2.768  15.795   1.853
  384    H    ASP  55           H        ASP  55  -0.894  10.894  -3.364
  385    HA   ASP  55           HA       ASP  55   0.525  12.229  -5.566
  386   1HB   ASP  55          2HB       ASP  55  -0.240  10.096  -6.406
  387   2HB   ASP  55          1HB       ASP  55  -1.834  10.334  -5.693
  388    H    THR  56           H        THR  56  -0.727  13.901  -6.641
  389    HA   THR  56           HA       THR  56  -2.581  15.160  -4.743
  390    HB   THR  56           HB       THR  56  -1.959  17.272  -6.094
  391    HG1  THR  56           1HG      THR  56  -0.677  16.787  -7.717
  392   1HG2  THR  56          1HG2      THR  56  -1.287  16.878  -3.778
  393   2HG2  THR  56          2HG2      THR  56   0.018  17.640  -4.688
  394   3HG2  THR  56          3HG2      THR  56   0.082  15.915  -4.331
  395    H    THR  57           H        THR  57  -2.744  13.387  -7.452
  396    HA   THR  57           HA       THR  57  -4.827  15.015  -8.714
  397    HB   THR  57           HB       THR  57  -3.673  12.360  -9.598
  398    HG1  THR  57           1HG      THR  57  -2.212  14.235  -9.655
  399   1HG2  THR  57          1HG2      THR  57  -5.909  12.691 -10.472
  400   2HG2  THR  57          2HG2      THR  57  -4.730  12.914 -11.766
  401   3HG2  THR  57          3HG2      THR  57  -5.487  14.316 -11.010
  402    H    ASN  58           H        ASN  58  -4.354  11.668  -7.612
  403    HA   ASN  58           HA       ASN  58  -6.319  11.279  -5.840
  404   1HB   ASN  58          2HB       ASN  58  -8.303  10.415  -6.996
  405   2HB   ASN  58          1HB       ASN  58  -8.030  12.104  -7.387
  406   1HD2  ASN  58          1HD2      ASN  58  -9.152  12.103  -9.271
  407   2HD2  ASN  58          2HD2      ASN  58  -8.659  11.228 -10.680
  408    H    LYS  59           H        LYS  59  -3.882  10.154  -7.488
  409    HA   LYS  59           HA       LYS  59  -4.617   7.364  -7.141
  410   1HB   LYS  59          2HB       LYS  59  -3.400   7.082  -9.518
  411   2HB   LYS  59          1HB       LYS  59  -5.139   7.224  -9.325
  412   1HG   LYS  59          2HG       LYS  59  -4.700   8.700 -11.039
  413   2HG   LYS  59          1HG       LYS  59  -4.736   9.758  -9.631
  414   1HD   LYS  59          2HD       LYS  59  -2.871  10.390 -10.970
  415   2HD   LYS  59          1HD       LYS  59  -2.241   9.574  -9.540
  416   1HE   LYS  59          2HE       LYS  59  -1.092   8.866 -11.590
  417   2HE   LYS  59          1HE       LYS  59  -1.934   7.530 -10.806
  418   1HZ   LYS  59          1HZ       LYS  59  -3.075   9.080 -13.067
  419   2HZ   LYS  59          2HZ       LYS  59  -3.664   7.630 -12.409
  420   3HZ   LYS  59          3HZ       LYS  59  -2.200   7.638 -13.263
  421    H    LYS  60           H        LYS  60  -3.120   7.469  -5.407
  422    HA   LYS  60           HA       LYS  60  -0.515   6.580  -6.415
  423   1HB   LYS  60          2HB       LYS  60  -0.161   8.850  -5.491
  424   2HB   LYS  60          1HB       LYS  60  -0.855   8.328  -3.964
  425   1HG   LYS  60          2HG       LYS  60   1.546   8.369  -3.784
  426   2HG   LYS  60          1HG       LYS  60   0.987   6.696  -3.717
  427   1HD   LYS  60          2HD       LYS  60   2.879   6.715  -5.130
  428   2HD   LYS  60          1HD       LYS  60   1.467   6.554  -6.172
  429   1HE   LYS  60          2HE       LYS  60   2.898   8.114  -7.221
  430   2HE   LYS  60          1HE       LYS  60   1.565   9.033  -6.531
  431   1HZ   LYS  60          1HZ       LYS  60   3.870   9.960  -6.230
  432   2HZ   LYS  60          2HZ       LYS  60   4.152   8.702  -5.128
  433   3HZ   LYS  60          3HZ       LYS  60   2.930   9.839  -4.825
  434    H    ILE  61           H        ILE  61  -0.196   4.538  -5.769
  435    HA   ILE  61           HA       ILE  61  -1.154   3.758  -3.110
  436    HB   ILE  61           HB       ILE  61  -1.921   1.556  -3.991
  437   1HG1  ILE  61          2HG1      ILE  61  -1.685   2.936  -6.677
  438   2HG1  ILE  61          1HG1      ILE  61  -0.784   1.518  -6.147
  439   1HG2  ILE  61          1HG2      ILE  61  -4.087   2.358  -4.773
  440   2HG2  ILE  61          2HG2      ILE  61  -3.400   3.962  -5.035
  441   3HG2  ILE  61          3HG2      ILE  61  -3.502   3.299  -3.402
  442   1HD1  ILE  61          1HD1      ILE  61  -2.571   0.895  -7.652
  443   2HD1  ILE  61          2HD1      ILE  61  -3.756   1.657  -6.594
  444   3HD1  ILE  61          3HD1      ILE  61  -2.864   0.242  -6.041
  445    H    THR  62           H        THR  62   0.210   2.480  -2.011
  446    HA   THR  62           HA       THR  62   2.675   1.614  -3.289
  447    HB   THR  62           HB       THR  62   1.723   1.680  -0.446
  448    HG1  THR  62           1HG      THR  62   3.604   2.857  -0.164
  449   1HG2  THR  62          1HG2      THR  62   4.165   0.188  -1.374
  450   2HG2  THR  62          2HG2      THR  62   2.669  -0.566  -0.826
  451   3HG2  THR  62          3HG2      THR  62   3.621   0.410   0.292
  452    H    ASN  63           H        ASN  63   2.801  -0.252  -4.261
  453    HA   ASN  63           HA       ASN  63   2.584  -2.753  -3.401
  454   1HB   ASN  63          2HB       ASN  63   0.230  -2.381  -2.742
  455   2HB   ASN  63          1HB       ASN  63  -0.174  -2.042  -4.420
  456   1HD2  ASN  63          1HD2      ASN  63  -1.705  -3.715  -4.219
  457   2HD2  ASN  63          2HD2      ASN  63  -1.217  -5.369  -4.383
  458    HA   PRO  64           HA       PRO  64   1.581  -3.018  -8.070
  459   1HB   PRO  64          2HB       PRO  64   1.453  -0.335  -9.180
  460   2HB   PRO  64          1HB       PRO  64   0.219  -1.597  -9.184
  461   1HG   PRO  64          2HG       PRO  64  -0.022   0.688  -7.742
  462   2HG   PRO  64          1HG       PRO  64  -0.735  -0.851  -7.229
  463   1HD   PRO  64          2HD       PRO  64   1.820   0.439  -6.350
  464   2HD   PRO  64          1HD       PRO  64   0.562  -0.334  -5.346
  465    H    PHE  65           H        PHE  65   2.895  -3.014  -9.952
  466    HA   PHE  65           HA       PHE  65   5.417  -1.528  -9.726
  467   1HB   PHE  65          2HB       PHE  65   6.627  -3.638 -10.395
  468   2HB   PHE  65          1HB       PHE  65   5.955  -3.656  -8.770
  469    HD1  PHE  65           1HD      PHE  65   4.059  -5.077  -8.221
  470    HD2  PHE  65           2HD      PHE  65   5.752  -5.061 -12.125
  471    HE1  PHE  65           1HE      PHE  65   2.884  -7.173  -8.738
  472    HE2  PHE  65           2HE      PHE  65   4.582  -7.158 -12.648
  473    HZ   PHE  65           HZ       PHE  65   3.110  -8.202 -10.941
  474    H    GLY  66           H        GLY  66   2.817  -1.906 -11.499
  475   1HA   GLY  66          2HA       GLY  66   4.243  -2.070 -14.082
  476   2HA   GLY  66          1HA       GLY  66   2.544  -2.463 -13.852
  477    H    GLY  67           H        GLY  67   4.359   0.292 -12.649
  478   1HA   GLY  67          2HA       GLY  67   3.143   2.141 -14.501
  479   2HA   GLY  67          1HA       GLY  67   2.523   2.243 -12.854
  480    H    GLU  68           H        GLU  68   3.385   4.200 -12.310
  481    HA   GLU  68           HA       GLU  68   6.290   4.507 -12.434
  482   1HB   GLU  68          2HB       GLU  68   3.989   6.308 -11.748
  483   2HB   GLU  68          1HB       GLU  68   5.660   6.797 -11.474
  484   1HG   GLU  68          2HG       GLU  68   6.147   6.650 -13.816
  485   2HG   GLU  68          1HG       GLU  68   4.560   5.957 -14.146
  486    H    LEU  69           H        LEU  69   7.125   3.251 -10.845
  487    HA   LEU  69           HA       LEU  69   5.904   3.354  -8.193
  488   1HB   LEU  69          2HB       LEU  69   7.213   1.324  -7.710
  489   2HB   LEU  69          1HB       LEU  69   6.114   1.134  -9.056
  490    HG   LEU  69           HG       LEU  69   8.289   1.716 -10.460
  491   1HD1  LEU  69          1HD1      LEU  69  10.271   0.670  -9.447
  492   2HD1  LEU  69          2HD1      LEU  69   9.394   0.535  -7.921
  493   3HD1  LEU  69          3HD1      LEU  69   9.754   2.125  -8.595
  494   1HD2  LEU  69          1HD2      LEU  69   7.739  -0.982  -9.239
  495   2HD2  LEU  69          2HD2      LEU  69   8.679  -0.679 -10.700
  496   3HD2  LEU  69          3HD2      LEU  69   6.956  -0.307 -10.668
  497    H    ASN  70           H        ASN  70   6.943   3.939  -6.394
  498    HA   ASN  70           HA       ASN  70   9.672   5.005  -6.631
  499   1HB   ASN  70          2HB       ASN  70   8.037   6.593  -5.733
  500   2HB   ASN  70          1HB       ASN  70   7.552   5.430  -4.504
  501   1HD2  ASN  70          1HD2      ASN  70   8.715   5.286  -2.640
  502   2HD2  ASN  70          2HD2      ASN  70  10.110   6.245  -2.293
  503    H    VAL  71           H        VAL  71  11.296   3.866  -5.772
  504    HA   VAL  71           HA       VAL  71  10.695   1.349  -4.513
  505    HB   VAL  71           HB       VAL  71  13.174   1.026  -4.478
  506   1HG1  VAL  71          1HG1      VAL  71  12.021   1.838  -7.143
  507   2HG1  VAL  71          2HG1      VAL  71  11.793   0.275  -6.358
  508   3HG1  VAL  71          3HG1      VAL  71  13.402   0.771  -6.886
  509   1HG2  VAL  71          1HG2      VAL  71  13.897   3.332  -4.289
  510   2HG2  VAL  71          2HG2      VAL  71  13.182   3.711  -5.855
  511   3HG2  VAL  71          3HG2      VAL  71  14.562   2.617  -5.757
  512    H    GLY  72           H        GLY  72  10.766   0.847  -2.421
  513   1HA   GLY  72          2HA       GLY  72  12.427   2.238  -0.557
  514   2HA   GLY  72          1HA       GLY  72  10.735   2.676  -0.385
  515    HA   PRO  73           HA       PRO  73  11.250  -1.515   1.608
  516   1HB   PRO  73          2HB       PRO  73  13.532  -1.842   2.922
  517   2HB   PRO  73          1HB       PRO  73  13.462  -2.072   1.169
  518   1HG   PRO  73          2HG       PRO  73  14.617   0.161   2.735
  519   2HG   PRO  73          1HG       PRO  73  15.090  -0.470   1.151
  520   1HD   PRO  73          2HD       PRO  73  13.432   1.793   1.712
  521   2HD   PRO  73          1HD       PRO  73  13.854   1.119   0.123
  522    H    ALA  74           H        ALA  74  11.228  -2.156   3.934
  523    HA   ALA  74           HA       ALA  74  10.533   0.139   5.603
  524   1HB   ALA  74          1HB       ALA  74  10.071  -2.806   6.053
  525   2HB   ALA  74          2HB       ALA  74   8.893  -1.653   5.422
  526   3HB   ALA  74          3HB       ALA  74   9.480  -1.497   7.077
  527    H    ASN  75           H        ASN  75  10.982  -0.626   8.111
  528    HA   ASN  75           HA       ASN  75  13.851  -0.474   8.273
  529   1HB   ASN  75          2HB       ASN  75  12.442   0.912   9.735
  530   2HB   ASN  75          1HB       ASN  75  11.796  -0.538  10.491
  531   1HD2  ASN  75          1HD2      ASN  75  12.982  -1.592  12.012
  532   2HD2  ASN  75          2HD2      ASN  75  14.483  -1.001  12.643
  533    H    ASN  76           H        ASN  76  11.367  -2.858   9.259
  534    HA   ASN  76           HA       ASN  76  13.432  -4.903   9.059
  535   1HB   ASN  76          2HB       ASN  76  13.227  -4.038  11.501
  536   2HB   ASN  76          1HB       ASN  76  11.709  -4.936  11.521
  537   1HD2  ASN  76          1HD2      ASN  76  15.107  -5.098  11.685
  538   2HD2  ASN  76          2HD2      ASN  76  15.253  -6.824  11.832
  539    H    ASN  77           H        ASN  77  12.626  -6.994   8.709
  540    HA   ASN  77           HA       ASN  77  10.127  -7.033   7.320
  541   1HB   ASN  77          2HB       ASN  77  12.167  -8.316   6.609
  542   2HB   ASN  77          1HB       ASN  77  11.914  -9.385   7.985
  543   1HD2  ASN  77          1HD2      ASN  77  11.577 -11.209   6.746
  544   2HD2  ASN  77          2HD2      ASN  77  10.168 -11.425   5.767
  545    H    THR  78           H        THR  78  11.114  -7.775  10.538
  546    HA   THR  78           HA       THR  78   9.005  -9.581  11.175
  547    HB   THR  78           HB       THR  78  11.094  -9.312  12.560
  548    HG1  THR  78           1HG      THR  78   8.529  -9.077  13.775
  549   1HG2  THR  78          1HG2      THR  78  11.106  -7.529  14.265
  550   2HG2  THR  78          2HG2      THR  78   9.693  -6.804  13.499
  551   3HG2  THR  78          3HG2      THR  78  11.223  -6.880  12.628
  552    H    ALA  79           H        ALA  79   9.130  -6.254  10.590
  553    HA   ALA  79           HA       ALA  79   6.532  -5.826  11.889
  554   1HB   ALA  79          1HB       ALA  79   8.245  -4.291  12.671
  555   2HB   ALA  79          2HB       ALA  79   7.023  -3.425  11.738
  556   3HB   ALA  79          3HB       ALA  79   8.585  -3.801  11.011
  557    H    PHE  80           H        PHE  80   8.382  -4.866   9.013
  558    HA   PHE  80           HA       PHE  80   5.939  -5.134   7.403
  559   1HB   PHE  80          2HB       PHE  80   7.921  -2.849   7.235
  560   2HB   PHE  80          1HB       PHE  80   6.548  -3.093   6.159
  561    HD1  PHE  80           1HD      PHE  80   7.682  -1.497   9.076
  562    HD2  PHE  80           2HD      PHE  80   4.228  -3.252   7.322
  563    HE1  PHE  80           1HE      PHE  80   6.258  -0.238  10.641
  564    HE2  PHE  80           2HE      PHE  80   2.795  -1.994   8.878
  565    HZ   PHE  80           HZ       PHE  80   3.809  -0.487  10.541
  566    H    GLY  81           H        GLY  81   7.743  -3.993   5.165
  567   1HA   GLY  81          2HA       GLY  81   9.873  -5.894   4.916
  568   2HA   GLY  81          1HA       GLY  81   8.488  -6.314   3.920
  569    H    TYR  82           H        TYR  82   7.807  -4.841   2.300
  570    HA   TYR  82           HA       TYR  82   9.720  -2.762   1.554
  571   1HB   TYR  82          2HB       TYR  82   9.945  -3.579  -0.716
  572   2HB   TYR  82          1HB       TYR  82  10.412  -4.870   0.387
  573    HD1  TYR  82           1HD      TYR  82   8.620  -6.650   0.923
  574    HD2  TYR  82           2HD      TYR  82   8.343  -3.976  -2.378
  575    HE1  TYR  82           1HE      TYR  82   7.032  -8.173  -0.170
  576    HE2  TYR  82           2HE      TYR  82   6.752  -5.496  -3.477
  577    HH   TYR  82           HH       TYR  82   6.151  -7.876  -3.427
  578    H    TYR  83           H        TYR  83   8.828  -1.358  -0.175
  579    HA   TYR  83           HA       TYR  83   6.014  -1.682  -0.737
  580   1HB   TYR  83          2HB       TYR  83   5.410   0.560   0.073
  581   2HB   TYR  83          1HB       TYR  83   5.921  -0.495   1.378
  582    HD1  TYR  83           1HD      TYR  83   7.970  -0.048   2.587
  583    HD2  TYR  83           2HD      TYR  83   6.697   2.480  -0.584
  584    HE1  TYR  83           1HE      TYR  83   9.551   1.669   3.339
  585    HE2  TYR  83           2HE      TYR  83   8.291   4.209   0.146
  586    HH   TYR  83           HH       TYR  83  10.763   3.574   2.406
  587    H    LEU  84           H        LEU  84   5.365  -0.683  -2.575
  588    HA   LEU  84           HA       LEU  84   7.334   0.988  -3.976
  589   1HB   LEU  84          2HB       LEU  84   5.547  -1.149  -5.143
  590   2HB   LEU  84          1HB       LEU  84   6.457  -0.002  -6.105
  591    HG   LEU  84           HG       LEU  84   7.658  -2.056  -4.245
  592   1HD1  LEU  84          1HD1      LEU  84   6.659  -3.123  -6.164
  593   2HD1  LEU  84          2HD1      LEU  84   8.415  -3.126  -6.337
  594   3HD1  LEU  84          3HD1      LEU  84   7.441  -1.974  -7.251
  595   1HD2  LEU  84          1HD2      LEU  84   9.782  -1.411  -5.258
  596   2HD2  LEU  84          2HD2      LEU  84   9.025  -0.040  -4.446
  597   3HD2  LEU  84          3HD2      LEU  84   8.961  -0.168  -6.204
  598    H    THR  85           H        THR  85   6.464   2.956  -3.734
  599    HA   THR  85           HA       THR  85   3.604   3.328  -3.720
  600    HB   THR  85           HB       THR  85   5.733   5.469  -3.581
  601    HG1  THR  85           1HG      THR  85   4.708   3.744  -1.550
  602   1HG2  THR  85          1HG2      THR  85   3.414   6.220  -3.875
  603   2HG2  THR  85          2HG2      THR  85   4.030   6.645  -2.277
  604   3HG2  THR  85          3HG2      THR  85   2.934   5.277  -2.465
  605    H    LEU  86           H        LEU  86   2.555   3.469  -5.584
  606    HA   LEU  86           HA       LEU  86   3.995   4.492  -7.939
  607   1HB   LEU  86          2HB       LEU  86   3.961   2.027  -7.791
  608   2HB   LEU  86          1HB       LEU  86   2.215   2.069  -7.731
  609    HG   LEU  86           HG       LEU  86   3.516   3.288 -10.104
  610   1HD1  LEU  86          1HD1      LEU  86   3.243   0.315  -9.670
  611   2HD1  LEU  86          2HD1      LEU  86   4.764   1.203  -9.757
  612   3HD1  LEU  86          3HD1      LEU  86   3.717   1.108 -11.173
  613   1HD2  LEU  86          1HD2      LEU  86   1.082   3.307  -9.806
  614   2HD2  LEU  86          2HD2      LEU  86   1.087   1.545  -9.700
  615   3HD2  LEU  86          3HD2      LEU  86   1.561   2.341 -11.200
  616    H    THR  87           H        THR  87   2.841   5.810  -9.319
  617    HA   THR  87           HA       THR  87   0.176   6.625  -8.552
  618    HB   THR  87           HB       THR  87   0.391   7.838 -10.877
  619    HG1  THR  87           1HG      THR  87   2.200   7.438 -11.850
  620   1HG2  THR  87          1HG2      THR  87   2.144   8.615  -8.551
  621   2HG2  THR  87          2HG2      THR  87   0.430   8.996  -8.727
  622   3HG2  THR  87          3HG2      THR  87   1.607   9.683  -9.847
  623    H    ARG  88           H        ARG  88  -1.612   5.656  -9.167
  624    HA   ARG  88           HA       ARG  88  -2.638   5.104 -11.563
  625   1HB   ARG  88          2HB       ARG  88  -0.622   3.574 -11.906
  626   2HB   ARG  88          1HB       ARG  88  -1.322   2.508 -10.699
  627   1HG   ARG  88          2HG       ARG  88  -3.279   2.176 -12.083
  628   2HG   ARG  88          1HG       ARG  88  -2.656   3.324 -13.272
  629   1HD   ARG  88          2HD       ARG  88  -2.017   1.320 -14.203
  630   2HD   ARG  88          1HD       ARG  88  -0.577   1.753 -13.279
  631    HE   ARG  88           HE       ARG  88  -2.607  -0.193 -12.385
  632   1HH1  ARG  88          1HH1      ARG  88   0.687   0.995 -12.430
  633   2HH1  ARG  88          2HH1      ARG  88   1.335  -0.401 -11.641
  634   1HH2  ARG  88          1HH2      ARG  88  -1.781  -2.025 -11.358
  635   2HH2  ARG  88          2HH2      ARG  88  -0.071  -2.150 -11.047
  636    H    LEU  89           H        LEU  89  -4.611   5.358 -10.631
  637    HA   LEU  89           HA       LEU  89  -5.692   3.242  -9.012
  638   1HB   LEU  89          2HB       LEU  89  -4.425   4.609  -7.353
  639   2HB   LEU  89          1HB       LEU  89  -5.410   5.992  -7.786
  640    HG   LEU  89           HG       LEU  89  -7.417   4.744  -6.989
  641   1HD1  LEU  89          1HD1      LEU  89  -5.375   2.782  -5.964
  642   2HD1  LEU  89          2HD1      LEU  89  -6.545   2.481  -7.249
  643   3HD1  LEU  89          3HD1      LEU  89  -7.101   2.772  -5.601
  644   1HD2  LEU  89          1HD2      LEU  89  -5.195   5.152  -4.995
  645   2HD2  LEU  89          2HD2      LEU  89  -6.908   5.011  -4.601
  646   3HD2  LEU  89          3HD2      LEU  89  -6.332   6.374  -5.563
  647    H    ASP  90           H        ASP  90  -7.990   3.783  -8.381
  648    HA   ASP  90           HA       ASP  90  -9.273   5.829 -10.030
  649   1HB   ASP  90          2HB       ASP  90  -9.266   3.631 -11.299
  650   2HB   ASP  90          1HB       ASP  90 -10.223   2.949  -9.991
  651    H    LYS  91           H        LYS  91 -11.532   6.214  -9.278
  652    HA   LYS  91           HA       LYS  91 -11.729   6.246  -6.457
  653   1HB   LYS  91          2HB       LYS  91 -12.971   7.631  -8.384
  654   2HB   LYS  91          1HB       LYS  91 -14.210   6.416  -8.108
  655   1HG   LYS  91          2HG       LYS  91 -13.060   8.256  -6.013
  656   2HG   LYS  91          1HG       LYS  91 -14.614   8.456  -6.819
  657   1HD   LYS  91          2HD       LYS  91 -15.388   6.345  -5.859
  658   2HD   LYS  91          1HD       LYS  91 -13.826   6.122  -5.074
  659   1HE   LYS  91          2HE       LYS  91 -15.375   6.973  -3.456
  660   2HE   LYS  91          1HE       LYS  91 -14.212   8.242  -3.834
  661   1HZ   LYS  91          1HZ       LYS  91 -16.889   8.052  -5.096
  662   2HZ   LYS  91          2HZ       LYS  91 -15.808   9.357  -5.164
  663   3HZ   LYS  91          3HZ       LYS  91 -16.578   8.971  -3.707
  664    H    ALA  92           H        ALA  92 -13.038   4.108  -8.951
  665    HA   ALA  92           HA       ALA  92 -14.638   2.529  -7.204
  666   1HB   ALA  92          1HB       ALA  92 -13.415   1.813  -9.870
  667   2HB   ALA  92          2HB       ALA  92 -15.004   2.534  -9.615
  668   3HB   ALA  92          3HB       ALA  92 -14.675   0.901  -9.039
  669    H    ALA  93           H        ALA  93 -11.286   2.468  -8.178
  670    HA   ALA  93           HA       ALA  93 -10.647  -0.096  -7.164
  671   1HB   ALA  93          1HB       ALA  93  -8.316   0.628  -7.328
  672   2HB   ALA  93          2HB       ALA  93  -8.849   2.287  -7.598
  673   3HB   ALA  93          3HB       ALA  93  -9.226   1.038  -8.783
  674    H    CYS  94           H        CYS  94 -10.928   3.063  -5.716
  675    HA   CYS  94           HA       CYS  94  -9.718   2.579  -3.235
  676   1HB   CYS  94          2HB       CYS  94 -10.446   4.811  -3.860
  677   2HB   CYS  94          1HB       CYS  94 -12.121   4.283  -3.946
  678    H    VAL  95           H        VAL  95 -13.043   2.015  -4.344
  679    HA   VAL  95           HA       VAL  95 -13.919   0.809  -1.937
  680    HB   VAL  95           HB       VAL  95 -15.076   0.429  -4.702
  681   1HG1  VAL  95          1HG1      VAL  95 -17.169  -0.041  -3.511
  682   2HG1  VAL  95          2HG1      VAL  95 -16.321   0.111  -1.972
  683   3HG1  VAL  95          3HG1      VAL  95 -15.904  -1.192  -3.084
  684   1HG2  VAL  95          1HG2      VAL  95 -16.591   2.274  -4.143
  685   2HG2  VAL  95          2HG2      VAL  95 -14.909   2.801  -4.160
  686   3HG2  VAL  95          3HG2      VAL  95 -15.728   2.519  -2.625
  687    H    SER  96           H        SER  96 -12.516  -0.382  -4.885
  688    HA   SER  96           HA       SER  96 -12.794  -3.119  -4.500
  689   1HB   SER  96          2HB       SER  96 -10.714  -1.448  -5.867
  690   2HB   SER  96          1HB       SER  96 -10.675  -3.211  -5.915
  691    HG   SER  96           HG       SER  96 -13.094  -2.702  -6.562
  692    H    LEU  97           H        LEU  97 -10.447  -0.870  -3.133
  693    HA   LEU  97           HA       LEU  97  -8.728  -2.919  -2.132
  694   1HB   LEU  97          2HB       LEU  97  -8.960   0.003  -1.423
  695   2HB   LEU  97          1HB       LEU  97  -7.696  -1.061  -0.833
  696    HG   LEU  97           HG       LEU  97  -8.179  -0.433  -3.749
  697   1HD1  LEU  97          1HD1      LEU  97  -6.149   0.923  -3.591
  698   2HD1  LEU  97          2HD1      LEU  97  -6.078   0.620  -1.855
  699   3HD1  LEU  97          3HD1      LEU  97  -7.418   1.543  -2.535
  700   1HD2  LEU  97          1HD2      LEU  97  -5.926  -1.879  -2.359
  701   2HD2  LEU  97          2HD2      LEU  97  -6.001  -1.489  -4.079
  702   3HD2  LEU  97          3HD2      LEU  97  -7.165  -2.614  -3.380
  703    H    ALA  98           H        ALA  98 -11.562  -1.299  -0.934
  704    HA   ALA  98           HA       ALA  98 -11.237  -2.354   1.749
  705   1HB   ALA  98          1HB       ALA  98 -12.307  -0.196   1.457
  706   2HB   ALA  98          2HB       ALA  98 -13.423  -1.351   2.184
  707   3HB   ALA  98          3HB       ALA  98 -13.568  -0.940   0.476
  708    H    THR  99           H        THR  99 -12.538  -3.364  -1.229
  709    HA   THR  99           HA       THR  99 -14.026  -5.538   0.047
  710    HB   THR  99           HB       THR  99 -14.693  -6.054  -2.377
  711    HG1  THR  99           1HG      THR  99 -13.853  -3.358  -2.772
  712   1HG2  THR  99          1HG2      THR  99 -15.539  -3.435  -1.135
  713   2HG2  THR  99          2HG2      THR  99 -16.219  -5.024  -0.778
  714   3HG2  THR  99          3HG2      THR  99 -16.428  -4.314  -2.379
  715    H    LEU 100           H        LEU 100 -11.014  -4.913  -0.575
  716    HA   LEU 100           HA       LEU 100 -10.309  -7.576  -1.593
  717   1HB   LEU 100          2HB       LEU 100  -9.338  -5.204  -2.360
  718   2HB   LEU 100          1HB       LEU 100  -8.287  -5.467  -0.984
  719    HG   LEU 100           HG       LEU 100  -8.550  -7.401  -3.286
  720   1HD1  LEU 100          1HD1      LEU 100  -6.475  -5.275  -2.770
  721   2HD1  LEU 100          2HD1      LEU 100  -7.682  -5.260  -4.056
  722   3HD1  LEU 100          3HD1      LEU 100  -6.413  -6.485  -4.049
  723   1HD2  LEU 100          1HD2      LEU 100  -6.477  -8.341  -2.406
  724   2HD2  LEU 100          2HD2      LEU 100  -7.751  -8.398  -1.188
  725   3HD2  LEU 100          3HD2      LEU 100  -6.489  -7.170  -1.089
  726    H    ASN 101           H        ASN 101  -9.402  -9.058  -0.184
  727    HA   ASN 101           HA       ASN 101  -9.333  -8.209   2.612
  728   1HB   ASN 101          2HB       ASN 101 -10.577 -10.303   1.849
  729   2HB   ASN 101          1HB       ASN 101  -8.993 -11.033   1.596
  730   1HD2  ASN 101          1HD2      ASN 101 -11.161 -11.709   3.447
  731   2HD2  ASN 101          2HD2      ASN 101 -10.452 -11.689   5.030
  732    H    LEU 102           H        LEU 102  -7.416  -7.086   2.698
  733    HA   LEU 102           HA       LEU 102  -4.950  -8.216   1.761
  734   1HB   LEU 102          2HB       LEU 102  -5.609  -5.758   3.365
  735   2HB   LEU 102          1HB       LEU 102  -3.955  -6.245   3.060
  736    HG   LEU 102           HG       LEU 102  -4.464  -4.574   1.475
  737   1HD1  LEU 102          1HD1      LEU 102  -4.244  -5.717  -0.657
  738   2HD1  LEU 102          2HD1      LEU 102  -4.736  -7.234   0.094
  739   3HD1  LEU 102          3HD1      LEU 102  -3.225  -6.462   0.573
  740   1HD2  LEU 102          1HD2      LEU 102  -6.380  -4.665  -0.037
  741   2HD2  LEU 102          2HD2      LEU 102  -6.881  -4.580   1.652
  742   3HD2  LEU 102          3HD2      LEU 102  -6.957  -6.114   0.784
  743    H    GLY 103           H        GLY 103  -6.744  -9.215   4.224
  744   1HA   GLY 103          2HA       GLY 103  -4.742  -9.299   6.316
  745   2HA   GLY 103          1HA       GLY 103  -6.333 -10.051   6.361
  746    H    THR 104           H        THR 104  -4.252 -10.552   3.666
  747    HA   THR 104           HA       THR 104  -3.644 -13.281   4.580
  748    HB   THR 104           HB       THR 104  -3.927 -13.933   2.128
  749    HG1  THR 104           1HG      THR 104  -5.686 -11.766   1.852
  750   1HG2  THR 104          1HG2      THR 104  -6.369 -13.014   3.649
  751   2HG2  THR 104          2HG2      THR 104  -5.563 -14.572   3.827
  752   3HG2  THR 104          3HG2      THR 104  -6.367 -14.161   2.312
  753    H    SER 105           H        SER 105  -2.934 -11.134   1.840
  754    HA   SER 105           HA       SER 105  -0.126 -11.976   1.983
  755   1HB   SER 105          2HB       SER 105  -0.168 -11.089  -0.451
  756   2HB   SER 105          1HB       SER 105  -0.967 -12.623  -0.101
  757    HG   SER 105           HG       SER 105  -2.894 -11.702  -0.358
  758    H    ALA 106           H        ALA 106  -1.454  -9.679   3.471
  759    HA   ALA 106           HA       ALA 106   0.472  -7.651   2.559
  760   1HB   ALA 106          1HB       ALA 106  -1.763  -6.941   1.885
  761   2HB   ALA 106          2HB       ALA 106  -1.093  -5.873   3.118
  762   3HB   ALA 106          3HB       ALA 106  -2.312  -7.070   3.555
  763    H    LYS 107           H        LYS 107   1.333  -6.292   4.191
  764    HA   LYS 107           HA       LYS 107   1.659  -7.630   6.719
  765   1HB   LYS 107          2HB       LYS 107   2.621  -4.845   6.058
  766   2HB   LYS 107          1HB       LYS 107   3.301  -5.972   7.216
  767   1HG   LYS 107          2HG       LYS 107   3.341  -6.385   4.243
  768   2HG   LYS 107          1HG       LYS 107   4.644  -5.643   5.166
  769   1HD   LYS 107          2HD       LYS 107   3.587  -8.416   5.668
  770   2HD   LYS 107          1HD       LYS 107   4.982  -8.059   4.651
  771   1HE   LYS 107          2HE       LYS 107   5.933  -6.848   6.692
  772   2HE   LYS 107          1HE       LYS 107   4.675  -7.670   7.613
  773   1HZ   LYS 107          1HZ       LYS 107   6.672  -9.072   5.918
  774   2HZ   LYS 107          2HZ       LYS 107   5.570  -9.780   7.000
  775   3HZ   LYS 107          3HZ       LYS 107   6.846  -8.835   7.587
  776    H    GLY 108           H        GLY 108   0.064  -4.847   5.416
  777   1HA   GLY 108          2HA       GLY 108  -2.015  -4.501   7.136
  778   2HA   GLY 108          1HA       GLY 108  -0.682  -3.636   7.907
  779    H    TYR 109           H        TYR 109  -3.230  -2.669   6.455
  780    HA   TYR 109           HA       TYR 109  -1.806  -1.175   4.364
  781   1HB   TYR 109          2HB       TYR 109  -2.985  -2.064   2.696
  782   2HB   TYR 109          1HB       TYR 109  -3.504  -3.273   3.846
  783    HD1  TYR 109           1HD      TYR 109  -4.524  -0.035   2.298
  784    HD2  TYR 109           2HD      TYR 109  -5.758  -3.565   4.321
  785    HE1  TYR 109           1HE      TYR 109  -6.874   0.496   1.789
  786    HE2  TYR 109           2HE      TYR 109  -8.104  -3.052   3.829
  787    HH   TYR 109           HH       TYR 109  -9.059  -0.836   1.555
  788    H    GLY 110           H        GLY 110  -2.185   0.943   4.201
  789   1HA   GLY 110          2HA       GLY 110  -4.321   2.024   5.943
  790   2HA   GLY 110          1HA       GLY 110  -2.696   2.699   5.910
  791    H    VAL 111           H        VAL 111  -4.824   4.346   5.412
  792    HA   VAL 111           HA       VAL 111  -4.550   4.844   2.527
  793    HB   VAL 111           HB       VAL 111  -7.114   5.205   4.104
  794   1HG1  VAL 111          1HG1      VAL 111  -6.518   5.679   1.184
  795   2HG1  VAL 111          2HG1      VAL 111  -6.855   6.913   2.398
  796   3HG1  VAL 111          3HG1      VAL 111  -8.114   5.770   1.932
  797   1HG2  VAL 111          1HG2      VAL 111  -6.417   3.213   1.950
  798   2HG2  VAL 111          2HG2      VAL 111  -8.022   3.452   2.639
  799   3HG2  VAL 111          3HG2      VAL 111  -6.707   2.858   3.653
  800    H    ASN 112           H        ASN 112  -4.309   6.947   1.936
  801    HA   ASN 112           HA       ASN 112  -3.861   9.155   2.055
  802   1HB   ASN 112          2HB       ASN 112  -6.127   9.025   3.387
  803   2HB   ASN 112          1HB       ASN 112  -5.102   9.377   4.774
  804   1HD2  ASN 112          1HD2      ASN 112  -7.184  10.997   3.707
  805   2HD2  ASN 112          2HD2      ASN 112  -6.466  12.484   3.207
  806    H    ILE 113           H        ILE 113  -2.127   7.093   3.158
  807    HA   ILE 113           HA       ILE 113  -0.815   8.270   5.455
  808    HB   ILE 113           HB       ILE 113  -0.051   5.874   3.772
  809   1HG1  ILE 113          2HG1      ILE 113  -2.175   5.557   4.952
  810   2HG1  ILE 113          1HG1      ILE 113  -0.914   4.537   5.639
  811   1HG2  ILE 113          1HG2      ILE 113   1.035   6.782   6.435
  812   2HG2  ILE 113          2HG2      ILE 113   1.889   6.823   4.894
  813   3HG2  ILE 113          3HG2      ILE 113   1.445   5.275   5.615
  814   1HD1  ILE 113          1HD1      ILE 113  -1.893   7.136   6.793
  815   2HD1  ILE 113          2HD1      ILE 113  -0.647   6.098   7.485
  816   3HD1  ILE 113          3HD1      ILE 113  -2.309   5.522   7.366
  817    H    SER 114           H        SER 114   0.952   9.532   5.401
  818    HA   SER 114           HA       SER 114   2.652   9.451   3.024
  819   1HB   SER 114          2HB       SER 114   1.764  11.969   4.453
  820   2HB   SER 114          1HB       SER 114   2.994  11.903   3.184
  821    HG   SER 114           HG       SER 114   0.975  10.631   2.187
  822    H    GLY 115           H        GLY 115   4.089   8.145   4.054
  823   1HA   GLY 115          2HA       GLY 115   6.258   8.826   5.401
  824   2HA   GLY 115          1HA       GLY 115   5.076   8.859   6.711
  825    H    GLU 116           H        GLU 116   5.824   6.770   3.960
  826    HA   GLU 116           HA       GLU 116   4.497   4.540   4.950
  827   1HB   GLU 116          2HB       GLU 116   5.184   5.033   2.573
  828   2HB   GLU 116          1HB       GLU 116   6.795   4.476   3.009
  829   1HG   GLU 116          2HG       GLU 116   5.886   2.585   2.115
  830   2HG   GLU 116          1HG       GLU 116   5.541   2.360   3.829
  831    H    ASN 117           H        ASN 117   7.908   5.443   5.249
  832    HA   ASN 117           HA       ASN 117   9.025   2.992   5.830
  833   1HB   ASN 117          2HB       ASN 117  10.320   5.071   5.468
  834   2HB   ASN 117          1HB       ASN 117   9.838   5.628   7.066
  835   1HD2  ASN 117          1HD2      ASN 117  11.753   3.311   5.296
  836   2HD2  ASN 117          2HD2      ASN 117  12.760   2.844   6.618
  837    H    ASN 118           H        ASN 118   7.355   5.186   8.037
  838    HA   ASN 118           HA       ASN 118   6.887   2.864   9.737
  839   1HB   ASN 118          2HB       ASN 118   8.109   5.431  10.632
  840   2HB   ASN 118          1HB       ASN 118   6.946   4.657  11.705
  841   1HD2  ASN 118          1HD2      ASN 118  10.100   4.502  10.314
  842   2HD2  ASN 118          2HD2      ASN 118  10.668   3.157  11.238
  843    H    ILE 119           H        ILE 119   4.982   3.027   8.342
  844    HA   ILE 119           HA       ILE 119   3.014   4.965   8.521
  845    HB   ILE 119           HB       ILE 119   2.840   3.203   6.906
  846   1HG1  ILE 119          2HG1      ILE 119   0.592   2.783   8.889
  847   2HG1  ILE 119          1HG1      ILE 119   0.686   4.130   7.764
  848   1HG2  ILE 119          1HG2      ILE 119   3.966   1.439   8.108
  849   2HG2  ILE 119          2HG2      ILE 119   2.405   0.869   7.520
  850   3HG2  ILE 119          3HG2      ILE 119   2.606   1.291   9.219
  851   1HD1  ILE 119          1HD1      ILE 119   0.502   1.221   7.020
  852   2HD1  ILE 119          2HD1      ILE 119   0.600   2.570   5.888
  853   3HD1  ILE 119          3HD1      ILE 119  -0.804   2.403   6.943
  854    H    THR 120           H        THR 120   1.157   5.178   9.806
  855    HA   THR 120           HA       THR 120   1.615   4.798  12.577
  856    HB   THR 120           HB       THR 120   0.380   6.739  11.609
  857    HG1  THR 120           1HG      THR 120  -0.250   6.837  13.619
  858   1HG2  THR 120          1HG2      THR 120  -1.995   6.485  11.062
  859   2HG2  THR 120          2HG2      THR 120  -1.856   4.739  11.265
  860   3HG2  THR 120          3HG2      THR 120  -0.979   5.546   9.966
  861    H    SER 121           H        SER 121  -0.376   3.966  13.942
  862    HA   SER 121           HA       SER 121  -0.303   1.168  13.645
  863   1HB   SER 121          2HB       SER 121  -0.563   2.442  15.811
  864   2HB   SER 121          1HB       SER 121  -2.248   2.716  15.368
  865    HG   SER 121           HG       SER 121  -2.691   0.759  15.990
  866    H    PHE 122           H        PHE 122  -2.109  -0.282  13.459
  867    HA   PHE 122           HA       PHE 122  -3.809   0.540  11.237
  868   1HB   PHE 122          2HB       PHE 122  -3.339  -2.237  12.347
  869   2HB   PHE 122          1HB       PHE 122  -4.084  -1.827  10.804
  870    HD1  PHE 122           1HD      PHE 122  -2.654  -0.660   9.064
  871    HD2  PHE 122           2HD      PHE 122  -1.029  -2.534  12.519
  872    HE1  PHE 122           1HE      PHE 122  -0.458  -0.778   7.961
  873    HE2  PHE 122           2HE      PHE 122   1.169  -2.651  11.426
  874    HZ   PHE 122           HZ       PHE 122   1.479  -1.690   9.182
  875    H    GLY 123           H        GLY 123  -5.752   1.286  11.740
  876   1HA   GLY 123          2HA       GLY 123  -7.159   0.100  14.047
  877   2HA   GLY 123          1HA       GLY 123  -7.431   1.728  13.440
  878    H    ASN 124           H        ASN 124  -9.543   1.655  12.901
  879    HA   ASN 124           HA       ASN 124 -10.342  -0.303  10.854
  880   1HB   ASN 124          2HB       ASN 124 -12.529  -0.533  11.918
  881   2HB   ASN 124          1HB       ASN 124 -11.257  -0.985  13.046
  882   1HD2  ASN 124          1HD2      ASN 124 -13.948  -0.191  13.651
  883   2HD2  ASN 124          2HD2      ASN 124 -13.850   1.230  14.640
  884    H    SER 125           H        SER 125  -9.471   2.530  10.728
  885    HA   SER 125           HA       SER 125 -11.716   3.473   9.133
  886   1HB   SER 125          2HB       SER 125 -10.447   5.178  11.292
  887   2HB   SER 125          1HB       SER 125 -11.643   5.729  10.119
  888    HG   SER 125           HG       SER 125 -12.535   3.512  11.335
  889    H    ALA 126           H        ALA 126 -11.104   4.869   7.449
  890    HA   ALA 126           HA       ALA 126  -8.197   4.914   7.003
  891   1HB   ALA 126          1HB       ALA 126  -9.424   3.470   5.463
  892   2HB   ALA 126          2HB       ALA 126  -8.670   4.825   4.622
  893   3HB   ALA 126          3HB       ALA 126 -10.404   4.845   4.948
  894    H    ASP 127           H        ASP 127  -7.548   6.934   7.543
  895    HA   ASP 127           HA       ASP 127  -7.928   9.020   5.713
  896   1HB   ASP 127          2HB       ASP 127 -10.123   9.184   7.035
  897   2HB   ASP 127          1HB       ASP 127  -9.139   9.698   8.401
  898    H    GLN 128           H        GLN 128  -5.716   8.897   5.783
  899    HA   GLN 128           HA       GLN 128  -3.583   9.236   6.452
  900   1HB   GLN 128          2HB       GLN 128  -4.895  11.024   8.504
  901   2HB   GLN 128          1HB       GLN 128  -3.160  10.931   8.230
  902   1HG   GLN 128          2HG       GLN 128  -3.624  11.572   5.840
  903   2HG   GLN 128          1HG       GLN 128  -5.276  11.920   6.347
  904   1HE2  GLN 128          1HE2      GLN 128  -2.514  12.457   8.403
  905   2HE2  GLN 128          2HE2      GLN 128  -2.563  14.184   8.353
  906    H    ALA 129           H        ALA 129  -5.357   7.182   7.578
  907    HA   ALA 129           HA       ALA 129  -3.675   6.364   9.817
  908   1HB   ALA 129          1HB       ALA 129  -5.673   7.353  10.818
  909   2HB   ALA 129          2HB       ALA 129  -5.630   5.610  11.086
  910   3HB   ALA 129          3HB       ALA 129  -6.692   6.287   9.852
  911    H    ALA 130           H        ALA 130  -3.554   4.129  10.093
  912    HA   ALA 130           HA       ALA 130  -4.029   2.670   7.623
  913   1HB   ALA 130          1HB       ALA 130  -2.529   1.001   8.569
  914   2HB   ALA 130          2HB       ALA 130  -2.480   1.896  10.090
  915   3HB   ALA 130          3HB       ALA 130  -1.803   2.607   8.625
  916    H    LYS 131           H        LYS 131  -4.815   0.409   7.780
  917    HA   LYS 131           HA       LYS 131  -6.643  -0.001  10.045
  918   1HB   LYS 131          2HB       LYS 131  -8.395  -0.790   8.588
  919   2HB   LYS 131          1HB       LYS 131  -7.911   0.822   8.042
  920   1HG   LYS 131          2HG       LYS 131  -6.312  -1.002   6.624
  921   2HG   LYS 131          1HG       LYS 131  -7.956  -1.671   6.594
  922   1HD   LYS 131          2HD       LYS 131  -7.446  -0.145   4.696
  923   2HD   LYS 131          1HD       LYS 131  -8.821   0.365   5.668
  924   1HE   LYS 131          2HE       LYS 131  -6.052   1.466   6.087
  925   2HE   LYS 131          1HE       LYS 131  -7.181   2.170   4.930
  926   1HZ   LYS 131          1HZ       LYS 131  -8.772   2.436   6.803
  927   2HZ   LYS 131          2HZ       LYS 131  -7.355   3.356   6.977
  928   3HZ   LYS 131          3HZ       LYS 131  -7.550   1.935   7.864
  929    H    SER 132           H        SER 132  -7.206  -2.282  10.341
  930    HA   SER 132           HA       SER 132  -4.861  -3.904   9.766
  931   1HB   SER 132          2HB       SER 132  -5.722  -3.756  12.051
  932   2HB   SER 132          1HB       SER 132  -7.239  -4.495  11.541
  933    HG   SER 132           HG       SER 132  -5.811  -6.289  10.796
  934    H    THR 133           H        THR 133  -7.242  -3.179   7.951
  935    HA   THR 133           HA       THR 133  -7.913  -4.017   5.969
  936    HB   THR 133           HB       THR 133  -6.729  -5.769   4.925
  937    HG1  THR 133           1HG      THR 133  -6.330  -6.744   7.560
  938   1HG2  THR 133          1HG2      THR 133  -5.284  -3.862   5.464
  939   2HG2  THR 133          2HG2      THR 133  -4.375  -5.373   5.456
  940   3HG2  THR 133          3HG2      THR 133  -4.837  -4.630   6.987
  941    H    ALA 134           H        ALA 134  -8.420  -6.666   5.199
  942    HA   ALA 134           HA       ALA 134  -9.542  -8.581   5.523
  943   1HB   ALA 134          1HB       ALA 134 -10.020  -7.669   8.350
  944   2HB   ALA 134          2HB       ALA 134  -8.689  -8.688   7.797
  945   3HB   ALA 134          3HB       ALA 134 -10.350  -9.279   7.707
  946    H    ILE 135           H        ILE 135 -10.783  -5.950   4.705
  947    HA   ILE 135           HA       ILE 135 -12.683  -5.947   3.345
  948    HB   ILE 135           HB       ILE 135 -13.553  -8.314   4.999
  949   1HG1  ILE 135          2HG1      ILE 135 -11.686  -8.708   3.402
  950   2HG1  ILE 135          1HG1      ILE 135 -13.136  -9.630   3.022
  951   1HG2  ILE 135          1HG2      ILE 135 -15.380  -8.582   3.376
  952   2HG2  ILE 135          2HG2      ILE 135 -14.938  -7.037   2.649
  953   3HG2  ILE 135          3HG2      ILE 135 -15.517  -7.095   4.314
  954   1HD1  ILE 135          1HD1      ILE 135 -12.213  -7.112   1.661
  955   2HD1  ILE 135          2HD1      ILE 135 -13.706  -7.979   1.298
  956   3HD1  ILE 135          3HD1      ILE 135 -12.145  -8.750   1.013
  957    H    THR 136           H        THR 136 -13.728  -4.151   3.702
  958    HA   THR 136           HA       THR 136 -16.118  -4.175   5.133
  959    HB   THR 136           HB       THR 136 -14.949  -3.969   7.192
  960    HG1  THR 136           1HG      THR 136 -16.708  -2.622   7.188
  961   1HG2  THR 136          1HG2      THR 136 -12.771  -3.247   6.373
  962   2HG2  THR 136          2HG2      THR 136 -13.329  -2.189   7.668
  963   3HG2  THR 136          3HG2      THR 136 -13.427  -1.655   5.991
  964    HA   PRO 137           HA       PRO 137 -16.511  -1.105   1.924
  965   1HB   PRO 137          2HB       PRO 137 -19.162  -0.609   2.369
  966   2HB   PRO 137          1HB       PRO 137 -18.566  -1.996   1.450
  967   1HG   PRO 137          2HG       PRO 137 -19.436  -1.850   4.310
  968   2HG   PRO 137          1HG       PRO 137 -19.794  -3.090   3.093
  969   1HD   PRO 137          2HD       PRO 137 -17.909  -3.456   4.971
  970   2HD   PRO 137          1HD       PRO 137 -17.721  -4.093   3.324
  971    H    ALA 138           H        ALA 138 -17.406  -0.714   5.282
  972    HA   ALA 138           HA       ALA 138 -17.884   2.068   5.262
  973   1HB   ALA 138          1HB       ALA 138 -16.867   0.325   7.506
  974   2HB   ALA 138          2HB       ALA 138 -18.560   0.647   7.126
  975   3HB   ALA 138          3HB       ALA 138 -17.514   1.957   7.680
  976    H    GLU 139           H        GLU 139 -15.012   0.126   5.366
  977    HA   GLU 139           HA       GLU 139 -13.109   2.048   6.101
  978   1HB   GLU 139          2HB       GLU 139 -12.835  -0.471   5.850
  979   2HB   GLU 139          1HB       GLU 139 -12.695  -0.193   4.121
  980   1HG   GLU 139          2HG       GLU 139 -10.513  -0.403   5.023
  981   2HG   GLU 139          1HG       GLU 139 -10.767   1.287   4.579
  982    H    ALA 140           H        ALA 140 -14.240   0.992   2.900
  983    HA   ALA 140           HA       ALA 140 -12.721   2.814   1.381
  984   1HB   ALA 140          1HB       ALA 140 -13.768   0.846   0.396
  985   2HB   ALA 140          2HB       ALA 140 -14.267   2.314  -0.450
  986   3HB   ALA 140          3HB       ALA 140 -15.366   1.536   0.692
  987    H    ALA 141           H        ALA 141 -15.998   2.994   2.685
  988    HA   ALA 141           HA       ALA 141 -16.739   5.440   1.534
  989   1HB   ALA 141          1HB       ALA 141 -18.330   3.880   2.563
  990   2HB   ALA 141          2HB       ALA 141 -18.490   5.511   3.213
  991   3HB   ALA 141          3HB       ALA 141 -17.668   4.267   4.151
  992    H    THR 142           H        THR 142 -14.756   4.693   4.287
  993    HA   THR 142           HA       THR 142 -14.734   7.440   5.219
  994    HB   THR 142           HB       THR 142 -13.049   5.108   6.158
  995    HG1  THR 142           1HG      THR 142 -15.191   4.595   6.548
  996   1HG2  THR 142          1HG2      THR 142 -13.735   7.734   7.483
  997   2HG2  THR 142          2HG2      THR 142 -12.165   7.298   6.810
  998   3HG2  THR 142          3HG2      THR 142 -12.798   6.427   8.207
  999    H    ALA 143           H        ALA 143 -12.723   5.240   3.381
 1000    HA   ALA 143           HA       ALA 143 -10.296   6.634   3.486
 1001   1HB   ALA 143          1HB       ALA 143  -9.646   5.295   1.560
 1002   2HB   ALA 143          2HB       ALA 143 -11.331   4.843   1.290
 1003   3HB   ALA 143          3HB       ALA 143 -10.496   4.310   2.750
 1004    H    CYS 144           H        CYS 144 -12.513   6.476   0.706
 1005    HA   CYS 144           HA       CYS 144 -11.336   8.994  -0.219
 1006   1HB   CYS 144          2HB       CYS 144 -12.510   8.255  -2.420
 1007   2HB   CYS 144          1HB       CYS 144 -11.031   7.443  -1.919
 1008    H    LYS 145           H        LYS 145 -12.976   9.544   1.729
 1009    HA   LYS 145           HA       LYS 145 -15.702   9.913   1.134
 1010   1HB   LYS 145          2HB       LYS 145 -13.913  11.584   2.915
 1011   2HB   LYS 145          1HB       LYS 145 -15.665  11.644   2.903
 1012   1HG   LYS 145          2HG       LYS 145 -15.725   9.302   3.653
 1013   2HG   LYS 145          1HG       LYS 145 -13.961   9.307   3.726
 1014   1HD   LYS 145          2HD       LYS 145 -15.757  11.173   5.278
 1015   2HD   LYS 145          1HD       LYS 145 -15.038   9.698   5.927
 1016   1HE   LYS 145          2HE       LYS 145 -13.374  11.897   4.724
 1017   2HE   LYS 145          1HE       LYS 145 -13.853  11.909   6.420
 1018   1HZ   LYS 145          1HZ       LYS 145 -12.651   9.947   6.834
 1019   2HZ   LYS 145          2HZ       LYS 145 -11.612  10.917   5.908
 1020   3HZ   LYS 145          3HZ       LYS 145 -12.432   9.618   5.185
 1021    H    ASN 146           H        ASN 146 -13.398  12.548   1.484
 1022    HA   ASN 146           HA       ASN 146 -14.402  13.829  -0.948
 1023   1HB   ASN 146          2HB       ASN 146 -14.579  15.989   0.323
 1024   2HB   ASN 146          1HB       ASN 146 -15.760  14.780   0.814
 1025   1HD2  ASN 146          1HD2      ASN 146 -12.982  16.618   1.756
 1026   2HD2  ASN 146          2HD2      ASN 146 -12.994  16.163   3.429
 1027    H    THR 147           H        THR 147 -11.910  12.487   0.063
 1028    HA   THR 147           HA       THR 147  -9.915  14.474   0.428
 1029    HB   THR 147           HB       THR 147  -8.384  12.458  -0.178
 1030    HG1  THR 147           1HG      THR 147  -9.708  10.455   0.266
 1031   1HG2  THR 147          1HG2      THR 147  -8.779  13.247   2.110
 1032   2HG2  THR 147          2HG2      THR 147  -8.706  11.486   2.046
 1033   3HG2  THR 147          3HG2      THR 147 -10.265  12.300   2.179
 1034    H    ASP 148           H        ASP 148 -10.569  12.274  -2.284
 1035    HA   ASP 148           HA       ASP 148 -10.303  12.416  -4.521
 1036   1HB   ASP 148          2HB       ASP 148 -11.880  14.343  -4.147
 1037   2HB   ASP 148          1HB       ASP 148 -10.478  15.409  -4.186
 1038    H    SER 149           H        SER 149  -8.730  15.544  -4.040
 1039    HA   SER 149           HA       SER 149  -6.427  14.667  -5.498
 1040   1HB   SER 149          2HB       SER 149  -5.609  17.025  -4.740
 1041   2HB   SER 149          1HB       SER 149  -6.947  16.905  -5.883
 1042    HG   SER 149           HG       SER 149  -8.093  17.951  -4.491
 1043    H    THR 150           H        THR 150  -7.385  14.488  -2.294
 1044    HA   THR 150           HA       THR 150  -4.624  13.991  -1.379
 1045    HB   THR 150           HB       THR 150  -7.087  14.228   0.372
 1046    HG1  THR 150           1HG      THR 150  -5.273  16.272  -0.476
 1047   1HG2  THR 150          1HG2      THR 150  -5.136  13.228   1.445
 1048   2HG2  THR 150          2HG2      THR 150  -5.427  14.841   2.095
 1049   3HG2  THR 150          3HG2      THR 150  -4.134  14.583   0.923
 1050    H    ASN 151           H        ASN 151  -6.505  12.298  -3.048
 1051    HA   ASN 151           HA       ASN 151  -6.970  10.007  -1.313
 1052   1HB   ASN 151          2HB       ASN 151  -8.624  10.612  -3.083
 1053   2HB   ASN 151          1HB       ASN 151  -7.404  10.240  -4.298
 1054   1HD2  ASN 151          1HD2      ASN 151  -8.417   8.541  -5.234
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.732   7.049  -4.426
 1056    H    LYS 152           H        LYS 152  -4.945   9.310  -0.759
 1057    HA   LYS 152           HA       LYS 152  -3.643   7.767  -2.842
 1058   1HB   LYS 152          2HB       LYS 152  -1.391   8.463  -2.191
 1059   2HB   LYS 152          1HB       LYS 152  -2.318   9.808  -2.823
 1060   1HG   LYS 152          2HG       LYS 152  -1.993   9.306   0.122
 1061   2HG   LYS 152          1HG       LYS 152  -0.843  10.256  -0.814
 1062   1HD   LYS 152          2HD       LYS 152  -2.898  11.628  -1.545
 1063   2HD   LYS 152          1HD       LYS 152  -3.716  10.851  -0.189
 1064   1HE   LYS 152          2HE       LYS 152  -1.207  12.521  -0.040
 1065   2HE   LYS 152          1HE       LYS 152  -2.822  13.027   0.451
 1066   1HZ   LYS 152          1HZ       LYS 152  -2.804  11.392   2.191
 1067   2HZ   LYS 152          2HZ       LYS 152  -1.416  12.352   2.327
 1068   3HZ   LYS 152          3HZ       LYS 152  -1.308  10.789   1.681
 1069    H    VAL 153           H        VAL 153  -3.243   5.788  -2.156
 1070    HA   VAL 153           HA       VAL 153  -3.193   5.362   0.747
 1071    HB   VAL 153           HB       VAL 153  -5.329   4.616   0.291
 1072   1HG1  VAL 153          1HG1      VAL 153  -4.353   3.517  -2.338
 1073   2HG1  VAL 153          2HG1      VAL 153  -5.315   4.977  -2.099
 1074   3HG1  VAL 153          3HG1      VAL 153  -6.005   3.396  -1.729
 1075   1HG2  VAL 153          1HG2      VAL 153  -4.116   2.785   1.329
 1076   2HG2  VAL 153          2HG2      VAL 153  -3.661   2.166  -0.258
 1077   3HG2  VAL 153          3HG2      VAL 153  -5.355   2.169   0.237
 1078    H    THR 154           H        THR 154  -0.960   5.141   0.833
 1079    HA   THR 154           HA       THR 154   0.318   2.993  -0.572
 1080    HB   THR 154           HB       THR 154   2.185   3.450   0.989
 1081    HG1  THR 154           1HG      THR 154   1.614   4.242   2.858
 1082   1HG2  THR 154          1HG2      THR 154   2.634   5.739   0.262
 1083   2HG2  THR 154          2HG2      THR 154   0.936   5.937  -0.174
 1084   3HG2  THR 154          3HG2      THR 154   1.943   4.784  -1.051
 1085    H    TYR 155           H        TYR 155   0.227   0.809  -0.033
 1086    HA   TYR 155           HA       TYR 155  -0.313   0.261   2.799
 1087   1HB   TYR 155          2HB       TYR 155  -1.834  -1.598   2.137
 1088   2HB   TYR 155          1HB       TYR 155  -2.443   0.014   1.813
 1089    HD1  TYR 155           1HD      TYR 155  -1.513  -3.179   0.395
 1090    HD2  TYR 155           2HD      TYR 155  -2.517   0.849  -0.524
 1091    HE1  TYR 155           1HE      TYR 155  -1.928  -3.828  -1.937
 1092    HE2  TYR 155           2HE      TYR 155  -2.945   0.214  -2.864
 1093    HH   TYR 155           HH       TYR 155  -3.083  -3.099  -3.870
 1094    H    PHE 156           H        PHE 156   0.908  -1.168   3.724
 1095    HA   PHE 156           HA       PHE 156   3.053  -2.404   2.313
 1096   1HB   PHE 156          2HB       PHE 156   2.144  -2.312   5.151
 1097   2HB   PHE 156          1HB       PHE 156   3.254  -3.592   4.679
 1098    HD1  PHE 156           1HD      PHE 156   5.465  -2.999   3.727
 1099    HD2  PHE 156           2HD      PHE 156   2.883  -0.109   5.484
 1100    HE1  PHE 156           1HE      PHE 156   7.371  -1.468   3.994
 1101    HE2  PHE 156           2HE      PHE 156   4.784   1.427   5.751
 1102    HZ   PHE 156           HZ       PHE 156   7.031   0.751   5.006
 1103    H    MET 157           H        MET 157   3.200  -4.351   1.472
 1104    HA   MET 157           HA       MET 157   1.144  -6.327   2.166
 1105   1HB   MET 157          2HB       MET 157   1.978  -7.162  -0.284
 1106   2HB   MET 157          1HB       MET 157   0.562  -6.163   0.006
 1107   1HG   MET 157          2HG       MET 157   1.923  -5.304  -1.818
 1108   2HG   MET 157          1HG       MET 157   1.830  -4.166  -0.478
 1109   1HE   MET 157          1HE       MET 157   5.403  -3.477  -1.887
 1110   2HE   MET 157          2HE       MET 157   3.835  -2.784  -1.471
 1111   3HE   MET 157          3HE       MET 157   3.973  -3.901  -2.829
 1112    H    LYS 158           H        LYS 158   1.772  -8.515   2.178
 1113    HA   LYS 158           HA       LYS 158   4.256  -8.923   3.495
 1114   1HB   LYS 158          2HB       LYS 158   2.243 -10.151   4.117
 1115   2HB   LYS 158          1HB       LYS 158   2.171 -10.885   2.523
 1116   1HG   LYS 158          2HG       LYS 158   4.378 -11.955   3.007
 1117   2HG   LYS 158          1HG       LYS 158   4.236 -11.347   4.659
 1118   1HD   LYS 158          2HD       LYS 158   3.468 -13.661   4.508
 1119   2HD   LYS 158          1HD       LYS 158   2.141 -12.579   4.934
 1120   1HE   LYS 158          2HE       LYS 158   1.392 -12.578   2.608
 1121   2HE   LYS 158          1HE       LYS 158   2.734 -13.633   2.170
 1122   1HZ   LYS 158          1HZ       LYS 158   0.682 -14.876   2.443
 1123   2HZ   LYS 158          2HZ       LYS 158   0.529 -14.326   4.036
 1124   3HZ   LYS 158          3HZ       LYS 158   1.818 -15.339   3.618
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1 -23.790  -0.885   2.569
    2   2H    MET   1          2HT       MET   1 -25.341  -0.705   1.914
    3   3H    MET   1          3HT       MET   1 -24.921   0.123   3.335
    4    HA   MET   1           HA       MET   1 -24.926   1.599   1.417
    5   1HB   MET   1          2HB       MET   1 -23.286   1.815   3.373
    6   2HB   MET   1          1HB       MET   1 -22.084   1.085   2.320
    7   1HG   MET   1          2HG       MET   1 -21.781   3.438   2.268
    8   2HG   MET   1          1HG       MET   1 -22.454   2.945   0.714
    9   1HE   MET   1          1HE       MET   1 -22.959   5.546   0.306
   10   2HE   MET   1          2HE       MET   1 -22.405   5.983   1.923
   11   3HE   MET   1          3HE       MET   1 -23.985   6.521   1.356
   12    H    GLU   2           H        GLU   2 -21.724   0.305   0.988
   13    HA   GLU   2           HA       GLU   2 -22.523  -1.104  -1.452
   14   1HB   GLU   2          2HB       GLU   2 -20.147   0.740  -1.121
   15   2HB   GLU   2          1HB       GLU   2 -20.264  -0.445  -2.415
   16   1HG   GLU   2          2HG       GLU   2 -22.342   0.642  -3.178
   17   2HG   GLU   2          1HG       GLU   2 -22.132   1.865  -1.927
   18    H    GLN   3           H        GLN   3 -22.242  -3.162  -0.935
   19    HA   GLN   3           HA       GLN   3 -20.413  -3.811   1.227
   20   1HB   GLN   3          2HB       GLN   3 -22.315  -5.662  -0.209
   21   2HB   GLN   3          1HB       GLN   3 -21.541  -5.930   1.345
   22   1HG   GLN   3          2HG       GLN   3 -23.748  -4.006   0.678
   23   2HG   GLN   3          1HG       GLN   3 -23.789  -5.374   1.787
   24   1HE2  GLN   3          1HE2      GLN   3 -22.685  -5.199   3.791
   25   2HE2  GLN   3          2HE2      GLN   3 -22.373  -3.644   4.493
   26    H    SER   4           H        SER   4 -19.238  -5.970   1.004
   27    HA   SER   4           HA       SER   4 -17.459  -5.692  -1.225
   28   1HB   SER   4          2HB       SER   4 -16.425  -7.789  -0.048
   29   2HB   SER   4          1HB       SER   4 -16.326  -6.210   0.733
   30    HG   SER   4           HG       SER   4 -17.243  -8.309   1.849
   31    H    ALA   5           H        ALA   5 -17.592  -6.685  -3.094
   32    HA   ALA   5           HA       ALA   5 -19.388  -8.994  -3.348
   33   1HB   ALA   5          1HB       ALA   5 -19.500  -8.441  -5.724
   34   2HB   ALA   5          2HB       ALA   5 -18.363  -7.116  -5.476
   35   3HB   ALA   5          3HB       ALA   5 -19.959  -7.061  -4.727
   36    H    SER   6           H        SER   6 -16.300  -7.762  -4.621
   37    HA   SER   6           HA       SER   6 -15.524 -10.488  -5.339
   38   1HB   SER   6          2HB       SER   6 -14.113  -7.873  -5.910
   39   2HB   SER   6          1HB       SER   6 -13.762  -9.442  -6.639
   40    HG   SER   6           HG       SER   6 -16.031  -7.788  -6.989
   41    H    ASP   7           H        ASP   7 -15.581  -9.593  -2.515
   42    HA   ASP   7           HA       ASP   7 -13.016  -8.915  -1.578
   43   1HB   ASP   7          2HB       ASP   7 -13.798  -9.532   0.624
   44   2HB   ASP   7          1HB       ASP   7 -15.103  -8.717  -0.229
   45    H    SER   8           H        SER   8 -14.378 -11.965  -2.503
   46    HA   SER   8           HA       SER   8 -12.009 -13.360  -1.502
   47   1HB   SER   8          2HB       SER   8 -13.487 -15.359  -2.455
   48   2HB   SER   8          1HB       SER   8 -13.797 -14.661  -0.865
   49    HG   SER   8           HG       SER   8 -15.694 -14.156  -1.570
   50    H    ASN   9           H        ASN   9 -13.892 -12.887  -4.478
   51    HA   ASN   9           HA       ASN   9 -12.274 -14.434  -6.165
   52   1HB   ASN   9          2HB       ASN   9 -14.565 -13.632  -6.717
   53   2HB   ASN   9          1HB       ASN   9 -13.916 -12.012  -6.929
   54   1HD2  ASN   9          1HD2      ASN   9 -12.272 -14.951  -7.896
   55   2HD2  ASN   9          2HD2      ASN   9 -12.367 -14.669  -9.598
   56    H    LYS  10           H        LYS  10 -12.210 -10.907  -5.575
   57    HA   LYS  10           HA       LYS  10 -10.012 -10.492  -7.349
   58   1HB   LYS  10          2HB       LYS  10 -11.676  -8.716  -6.711
   59   2HB   LYS  10          1HB       LYS  10 -10.930  -8.663  -5.120
   60   1HG   LYS  10          2HG       LYS  10  -8.790  -8.040  -6.178
   61   2HG   LYS  10          1HG       LYS  10  -9.602  -8.012  -7.741
   62   1HD   LYS  10          2HD       LYS  10 -11.180  -6.301  -6.742
   63   2HD   LYS  10          1HD       LYS  10 -10.069  -6.210  -5.372
   64   1HE   LYS  10          2HE       LYS  10  -9.550  -4.441  -6.917
   65   2HE   LYS  10          1HE       LYS  10  -8.248  -5.631  -6.952
   66   1HZ   LYS  10          1HZ       LYS  10  -9.064  -4.764  -9.168
   67   2HZ   LYS  10          2HZ       LYS  10 -10.469  -5.671  -8.909
   68   3HZ   LYS  10          3HZ       LYS  10  -8.963  -6.449  -9.012
   69    H    SER  11           H        SER  11 -10.368 -11.047  -3.915
   70    HA   SER  11           HA       SER  11  -7.821 -10.305  -3.054
   71   1HB   SER  11          2HB       SER  11  -9.772 -10.814  -1.576
   72   2HB   SER  11          1HB       SER  11  -9.530 -12.528  -1.916
   73    HG   SER  11           HG       SER  11  -7.958 -12.554  -0.531
   74    H    GLN  12           H        GLN  12  -9.013 -13.493  -4.104
   75    HA   GLN  12           HA       GLN  12  -6.696 -14.966  -3.686
   76   1HB   GLN  12          2HB       GLN  12  -8.839 -15.259  -5.792
   77   2HB   GLN  12          1HB       GLN  12  -7.580 -16.455  -5.515
   78   1HG   GLN  12          2HG       GLN  12  -8.384 -16.848  -3.281
   79   2HG   GLN  12          1HG       GLN  12  -9.573 -15.557  -3.447
   80   1HE2  GLN  12          1HE2      GLN  12 -11.260 -16.998  -3.010
   81   2HE2  GLN  12          2HE2      GLN  12 -11.811 -18.132  -4.194
   82    H    ASN  13           H        ASN  13  -7.698 -13.203  -6.602
   83    HA   ASN  13           HA       ASN  13  -5.415 -14.002  -8.107
   84   1HB   ASN  13          2HB       ASN  13  -7.493 -11.861  -8.581
   85   2HB   ASN  13          1HB       ASN  13  -6.212 -12.244  -9.729
   86   1HD2  ASN  13          1HD2      ASN  13  -9.206 -13.272  -8.323
   87   2HD2  ASN  13          2HD2      ASN  13  -9.485 -14.611  -9.390
   88    H    ALA  14           H        ALA  14  -6.213 -11.187  -6.163
   89    HA   ALA  14           HA       ALA  14  -3.999  -9.611  -7.039
   90   1HB   ALA  14          1HB       ALA  14  -6.034  -8.606  -6.110
   91   2HB   ALA  14          2HB       ALA  14  -4.595  -8.108  -5.221
   92   3HB   ALA  14          3HB       ALA  14  -5.672  -9.329  -4.544
   93    H    ILE  15           H        ILE  15  -4.637 -11.591  -4.147
   94    HA   ILE  15           HA       ILE  15  -2.178 -11.045  -2.876
   95    HB   ILE  15           HB       ILE  15  -4.027 -13.416  -2.586
   96   1HG1  ILE  15          2HG1      ILE  15  -5.006 -11.276  -1.915
   97   2HG1  ILE  15          1HG1      ILE  15  -4.717 -12.288  -0.506
   98   1HG2  ILE  15          1HG2      ILE  15  -1.694 -12.640  -0.838
   99   2HG2  ILE  15          2HG2      ILE  15  -1.762 -14.040  -1.910
  100   3HG2  ILE  15          3HG2      ILE  15  -2.842 -13.942  -0.519
  101   1HD1  ILE  15          1HD1      ILE  15  -2.982 -10.004  -1.415
  102   2HD1  ILE  15          2HD1      ILE  15  -2.710 -11.009   0.008
  103   3HD1  ILE  15          3HD1      ILE  15  -4.132  -9.969  -0.080
  104    H    SER  16           H        SER  16  -3.166 -13.621  -5.109
  105    HA   SER  16           HA       SER  16  -0.849 -15.159  -5.028
  106   1HB   SER  16          2HB       SER  16  -2.931 -15.817  -6.199
  107   2HB   SER  16          1HB       SER  16  -2.599 -14.611  -7.439
  108    HG   SER  16           HG       SER  16  -1.784 -16.445  -8.261
  109    H    GLU  17           H        GLU  17  -1.473 -12.108  -6.602
  110    HA   GLU  17           HA       GLU  17   0.812 -12.134  -8.309
  111   1HB   GLU  17          2HB       GLU  17  -1.247 -10.735  -8.649
  112   2HB   GLU  17          1HB       GLU  17  -0.734  -9.744  -7.290
  113   1HG   GLU  17          2HG       GLU  17  -0.132  -8.666  -9.349
  114   2HG   GLU  17          1HG       GLU  17   1.330  -9.189  -8.511
  115    H    VAL  18           H        VAL  18   0.069 -10.443  -5.262
  116    HA   VAL  18           HA       VAL  18   2.678  -9.294  -5.110
  117    HB   VAL  18           HB       VAL  18   1.989  -8.479  -2.880
  118   1HG1  VAL  18          1HG1      VAL  18   0.149  -7.052  -3.669
  119   2HG1  VAL  18          2HG1      VAL  18  -0.044  -8.101  -5.074
  120   3HG1  VAL  18          3HG1      VAL  18   1.448  -7.188  -4.856
  121   1HG2  VAL  18          1HG2      VAL  18  -0.305  -8.862  -2.100
  122   2HG2  VAL  18          2HG2      VAL  18   0.618 -10.364  -2.166
  123   3HG2  VAL  18          3HG2      VAL  18  -0.561  -9.999  -3.425
  124    H    MET  19           H        MET  19   1.125 -12.078  -3.610
  125    HA   MET  19           HA       MET  19   3.060 -12.617  -1.646
  126   1HB   MET  19          2HB       MET  19   0.803 -13.610  -1.673
  127   2HB   MET  19          1HB       MET  19   1.233 -14.547  -3.094
  128   1HG   MET  19          2HG       MET  19   2.981 -15.682  -1.753
  129   2HG   MET  19          1HG       MET  19   2.407 -14.807  -0.336
  130   1HE   MET  19          1HE       MET  19   2.660 -18.010  -0.573
  131   2HE   MET  19          2HE       MET  19   1.171 -18.505   0.236
  132   3HE   MET  19          3HE       MET  19   2.133 -17.179   0.892
  133    H    SER  20           H        SER  20   2.990 -13.227  -5.058
  134    HA   SER  20           HA       SER  20   5.154 -15.126  -5.027
  135   1HB   SER  20          2HB       SER  20   3.963 -13.553  -7.328
  136   2HB   SER  20          1HB       SER  20   5.088 -14.901  -7.478
  137    HG   SER  20           HG       SER  20   2.375 -14.897  -6.766
  138    H    ALA  21           H        ALA  21   4.784 -11.677  -5.238
  139    HA   ALA  21           HA       ALA  21   7.469 -11.227  -6.217
  140   1HB   ALA  21          1HB       ALA  21   5.604  -9.757  -6.881
  141   2HB   ALA  21          2HB       ALA  21   6.918  -8.872  -6.104
  142   3HB   ALA  21          3HB       ALA  21   5.444  -9.233  -5.205
  143    H    THR  22           H        THR  22   5.698 -10.940  -3.166
  144    HA   THR  22           HA       THR  22   7.719  -9.661  -1.684
  145    HB   THR  22           HB       THR  22   6.535 -10.656   0.319
  146    HG1  THR  22           1HG      THR  22   4.308 -11.484  -0.633
  147   1HG2  THR  22          1HG2      THR  22   4.425  -9.383  -0.078
  148   2HG2  THR  22          2HG2      THR  22   4.913  -9.188  -1.761
  149   3HG2  THR  22          3HG2      THR  22   5.886  -8.478  -0.473
  150    H    SER  23           H        SER  23   6.914 -13.100  -2.032
  151    HA   SER  23           HA       SER  23   8.941 -14.056  -0.333
  152   1HB   SER  23          2HB       SER  23   8.544 -16.235  -1.612
  153   2HB   SER  23          1HB       SER  23   7.145 -15.522  -0.805
  154    HG   SER  23           HG       SER  23   6.286 -14.981  -2.700
  155    H    ALA  24           H        ALA  24   8.870 -13.399  -3.792
  156    HA   ALA  24           HA       ALA  24  11.393 -14.559  -4.376
  157   1HB   ALA  24          1HB       ALA  24   9.858 -12.466  -5.908
  158   2HB   ALA  24          2HB       ALA  24   9.697 -14.210  -6.098
  159   3HB   ALA  24          3HB       ALA  24  11.211 -13.414  -6.521
  160    H    ILE  25           H        ILE  25  10.345 -11.246  -3.652
  161    HA   ILE  25           HA       ILE  25  12.849 -10.048  -4.194
  162    HB   ILE  25           HB       ILE  25  10.532  -8.922  -3.982
  163   1HG1  ILE  25          2HG1      ILE  25  11.582  -6.767  -3.323
  164   2HG1  ILE  25          1HG1      ILE  25  13.005  -7.658  -2.792
  165   1HG2  ILE  25          1HG2      ILE  25  10.080  -7.881  -1.808
  166   2HG2  ILE  25          2HG2      ILE  25  11.411  -8.801  -1.102
  167   3HG2  ILE  25          3HG2      ILE  25   9.991  -9.641  -1.730
  168   1HD1  ILE  25          1HD1      ILE  25  11.935  -7.619  -5.604
  169   2HD1  ILE  25          2HD1      ILE  25  13.406  -8.418  -5.048
  170   3HD1  ILE  25          3HD1      ILE  25  13.289  -6.660  -5.007
  171    H    ASN  26           H        ASN  26  11.512 -11.607  -1.364
  172    HA   ASN  26           HA       ASN  26  13.365 -10.675   0.542
  173   1HB   ASN  26          2HB       ASN  26  11.680 -13.167   0.392
  174   2HB   ASN  26          1HB       ASN  26  12.796 -12.893   1.726
  175   1HD2  ASN  26          1HD2      ASN  26   9.916 -13.108   1.816
  176   2HD2  ASN  26          2HD2      ASN  26   9.332 -11.618   2.463
  177    H    GLY  27           H        GLY  27  13.476 -13.311  -1.770
  178   1HA   GLY  27          2HA       GLY  27  15.849 -14.522  -0.786
  179   2HA   GLY  27          1HA       GLY  27  15.171 -14.733  -2.393
  180    H    LEU  28           H        LEU  28  15.271 -11.705  -2.678
  181    HA   LEU  28           HA       LEU  28  17.976 -11.622  -3.734
  182   1HB   LEU  28          2HB       LEU  28  15.730  -9.614  -3.932
  183   2HB   LEU  28          1HB       LEU  28  17.254  -9.530  -4.797
  184    HG   LEU  28           HG       LEU  28  15.175 -11.692  -5.140
  185   1HD1  LEU  28          1HD1      LEU  28  14.432  -9.526  -6.008
  186   2HD1  LEU  28          2HD1      LEU  28  14.751 -10.674  -7.308
  187   3HD1  LEU  28          3HD1      LEU  28  15.916  -9.398  -6.951
  188   1HD2  LEU  28          1HD2      LEU  28  16.542 -12.382  -7.043
  189   2HD2  LEU  28          2HD2      LEU  28  17.448 -12.483  -5.534
  190   3HD2  LEU  28          3HD2      LEU  28  17.729 -11.143  -6.645
  191    H    TYR  29           H        TYR  29  16.140 -10.384  -1.089
  192    HA   TYR  29           HA       TYR  29  18.291  -8.484  -0.437
  193   1HB   TYR  29          2HB       TYR  29  15.347  -8.438   0.198
  194   2HB   TYR  29          1HB       TYR  29  16.502  -7.412   1.038
  195    HD1  TYR  29           1HD      TYR  29  15.273  -8.252  -2.378
  196    HD2  TYR  29           2HD      TYR  29  17.076  -5.330   0.135
  197    HE1  TYR  29           1HE      TYR  29  15.101  -6.599  -4.188
  198    HE2  TYR  29           2HE      TYR  29  16.906  -3.669  -1.668
  199    HH   TYR  29           HH       TYR  29  16.757  -3.639  -4.132
  200    H    ILE  30           H        ILE  30  18.254 -11.361   0.213
  201    HA   ILE  30           HA       ILE  30  17.685 -11.742   2.954
  202    HB   ILE  30           HB       ILE  30  19.753 -13.163   1.263
  203   1HG1  ILE  30          2HG1      ILE  30  16.892 -13.904   1.918
  204   2HG1  ILE  30          1HG1      ILE  30  17.475 -13.350   0.352
  205   1HG2  ILE  30          1HG2      ILE  30  20.198 -13.471   3.622
  206   2HG2  ILE  30          2HG2      ILE  30  19.548 -14.962   2.941
  207   3HG2  ILE  30          3HG2      ILE  30  18.516 -13.913   3.911
  208   1HD1  ILE  30          1HD1      ILE  30  18.307 -15.886   1.740
  209   2HD1  ILE  30          2HD1      ILE  30  18.860 -15.338   0.157
  210   3HD1  ILE  30          3HD1      ILE  30  17.166 -15.761   0.402
  211    H    GLY  31           H        GLY  31  20.669 -10.860   1.239
  212   1HA   GLY  31          2HA       GLY  31  22.303 -10.640   3.548
  213   2HA   GLY  31          1HA       GLY  31  22.628  -9.911   1.981
  214    H    GLN  32           H        GLN  32  19.999  -8.529   2.086
  215    HA   GLN  32           HA       GLN  32  20.830  -6.142   3.426
  216   1HB   GLN  32          2HB       GLN  32  18.144  -6.828   2.226
  217   2HB   GLN  32          1HB       GLN  32  18.709  -5.220   2.656
  218   1HG   GLN  32          2HG       GLN  32  20.310  -6.801   0.738
  219   2HG   GLN  32          1HG       GLN  32  18.782  -6.113   0.200
  220   1HE2  GLN  32          1HE2      GLN  32  19.890  -4.779  -1.242
  221   2HE2  GLN  32          2HE2      GLN  32  20.737  -3.364  -0.709
  222    H    THR  33           H        THR  33  18.251  -8.492   3.828
  223    HA   THR  33           HA       THR  33  16.937  -9.101   5.572
  224    HB   THR  33           HB       THR  33  18.817  -7.464   7.290
  225    HG1  THR  33           1HG      THR  33  19.135  -9.821   6.002
  226   1HG2  THR  33          1HG2      THR  33  16.653  -7.929   8.370
  227   2HG2  THR  33          2HG2      THR  33  17.969  -8.818   9.138
  228   3HG2  THR  33          3HG2      THR  33  16.869  -9.648   8.038
  229    H    SER  34           H        SER  34  17.941  -5.728   6.113
  230    HA   SER  34           HA       SER  34  15.134  -4.993   6.523
  231   1HB   SER  34          2HB       SER  34  17.640  -3.401   7.100
  232   2HB   SER  34          1HB       SER  34  15.998  -2.993   7.597
  233    HG   SER  34           HG       SER  34  16.069  -4.462   9.139
  234    H    TYR  35           H        TYR  35  16.869  -5.348   3.900
  235    HA   TYR  35           HA       TYR  35  16.923  -4.429   1.815
  236   1HB   TYR  35          2HB       TYR  35  14.625  -2.688   2.740
  237   2HB   TYR  35          1HB       TYR  35  15.029  -3.118   1.086
  238    HD1  TYR  35           1HD      TYR  35  14.183  -5.124   0.110
  239    HD2  TYR  35           2HD      TYR  35  13.687  -4.417   4.273
  240    HE1  TYR  35           1HE      TYR  35  12.572  -6.980   0.232
  241    HE2  TYR  35           2HE      TYR  35  12.091  -6.268   4.408
  242    HH   TYR  35           HH       TYR  35  11.673  -8.556   1.995
  243    H    SER  36           H        SER  36  18.630  -3.319   3.759
  244    HA   SER  36           HA       SER  36  18.496  -0.608   4.253
  245   1HB   SER  36          2HB       SER  36  20.026  -2.220   5.362
  246   2HB   SER  36          1HB       SER  36  21.010  -2.253   3.897
  247    HG   SER  36           HG       SER  36  21.490  -0.717   5.788
  248    H    GLY  37           H        GLY  37  19.740  -2.251   1.405
  249   1HA   GLY  37          2HA       GLY  37  21.178  -0.161   0.236
  250   2HA   GLY  37          1HA       GLY  37  20.398  -1.464  -0.648
  251    H    LEU  38           H        LEU  38  17.728  -0.686   0.389
  252    HA   LEU  38           HA       LEU  38  17.203   1.458  -1.518
  253   1HB   LEU  38          2HB       LEU  38  15.291  -0.223   0.110
  254   2HB   LEU  38          1HB       LEU  38  14.835   0.916  -1.140
  255    HG   LEU  38           HG       LEU  38  16.392  -1.637  -1.554
  256   1HD1  LEU  38          1HD1      LEU  38  14.047  -2.030  -1.045
  257   2HD1  LEU  38          2HD1      LEU  38  14.378  -2.368  -2.745
  258   3HD1  LEU  38          3HD1      LEU  38  13.568  -0.869  -2.286
  259   1HD2  LEU  38          1HD2      LEU  38  15.413   0.417  -3.536
  260   2HD2  LEU  38          2HD2      LEU  38  16.123  -1.145  -3.946
  261   3HD2  LEU  38          3HD2      LEU  38  17.093   0.078  -3.126
  262    H    ASP  39           H        ASP  39  17.142   0.783   1.899
  263    HA   ASP  39           HA       ASP  39  15.409   2.761   2.799
  264   1HB   ASP  39          2HB       ASP  39  16.217   0.887   4.182
  265   2HB   ASP  39          1HB       ASP  39  17.817   1.621   4.234
  266    H    SER  40           H        SER  40  18.961   2.873   2.671
  267    HA   SER  40           HA       SER  40  19.092   5.533   3.616
  268   1HB   SER  40          2HB       SER  40  20.923   3.829   3.798
  269   2HB   SER  40          1HB       SER  40  21.211   4.023   2.070
  270    HG   SER  40           HG       SER  40  22.195   5.860   2.432
  271    H    THR  41           H        THR  41  19.134   4.135   0.361
  272    HA   THR  41           HA       THR  41  20.038   6.494  -0.929
  273    HB   THR  41           HB       THR  41  19.222   5.278  -3.024
  274    HG1  THR  41           1HG      THR  41  19.151   2.854  -1.824
  275   1HG2  THR  41          1HG2      THR  41  21.170   3.904  -1.167
  276   2HG2  THR  41          2HG2      THR  41  21.544   5.214  -2.287
  277   3HG2  THR  41          3HG2      THR  41  21.057   3.637  -2.906
  278    H    ILE  42           H        ILE  42  16.814   4.955  -0.834
  279    HA   ILE  42           HA       ILE  42  15.566   6.879  -2.474
  280    HB   ILE  42           HB       ILE  42  14.300   5.076  -0.404
  281   1HG1  ILE  42          2HG1      ILE  42  15.611   3.837  -2.079
  282   2HG1  ILE  42          1HG1      ILE  42  13.887   3.540  -2.267
  283   1HG2  ILE  42          1HG2      ILE  42  13.068   6.489  -2.765
  284   2HG2  ILE  42          2HG2      ILE  42  12.809   6.880  -1.066
  285   3HG2  ILE  42          3HG2      ILE  42  12.247   5.339  -1.711
  286   1HD1  ILE  42          1HD1      ILE  42  14.982   3.804  -4.413
  287   2HD1  ILE  42          2HD1      ILE  42  15.551   5.404  -3.940
  288   3HD1  ILE  42          3HD1      ILE  42  13.824   5.104  -4.137
  289    H    LEU  43           H        LEU  43  15.975   6.658   1.002
  290    HA   LEU  43           HA       LEU  43  14.042   8.571   1.732
  291   1HB   LEU  43          2HB       LEU  43  14.923   6.898   3.258
  292   2HB   LEU  43          1HB       LEU  43  16.508   7.645   3.193
  293    HG   LEU  43           HG       LEU  43  15.411   9.726   4.164
  294   1HD1  LEU  43          1HD1      LEU  43  13.220   7.747   4.764
  295   2HD1  LEU  43          2HD1      LEU  43  13.100   9.121   3.667
  296   3HD1  LEU  43          3HD1      LEU  43  13.338   9.390   5.394
  297   1HD2  LEU  43          1HD2      LEU  43  15.477   7.202   5.814
  298   2HD2  LEU  43          2HD2      LEU  43  15.513   8.848   6.446
  299   3HD2  LEU  43          3HD2      LEU  43  16.852   8.251   5.463
  300    H    LEU  44           H        LEU  44  17.616   8.913   1.732
  301    HA   LEU  44           HA       LEU  44  17.422  11.677   2.368
  302   1HB   LEU  44          2HB       LEU  44  19.869  11.735   2.018
  303   2HB   LEU  44          1HB       LEU  44  19.337  10.499   3.136
  304    HG   LEU  44           HG       LEU  44  19.526   8.887   1.124
  305   1HD1  LEU  44          1HD1      LEU  44  21.189   9.513  -0.542
  306   2HD1  LEU  44          2HD1      LEU  44  21.272  11.138   0.139
  307   3HD1  LEU  44          3HD1      LEU  44  19.781  10.573  -0.619
  308   1HD2  LEU  44          1HD2      LEU  44  21.997  10.103   2.348
  309   2HD2  LEU  44          2HD2      LEU  44  21.880   8.507   1.607
  310   3HD2  LEU  44          3HD2      LEU  44  20.983   8.862   3.082
  311    H    ASN  45           H        ASN  45  17.114  10.049  -0.563
  312    HA   ASN  45           HA       ASN  45  18.276  11.855  -2.373
  313   1HB   ASN  45          2HB       ASN  45  17.494   9.627  -3.057
  314   2HB   ASN  45          1HB       ASN  45  15.828  10.116  -2.740
  315   1HD2  ASN  45          1HD2      ASN  45  15.089   9.867  -4.802
  316   2HD2  ASN  45          2HD2      ASN  45  15.603  10.852  -6.129
  317    H    THR  46           H        THR  46  14.824  11.526  -1.557
  318    HA   THR  46           HA       THR  46  14.345  14.109  -2.805
  319    HB   THR  46           HB       THR  46  12.346  12.124  -1.700
  320    HG1  THR  46           1HG      THR  46  13.079  11.039  -3.408
  321   1HG2  THR  46          1HG2      THR  46  12.006  14.462  -3.588
  322   2HG2  THR  46          2HG2      THR  46  11.452  14.391  -1.915
  323   3HG2  THR  46          3HG2      THR  46  10.741  13.322  -3.125
  324    H    SER  47           H        SER  47  15.057  15.611  -1.353
  325    HA   SER  47           HA       SER  47  14.911  17.092   0.365
  326   1HB   SER  47          2HB       SER  47  12.081  16.036   0.479
  327   2HB   SER  47          1HB       SER  47  12.637  17.576   1.138
  328    HG   SER  47           HG       SER  47  13.358  17.291  -1.464
  329    H    ALA  48           H        ALA  48  15.654  14.268   1.036
  330    HA   ALA  48           HA       ALA  48  16.291  13.081   2.859
  331   1HB   ALA  48          1HB       ALA  48  15.242  15.373   4.509
  332   2HB   ALA  48          2HB       ALA  48  16.872  15.247   3.854
  333   3HB   ALA  48          3HB       ALA  48  16.315  14.085   5.056
  334    H    ILE  49           H        ILE  49  13.060  14.341   2.766
  335    HA   ILE  49           HA       ILE  49  12.079  11.789   3.854
  336    HB   ILE  49           HB       ILE  49  10.711  14.459   4.234
  337   1HG1  ILE  49          2HG1      ILE  49  12.173  12.800   6.305
  338   2HG1  ILE  49          1HG1      ILE  49  12.807  14.273   5.578
  339   1HG2  ILE  49          1HG2      ILE  49   9.193  12.560   4.110
  340   2HG2  ILE  49          2HG2      ILE  49   9.235  13.221   5.744
  341   3HG2  ILE  49          3HG2      ILE  49  10.107  11.733   5.372
  342   1HD1  ILE  49          1HD1      ILE  49  11.884  14.685   7.789
  343   2HD1  ILE  49          2HD1      ILE  49  10.316  14.074   7.258
  344   3HD1  ILE  49          3HD1      ILE  49  10.975  15.548   6.548
  345    HA   PRO  50           HA       PRO  50  10.601  11.894  -0.414
  346   1HB   PRO  50          2HB       PRO  50   9.367   9.338   0.495
  347   2HB   PRO  50          1HB       PRO  50  10.387   9.669  -0.912
  348   1HG   PRO  50          2HG       PRO  50  11.378   8.382   1.188
  349   2HG   PRO  50          1HG       PRO  50  12.353   9.575   0.308
  350   1HD   PRO  50          2HD       PRO  50  10.919   9.854   2.920
  351   2HD   PRO  50          1HD       PRO  50  12.521  10.454   2.444
  352    H    ASP  51           H        ASP  51   9.020  13.312  -0.692
  353    HA   ASP  51           HA       ASP  51   6.679  13.398   0.972
  354   1HB   ASP  51          2HB       ASP  51   7.839  15.429   0.082
  355   2HB   ASP  51          1HB       ASP  51   7.301  14.979  -1.532
  356    H    ASN  52           H        ASN  52   7.528  11.610  -1.677
  357    HA   ASN  52           HA       ASN  52   5.162  11.775  -3.262
  358   1HB   ASN  52          2HB       ASN  52   6.136   9.795  -4.442
  359   2HB   ASN  52          1HB       ASN  52   7.218  11.182  -4.345
  360   1HD2  ASN  52          1HD2      ASN  52   6.636   7.927  -3.342
  361   2HD2  ASN  52          2HD2      ASN  52   8.172   7.662  -2.599
  362    H    TYR  53           H        TYR  53   5.601  10.468  -0.304
  363    HA   TYR  53           HA       TYR  53   4.241   7.965  -0.501
  364   1HB   TYR  53          2HB       TYR  53   4.656   9.823   1.853
  365   2HB   TYR  53          1HB       TYR  53   4.038   8.185   1.963
  366    HD1  TYR  53           1HD      TYR  53   6.045   7.288  -0.359
  367    HD2  TYR  53           2HD      TYR  53   6.463   9.223   3.403
  368    HE1  TYR  53           1HE      TYR  53   8.333   6.418  -0.176
  369    HE2  TYR  53           2HE      TYR  53   8.755   8.354   3.598
  370    HH   TYR  53           HH       TYR  53  10.121   6.528   2.708
  371    H    LYS  54           H        LYS  54   3.149  10.924  -1.169
  372    HA   LYS  54           HA       LYS  54   0.402  10.082  -0.965
  373   1HB   LYS  54          2HB       LYS  54  -0.242  12.273   0.145
  374   2HB   LYS  54          1HB       LYS  54   0.542  11.087   1.183
  375   1HG   LYS  54          2HG       LYS  54   2.591  12.265   1.147
  376   2HG   LYS  54          1HG       LYS  54   2.044  13.312  -0.162
  377   1HD   LYS  54          2HD       LYS  54   0.376  14.298   1.329
  378   2HD   LYS  54          1HD       LYS  54   0.934  13.250   2.640
  379   1HE   LYS  54          2HE       LYS  54   1.906  15.509   2.787
  380   2HE   LYS  54          1HE       LYS  54   3.136  14.265   2.558
  381   1HZ   LYS  54          1HZ       LYS  54   3.730  15.958   1.092
  382   2HZ   LYS  54          2HZ       LYS  54   2.134  16.243   0.598
  383   3HZ   LYS  54          3HZ       LYS  54   2.941  14.838   0.100
  384    H    ASP  55           H        ASP  55  -0.341  10.546  -2.973
  385    HA   ASP  55           HA       ASP  55   0.809  12.663  -4.544
  386   1HB   ASP  55          2HB       ASP  55   0.064  10.706  -5.750
  387   2HB   ASP  55          1HB       ASP  55  -1.552  10.846  -5.058
  388    H    THR  56           H        THR  56  -0.169  14.598  -5.108
  389    HA   THR  56           HA       THR  56  -2.252  15.416  -3.208
  390    HB   THR  56           HB       THR  56  -0.101  16.632  -3.038
  391    HG1  THR  56           1HG      THR  56  -2.467  17.990  -3.801
  392   1HG2  THR  56          1HG2      THR  56  -0.751  17.576  -5.833
  393   2HG2  THR  56          2HG2      THR  56   0.596  16.537  -5.372
  394   3HG2  THR  56          3HG2      THR  56   0.541  18.207  -4.814
  395    H    THR  57           H        THR  57  -2.074  14.334  -6.229
  396    HA   THR  57           HA       THR  57  -3.763  16.356  -7.481
  397    HB   THR  57           HB       THR  57  -2.965  13.719  -8.698
  398    HG1  THR  57           1HG      THR  57  -0.990  14.482  -8.212
  399   1HG2  THR  57          1HG2      THR  57  -3.535  16.449  -9.865
  400   2HG2  THR  57          2HG2      THR  57  -4.608  15.048  -9.914
  401   3HG2  THR  57          3HG2      THR  57  -3.075  15.017 -10.790
  402    H    ASN  58           H        ASN  58  -3.843  12.826  -6.975
  403    HA   ASN  58           HA       ASN  58  -6.071  12.409  -5.562
  404   1HB   ASN  58          2HB       ASN  58  -7.984  12.107  -7.019
  405   2HB   ASN  58          1HB       ASN  58  -7.397  13.755  -7.165
  406   1HD2  ASN  58          1HD2      ASN  58  -9.055  12.251  -8.964
  407   2HD2  ASN  58          2HD2      ASN  58  -8.226  12.206 -10.484
  408    H    LYS  59           H        LYS  59  -3.572  11.184  -6.939
  409    HA   LYS  59           HA       LYS  59  -4.636   8.507  -7.068
  410   1HB   LYS  59          2HB       LYS  59  -3.343   8.362  -9.439
  411   2HB   LYS  59          1HB       LYS  59  -5.076   8.584  -9.255
  412   1HG   LYS  59          2HG       LYS  59  -4.398  10.152 -10.854
  413   2HG   LYS  59          1HG       LYS  59  -4.652  11.064  -9.371
  414   1HD   LYS  59          2HD       LYS  59  -2.662  11.879 -10.393
  415   2HD   LYS  59          1HD       LYS  59  -2.185  10.946  -8.974
  416   1HE   LYS  59          2HE       LYS  59  -1.486   9.114 -10.302
  417   2HE   LYS  59          1HE       LYS  59  -2.259   9.771 -11.744
  418   1HZ   LYS  59          1HZ       LYS  59  -0.661  11.540 -11.801
  419   2HZ   LYS  59          2HZ       LYS  59   0.169  10.064 -11.730
  420   3HZ   LYS  59          3HZ       LYS  59   0.042  11.033 -10.344
  421    H    LYS  60           H        LYS  60  -3.171   8.183  -5.303
  422    HA   LYS  60           HA       LYS  60  -0.741   7.025  -6.436
  423   1HB   LYS  60          2HB       LYS  60  -0.096   9.228  -5.375
  424   2HB   LYS  60          1HB       LYS  60  -0.604   8.558  -3.836
  425   1HG   LYS  60          2HG       LYS  60   1.507   7.222  -5.519
  426   2HG   LYS  60          1HG       LYS  60   1.893   8.523  -4.396
  427   1HD   LYS  60          2HD       LYS  60   0.526   5.944  -3.635
  428   2HD   LYS  60          1HD       LYS  60   2.254   6.261  -3.461
  429   1HE   LYS  60          2HE       LYS  60   1.609   8.265  -2.063
  430   2HE   LYS  60          1HE       LYS  60  -0.033   7.624  -2.062
  431   1HZ   LYS  60          1HZ       LYS  60   0.833   5.585  -1.047
  432   2HZ   LYS  60          2HZ       LYS  60   1.142   6.942  -0.088
  433   3HZ   LYS  60          3HZ       LYS  60   2.386   6.254  -1.002
  434    H    ILE  61           H        ILE  61  -0.687   4.973  -5.933
  435    HA   ILE  61           HA       ILE  61  -1.569   4.131  -3.254
  436    HB   ILE  61           HB       ILE  61  -2.168   1.901  -4.345
  437   1HG1  ILE  61          2HG1      ILE  61  -2.330   3.666  -6.799
  438   2HG1  ILE  61          1HG1      ILE  61  -1.193   2.344  -6.554
  439   1HG2  ILE  61          1HG2      ILE  61  -3.903   4.303  -4.874
  440   2HG2  ILE  61          2HG2      ILE  61  -3.806   3.394  -3.365
  441   3HG2  ILE  61          3HG2      ILE  61  -4.451   2.626  -4.817
  442   1HD1  ILE  61          1HD1      ILE  61  -4.187   2.086  -6.729
  443   2HD1  ILE  61          2HD1      ILE  61  -3.048   0.761  -6.487
  444   3HD1  ILE  61          3HD1      ILE  61  -3.031   1.676  -7.994
  445    H    THR  62           H        THR  62  -0.117   2.994  -2.182
  446    HA   THR  62           HA       THR  62   2.380   2.381  -3.557
  447    HB   THR  62           HB       THR  62   1.744   2.317  -0.604
  448    HG1  THR  62           1HG      THR  62   3.410   4.228  -1.049
  449   1HG2  THR  62          1HG2      THR  62   3.583   0.847  -1.155
  450   2HG2  THR  62          2HG2      THR  62   4.182   2.290  -0.334
  451   3HG2  THR  62          3HG2      THR  62   4.360   2.132  -2.080
  452    H    ASN  63           H        ASN  63   2.570   0.477  -4.416
  453    HA   ASN  63           HA       ASN  63   2.477  -2.009  -3.356
  454   1HB   ASN  63          2HB       ASN  63   0.207  -1.912  -2.666
  455   2HB   ASN  63          1HB       ASN  63  -0.302  -1.152  -4.169
  456   1HD2  ASN  63          1HD2      ASN  63   0.557  -4.131  -2.612
  457   2HD2  ASN  63          2HD2      ASN  63  -0.008  -5.180  -3.860
  458    HA   PRO  64           HA       PRO  64   1.330  -2.530  -8.013
  459   1HB   PRO  64          2HB       PRO  64   1.220   0.204  -9.104
  460   2HB   PRO  64          1HB       PRO  64   0.076  -1.133  -9.286
  461   1HG   PRO  64          2HG       PRO  64  -0.491   1.009  -7.790
  462   2HG   PRO  64          1HG       PRO  64  -1.031  -0.619  -7.348
  463   1HD   PRO  64          2HD       PRO  64   1.287   0.961  -6.288
  464   2HD   PRO  64          1HD       PRO  64   0.097  -0.004  -5.376
  465    H    PHE  65           H        PHE  65   2.655  -2.805  -9.719
  466    HA   PHE  65           HA       PHE  65   5.017  -1.072  -9.958
  467   1HB   PHE  65          2HB       PHE  65   6.073  -3.232 -10.986
  468   2HB   PHE  65          1HB       PHE  65   5.995  -3.063  -9.237
  469    HD1  PHE  65           1HD      PHE  65   4.650  -4.532  -7.911
  470    HD2  PHE  65           2HD      PHE  65   4.534  -4.740 -12.160
  471    HE1  PHE  65           1HE      PHE  65   3.457  -6.677  -7.771
  472    HE2  PHE  65           2HE      PHE  65   3.343  -6.890 -12.027
  473    HZ   PHE  65           HZ       PHE  65   2.792  -7.851  -9.785
  474    H    GLY  66           H        GLY  66   2.283  -1.129 -11.142
  475   1HA   GLY  66          2HA       GLY  66   2.866  -1.763 -13.955
  476   2HA   GLY  66          1HA       GLY  66   1.266  -1.686 -13.225
  477    H    GLY  67           H        GLY  67   3.654   0.769 -12.574
  478   1HA   GLY  67          2HA       GLY  67   2.739   2.599 -14.582
  479   2HA   GLY  67          1HA       GLY  67   2.059   2.938 -12.990
  480    H    GLU  68           H        GLU  68   3.168   4.804 -12.506
  481    HA   GLU  68           HA       GLU  68   6.071   4.811 -12.635
  482   1HB   GLU  68          2HB       GLU  68   4.064   6.801 -11.582
  483   2HB   GLU  68          1HB       GLU  68   5.800   7.081 -11.591
  484   1HG   GLU  68          2HG       GLU  68   4.046   6.664 -14.002
  485   2HG   GLU  68          1HG       GLU  68   4.723   8.198 -13.454
  486    H    LEU  69           H        LEU  69   6.910   3.429 -11.175
  487    HA   LEU  69           HA       LEU  69   5.810   3.407  -8.457
  488   1HB   LEU  69          2HB       LEU  69   6.917   1.241  -8.202
  489   2HB   LEU  69          1HB       LEU  69   5.824   1.264  -9.568
  490    HG   LEU  69           HG       LEU  69   8.060   1.824 -10.894
  491   1HD1  LEU  69          1HD1      LEU  69   9.948   0.555 -10.003
  492   2HD1  LEU  69          2HD1      LEU  69   9.040   0.236  -8.526
  493   3HD1  LEU  69          3HD1      LEU  69   9.502   1.889  -8.938
  494   1HD2  LEU  69          1HD2      LEU  69   6.597  -0.039 -11.367
  495   2HD2  LEU  69          2HD2      LEU  69   7.228  -0.921  -9.977
  496   3HD2  LEU  69          3HD2      LEU  69   8.274  -0.579 -11.354
  497    H    ASN  70           H        ASN  70   6.997   3.754  -6.658
  498    HA   ASN  70           HA       ASN  70   9.851   4.443  -6.976
  499   1HB   ASN  70          2HB       ASN  70   8.530   6.410  -6.339
  500   2HB   ASN  70          1HB       ASN  70   7.835   5.523  -4.984
  501   1HD2  ASN  70          1HD2      ASN  70   8.936   5.433  -3.081
  502   2HD2  ASN  70          2HD2      ASN  70  10.492   6.143  -2.829
  503    H    VAL  71           H        VAL  71  11.210   3.064  -5.944
  504    HA   VAL  71           HA       VAL  71  10.065   0.946  -4.352
  505    HB   VAL  71           HB       VAL  71  12.352   0.028  -4.256
  506   1HG1  VAL  71          1HG1      VAL  71  11.476   0.883  -7.014
  507   2HG1  VAL  71          2HG1      VAL  71  10.906  -0.535  -6.133
  508   3HG1  VAL  71          3HG1      VAL  71  12.589  -0.437  -6.650
  509   1HG2  VAL  71          1HG2      VAL  71  14.154   1.085  -5.523
  510   2HG2  VAL  71          2HG2      VAL  71  13.603   2.122  -4.205
  511   3HG2  VAL  71          3HG2      VAL  71  13.109   2.463  -5.865
  512    H    GLY  72           H        GLY  72  10.592   0.402  -2.215
  513   1HA   GLY  72          2HA       GLY  72  12.356   1.965  -0.613
  514   2HA   GLY  72          1HA       GLY  72  10.677   2.404  -0.327
  515    HA   PRO  73           HA       PRO  73  11.567  -1.593   1.994
  516   1HB   PRO  73          2HB       PRO  73  13.424  -1.139   3.819
  517   2HB   PRO  73          1HB       PRO  73  13.888  -1.388   2.131
  518   1HG   PRO  73          2HG       PRO  73  13.749   1.134   3.707
  519   2HG   PRO  73          1HG       PRO  73  14.889   0.662   2.437
  520   1HD   PRO  73          2HD       PRO  73  12.573   2.273   2.144
  521   2HD   PRO  73          1HD       PRO  73  13.594   1.624   0.844
  522    H    ALA  74           H        ALA  74  10.670  -2.189   4.022
  523    HA   ALA  74           HA       ALA  74   9.686   0.068   5.645
  524   1HB   ALA  74          1HB       ALA  74   7.876  -0.947   4.348
  525   2HB   ALA  74          2HB       ALA  74   7.645  -1.164   6.083
  526   3HB   ALA  74          3HB       ALA  74   8.224  -2.506   5.096
  527    H    ASN  75           H        ASN  75  11.591  -0.221   6.895
  528    HA   ASN  75           HA       ASN  75  12.707  -0.819   8.756
  529   1HB   ASN  75          2HB       ASN  75  10.520  -0.645   9.852
  530   2HB   ASN  75          1HB       ASN  75  10.191  -2.332   9.467
  531   1HD2  ASN  75          1HD2      ASN  75   9.989  -2.907  11.626
  532   2HD2  ASN  75          2HD2      ASN  75  11.349  -3.001  12.693
  533    H    ASN  76           H        ASN  76  10.868  -3.803   8.007
  534    HA   ASN  76           HA       ASN  76  13.319  -5.262   7.573
  535   1HB   ASN  76          2HB       ASN  76  13.123  -5.134  10.073
  536   2HB   ASN  76          1HB       ASN  76  11.600  -6.009   9.951
  537   1HD2  ASN  76          1HD2      ASN  76  12.427  -7.702  11.192
  538   2HD2  ASN  76          2HD2      ASN  76  13.550  -8.848  10.532
  539    H    ASN  77           H        ASN  77  12.937  -7.463   6.889
  540    HA   ASN  77           HA       ASN  77  10.861  -7.564   5.001
  541   1HB   ASN  77          2HB       ASN  77  11.669  -9.786   4.445
  542   2HB   ASN  77          1HB       ASN  77  13.031  -8.710   4.717
  543   1HD2  ASN  77          1HD2      ASN  77  14.312  -8.990   6.558
  544   2HD2  ASN  77          2HD2      ASN  77  14.278 -10.456   7.480
  545    H    THR  78           H        THR  78  11.152  -9.169   8.157
  546    HA   THR  78           HA       THR  78   8.860 -10.804   7.713
  547    HB   THR  78           HB       THR  78  10.650 -11.496   9.261
  548    HG1  THR  78           1HG      THR  78   8.261 -12.072   9.502
  549   1HG2  THR  78          1HG2      THR  78   9.592  -9.316  11.063
  550   2HG2  THR  78          2HG2      THR  78  11.162  -9.317  10.257
  551   3HG2  THR  78          3HG2      THR  78  10.807 -10.520  11.497
  552    H    ALA  79           H        ALA  79   9.371  -7.617   9.011
  553    HA   ALA  79           HA       ALA  79   6.846  -7.411  10.329
  554   1HB   ALA  79          1HB       ALA  79   7.331  -5.001  10.424
  555   2HB   ALA  79          2HB       ALA  79   8.715  -5.243   9.358
  556   3HB   ALA  79          3HB       ALA  79   8.703  -5.964  10.967
  557    H    PHE  80           H        PHE  80   8.044  -5.704   7.455
  558    HA   PHE  80           HA       PHE  80   5.393  -6.077   6.238
  559   1HB   PHE  80          2HB       PHE  80   7.117  -3.599   6.007
  560   2HB   PHE  80          1HB       PHE  80   5.550  -3.836   5.242
  561    HD1  PHE  80           1HD      PHE  80   7.303  -2.845   8.213
  562    HD2  PHE  80           2HD      PHE  80   3.517  -4.021   6.675
  563    HE1  PHE  80           1HE      PHE  80   6.205  -1.866  10.184
  564    HE2  PHE  80           2HE      PHE  80   2.404  -3.044   8.644
  565    HZ   PHE  80           HZ       PHE  80   3.753  -2.041  10.438
  566    H    GLY  81           H        GLY  81   8.054  -4.379   4.875
  567   1HA   GLY  81          2HA       GLY  81   9.903  -6.100   4.116
  568   2HA   GLY  81          1HA       GLY  81   8.623  -6.499   2.979
  569    H    TYR  82           H        TYR  82   7.861  -4.872   1.581
  570    HA   TYR  82           HA       TYR  82   9.625  -2.581   1.199
  571   1HB   TYR  82          2HB       TYR  82  10.017  -3.078  -1.141
  572   2HB   TYR  82          1HB       TYR  82  10.550  -4.457  -0.185
  573    HD1  TYR  82           1HD      TYR  82   9.022  -6.479  -0.036
  574    HD2  TYR  82           2HD      TYR  82   8.406  -3.335  -2.836
  575    HE1  TYR  82           1HE      TYR  82   7.613  -7.968  -1.393
  576    HE2  TYR  82           2HE      TYR  82   6.994  -4.816  -4.193
  577    HH   TYR  82           HH       TYR  82   6.691  -7.234  -4.562
  578    H    TYR  83           H        TYR  83   8.714  -1.030  -0.308
  579    HA   TYR  83           HA       TYR  83   5.906  -1.464  -0.962
  580   1HB   TYR  83          2HB       TYR  83   5.303   0.774  -0.145
  581   2HB   TYR  83          1HB       TYR  83   5.860  -0.261   1.157
  582    HD1  TYR  83           1HD      TYR  83   7.794   0.296   2.426
  583    HD2  TYR  83           2HD      TYR  83   6.740   2.610  -0.985
  584    HE1  TYR  83           1HE      TYR  83   9.425   2.006   3.092
  585    HE2  TYR  83           2HE      TYR  83   8.383   4.327  -0.332
  586    HH   TYR  83           HH       TYR  83   9.666   5.077   1.467
  587    H    LEU  84           H        LEU  84   5.193  -0.306  -2.740
  588    HA   LEU  84           HA       LEU  84   7.273   1.140  -4.233
  589   1HB   LEU  84          2HB       LEU  84   5.010  -0.518  -5.342
  590   2HB   LEU  84          1HB       LEU  84   6.180   0.371  -6.294
  591    HG   LEU  84           HG       LEU  84   6.811  -1.974  -4.499
  592   1HD1  LEU  84          1HD1      LEU  84   5.556  -2.670  -6.446
  593   2HD1  LEU  84          2HD1      LEU  84   7.243  -3.158  -6.611
  594   3HD1  LEU  84          3HD1      LEU  84   6.637  -1.761  -7.501
  595   1HD2  LEU  84          1HD2      LEU  84   8.666  -0.413  -4.642
  596   2HD2  LEU  84          2HD2      LEU  84   8.548  -0.410  -6.403
  597   3HD2  LEU  84          3HD2      LEU  84   9.022  -1.883  -5.554
  598    H    THR  85           H        THR  85   6.776   3.243  -4.019
  599    HA   THR  85           HA       THR  85   4.057   4.075  -3.592
  600    HB   THR  85           HB       THR  85   6.267   6.022  -4.112
  601    HG1  THR  85           1HG      THR  85   6.024   4.712  -1.586
  602   1HG2  THR  85          1HG2      THR  85   5.178   7.234  -2.309
  603   2HG2  THR  85          2HG2      THR  85   4.099   5.869  -2.020
  604   3HG2  THR  85          3HG2      THR  85   3.998   6.768  -3.535
  605    H    LEU  86           H        LEU  86   2.863   3.901  -5.387
  606    HA   LEU  86           HA       LEU  86   4.040   4.842  -7.904
  607   1HB   LEU  86          2HB       LEU  86   3.806   2.427  -7.835
  608   2HB   LEU  86          1HB       LEU  86   2.121   2.570  -7.394
  609    HG   LEU  86           HG       LEU  86   2.952   3.810  -9.962
  610   1HD1  LEU  86          1HD1      LEU  86   4.142   1.675  -9.965
  611   2HD1  LEU  86          2HD1      LEU  86   2.809   1.679 -11.121
  612   3HD1  LEU  86          3HD1      LEU  86   2.638   0.838  -9.578
  613   1HD2  LEU  86          1HD2      LEU  86   0.760   2.972 -10.650
  614   2HD2  LEU  86          2HD2      LEU  86   0.644   3.942  -9.180
  615   3HD2  LEU  86          3HD2      LEU  86   0.568   2.182  -9.085
  616    H    THR  87           H        THR  87   2.964   6.340  -9.021
  617    HA   THR  87           HA       THR  87   0.412   7.246  -7.952
  618    HB   THR  87           HB       THR  87   0.685   9.130  -9.576
  619    HG1  THR  87           1HG      THR  87   3.351   8.553 -10.021
  620   1HG2  THR  87          1HG2      THR  87   1.517   9.309  -7.264
  621   2HG2  THR  87          2HG2      THR  87   2.515  10.224  -8.396
  622   3HG2  THR  87          3HG2      THR  87   3.074   8.665  -7.786
  623    H    ARG  88           H        ARG  88  -1.434   6.678  -8.800
  624    HA   ARG  88           HA       ARG  88  -2.408   6.472 -11.278
  625   1HB   ARG  88          2HB       ARG  88  -0.440   4.784 -11.615
  626   2HB   ARG  88          1HB       ARG  88  -1.422   3.682 -10.666
  627   1HG   ARG  88          2HG       ARG  88  -3.272   4.084 -12.331
  628   2HG   ARG  88          1HG       ARG  88  -2.066   4.894 -13.335
  629   1HD   ARG  88          2HD       ARG  88  -2.162   2.659 -14.092
  630   2HD   ARG  88          1HD       ARG  88  -0.680   2.797 -13.144
  631    HE   ARG  88           HE       ARG  88  -3.179   1.604 -12.114
  632   1HH1  ARG  88          1HH1      ARG  88   0.315   1.712 -12.298
  633   2HH1  ARG  88          2HH1      ARG  88   0.528   0.290 -11.330
  634   1HH2  ARG  88          1HH2      ARG  88  -2.917  -0.246 -10.855
  635   2HH2  ARG  88          2HH2      ARG  88  -1.319  -0.857 -10.530
  636    H    LEU  89           H        LEU  89  -4.403   6.730 -10.324
  637    HA   LEU  89           HA       LEU  89  -5.597   4.440  -9.075
  638   1HB   LEU  89          2HB       LEU  89  -4.342   5.441  -7.195
  639   2HB   LEU  89          1HB       LEU  89  -5.209   6.945  -7.433
  640    HG   LEU  89           HG       LEU  89  -7.324   5.788  -6.866
  641   1HD1  LEU  89          1HD1      LEU  89  -5.518   3.459  -6.243
  642   2HD1  LEU  89          2HD1      LEU  89  -6.720   3.530  -7.534
  643   3HD1  LEU  89          3HD1      LEU  89  -7.234   3.566  -5.846
  644   1HD2  LEU  89          1HD2      LEU  89  -5.142   5.542  -4.808
  645   2HD2  LEU  89          2HD2      LEU  89  -6.873   5.563  -4.478
  646   3HD2  LEU  89          3HD2      LEU  89  -6.087   6.988  -5.156
  647    H    ASP  90           H        ASP  90  -7.834   4.655  -8.774
  648    HA   ASP  90           HA       ASP  90  -9.072   6.992 -10.063
  649   1HB   ASP  90          2HB       ASP  90  -9.688   4.065 -10.471
  650   2HB   ASP  90          1HB       ASP  90 -10.860   5.322 -10.840
  651    H    LYS  91           H        LYS  91 -11.450   7.127  -9.480
  652    HA   LYS  91           HA       LYS  91 -11.749   6.931  -6.647
  653   1HB   LYS  91          2HB       LYS  91 -12.812   8.724  -8.002
  654   2HB   LYS  91          1HB       LYS  91 -13.842   7.521  -8.758
  655   1HG   LYS  91          2HG       LYS  91 -13.858   7.840  -5.787
  656   2HG   LYS  91          1HG       LYS  91 -14.757   8.962  -6.809
  657   1HD   LYS  91          2HD       LYS  91 -16.087   7.207  -7.704
  658   2HD   LYS  91          1HD       LYS  91 -15.052   5.971  -6.988
  659   1HE   LYS  91          2HE       LYS  91 -15.730   6.737  -4.749
  660   2HE   LYS  91          1HE       LYS  91 -16.804   7.921  -5.496
  661   1HZ   LYS  91          1HZ       LYS  91 -17.841   5.753  -4.761
  662   2HZ   LYS  91          2HZ       LYS  91 -17.029   5.024  -6.061
  663   3HZ   LYS  91          3HZ       LYS  91 -18.167   6.242  -6.353
  664    H    ALA  92           H        ALA  92 -12.961   5.143  -9.440
  665    HA   ALA  92           HA       ALA  92 -14.564   3.303  -8.009
  666   1HB   ALA  92          1HB       ALA  92 -14.458   1.931 -10.032
  667   2HB   ALA  92          2HB       ALA  92 -13.160   2.949 -10.657
  668   3HB   ALA  92          3HB       ALA  92 -14.772   3.623 -10.420
  669    H    ALA  93           H        ALA  93 -11.157   3.395  -8.825
  670    HA   ALA  93           HA       ALA  93 -10.502   0.755  -8.091
  671   1HB   ALA  93          1HB       ALA  93  -9.025   2.183  -9.432
  672   2HB   ALA  93          2HB       ALA  93  -8.199   1.522  -8.021
  673   3HB   ALA  93          3HB       ALA  93  -8.741   3.201  -8.023
  674    H    CYS  94           H        CYS  94 -10.870   3.714  -6.260
  675    HA   CYS  94           HA       CYS  94  -9.803   2.924  -3.805
  676   1HB   CYS  94          2HB       CYS  94 -10.488   5.220  -4.216
  677   2HB   CYS  94          1HB       CYS  94 -12.164   4.721  -4.408
  678    H    VAL  95           H        VAL  95 -13.115   2.561  -5.065
  679    HA   VAL  95           HA       VAL  95 -14.114   1.159  -2.817
  680    HB   VAL  95           HB       VAL  95 -15.147   1.042  -5.656
  681   1HG1  VAL  95          1HG1      VAL  95 -16.514   0.495  -3.019
  682   2HG1  VAL  95          2HG1      VAL  95 -16.086  -0.701  -4.243
  683   3HG1  VAL  95          3HG1      VAL  95 -17.306   0.523  -4.594
  684   1HG2  VAL  95          1HG2      VAL  95 -16.648   2.863  -5.010
  685   2HG2  VAL  95          2HG2      VAL  95 -14.955   3.349  -4.897
  686   3HG2  VAL  95          3HG2      VAL  95 -15.858   2.954  -3.435
  687    H    SER  96           H        SER  96 -12.567   0.171  -5.782
  688    HA   SER  96           HA       SER  96 -12.978  -2.591  -5.617
  689   1HB   SER  96          2HB       SER  96 -12.081  -1.275  -7.564
  690   2HB   SER  96          1HB       SER  96 -10.544  -1.178  -6.710
  691    HG   SER  96           HG       SER  96 -11.873  -3.507  -7.651
  692    H    LEU  97           H        LEU  97 -10.363  -0.546  -4.330
  693    HA   LEU  97           HA       LEU  97  -8.873  -2.597  -3.117
  694   1HB   LEU  97          2HB       LEU  97  -9.136   0.301  -2.340
  695   2HB   LEU  97          1HB       LEU  97  -7.909  -0.793  -1.728
  696    HG   LEU  97           HG       LEU  97  -8.232  -0.007  -4.624
  697   1HD1  LEU  97          1HD1      LEU  97  -7.497   1.876  -3.262
  698   2HD1  LEU  97          2HD1      LEU  97  -6.189   1.294  -4.291
  699   3HD1  LEU  97          3HD1      LEU  97  -6.206   0.890  -2.575
  700   1HD2  LEU  97          1HD2      LEU  97  -7.277  -2.214  -4.389
  701   2HD2  LEU  97          2HD2      LEU  97  -6.105  -1.612  -3.216
  702   3HD2  LEU  97          3HD2      LEU  97  -6.031  -1.071  -4.894
  703    H    ALA  98           H        ALA  98 -11.685  -0.817  -2.057
  704    HA   ALA  98           HA       ALA  98 -11.693  -1.834   0.598
  705   1HB   ALA  98          1HB       ALA  98 -12.946   0.180  -0.092
  706   2HB   ALA  98          2HB       ALA  98 -13.963  -1.012   0.718
  707   3HB   ALA  98          3HB       ALA  98 -14.026  -0.845  -1.037
  708    H    THR  99           H        THR  99 -13.055  -2.940  -2.472
  709    HA   THR  99           HA       THR  99 -14.331  -5.207  -1.221
  710    HB   THR  99           HB       THR  99 -14.791  -5.944  -3.572
  711    HG1  THR  99           1HG      THR  99 -12.882  -4.241  -4.170
  712   1HG2  THR  99          1HG2      THR  99 -15.607  -3.101  -2.955
  713   2HG2  THR  99          2HG2      THR  99 -16.370  -4.539  -2.277
  714   3HG2  THR  99          3HG2      THR  99 -16.451  -4.231  -4.016
  715    H    LEU 100           H        LEU 100 -11.266  -4.612  -1.424
  716    HA   LEU 100           HA       LEU 100 -10.497  -7.361  -2.174
  717   1HB   LEU 100          2HB       LEU 100  -9.435  -5.106  -3.170
  718   2HB   LEU 100          1HB       LEU 100  -8.454  -5.242  -1.723
  719    HG   LEU 100           HG       LEU 100  -8.667  -7.323  -3.908
  720   1HD1  LEU 100          1HD1      LEU 100  -6.442  -5.427  -3.180
  721   2HD1  LEU 100          2HD1      LEU 100  -7.456  -5.343  -4.619
  722   3HD1  LEU 100          3HD1      LEU 100  -6.351  -6.701  -4.396
  723   1HD2  LEU 100          1HD2      LEU 100  -6.911  -7.254  -1.455
  724   2HD2  LEU 100          2HD2      LEU 100  -6.842  -8.453  -2.747
  725   3HD2  LEU 100          3HD2      LEU 100  -8.274  -8.342  -1.721
  726    H    ASN 101           H        ASN 101 -10.424  -8.606  -0.369
  727    HA   ASN 101           HA       ASN 101 -10.048  -7.406   2.216
  728   1HB   ASN 101          2HB       ASN 101 -11.537  -9.422   1.704
  729   2HB   ASN 101          1HB       ASN 101 -10.053 -10.365   1.667
  730   1HD2  ASN 101          1HD2      ASN 101 -10.747  -7.625   3.771
  731   2HD2  ASN 101          2HD2      ASN 101 -10.743  -8.530   5.255
  732    H    LEU 102           H        LEU 102  -7.980  -6.506   1.943
  733    HA   LEU 102           HA       LEU 102  -5.685  -7.973   1.249
  734   1HB   LEU 102          2HB       LEU 102  -5.999  -5.441   2.849
  735   2HB   LEU 102          1HB       LEU 102  -4.449  -6.080   2.333
  736    HG   LEU 102           HG       LEU 102  -6.672  -5.212   0.478
  737   1HD1  LEU 102          1HD1      LEU 102  -5.219  -3.323  -0.044
  738   2HD1  LEU 102          2HD1      LEU 102  -4.067  -3.869   1.177
  739   3HD1  LEU 102          3HD1      LEU 102  -5.674  -3.328   1.662
  740   1HD2  LEU 102          1HD2      LEU 102  -5.286  -6.984  -0.470
  741   2HD2  LEU 102          2HD2      LEU 102  -3.834  -6.064  -0.087
  742   3HD2  LEU 102          3HD2      LEU 102  -4.979  -5.445  -1.273
  743    H    GLY 103           H        GLY 103  -7.477  -7.854   4.163
  744   1HA   GLY 103          2HA       GLY 103  -5.340  -8.368   5.985
  745   2HA   GLY 103          1HA       GLY 103  -7.053  -8.533   6.323
  746    H    THR 104           H        THR 104  -6.164 -10.294   3.594
  747    HA   THR 104           HA       THR 104  -6.384 -12.790   5.038
  748    HB   THR 104           HB       THR 104  -6.211 -13.782   2.707
  749    HG1  THR 104           1HG      THR 104  -6.852 -11.305   1.600
  750   1HG2  THR 104          1HG2      THR 104  -8.490 -13.099   2.072
  751   2HG2  THR 104          2HG2      THR 104  -8.408 -11.775   3.236
  752   3HG2  THR 104          3HG2      THR 104  -8.365 -13.446   3.796
  753    H    SER 105           H        SER 105  -3.925 -10.863   3.480
  754    HA   SER 105           HA       SER 105  -1.864 -12.589   4.558
  755   1HB   SER 105          2HB       SER 105  -2.080 -12.063   1.583
  756   2HB   SER 105          1HB       SER 105  -0.657 -12.739   2.372
  757    HG   SER 105           HG       SER 105  -3.101 -13.914   1.777
  758    H    ALA 106           H        ALA 106  -2.680  -9.697   2.717
  759    HA   ALA 106           HA       ALA 106  -0.269  -8.401   2.594
  760   1HB   ALA 106          1HB       ALA 106  -2.974  -7.128   2.968
  761   2HB   ALA 106          2HB       ALA 106  -2.269  -7.640   1.434
  762   3HB   ALA 106          3HB       ALA 106  -1.525  -6.330   2.354
  763    H    LYS 107           H        LYS 107   0.514  -6.488   3.762
  764    HA   LYS 107           HA       LYS 107   0.606  -7.164   6.559
  765   1HB   LYS 107          2HB       LYS 107   2.333  -5.698   4.711
  766   2HB   LYS 107          1HB       LYS 107   2.228  -4.959   6.303
  767   1HG   LYS 107          2HG       LYS 107   4.004  -6.367   6.598
  768   2HG   LYS 107          1HG       LYS 107   2.680  -7.397   7.136
  769   1HD   LYS 107          2HD       LYS 107   2.606  -8.250   4.728
  770   2HD   LYS 107          1HD       LYS 107   4.176  -7.458   4.537
  771   1HE   LYS 107          2HE       LYS 107   3.624  -9.431   6.743
  772   2HE   LYS 107          1HE       LYS 107   4.192  -9.936   5.155
  773   1HZ   LYS 107          1HZ       LYS 107   6.059  -9.727   6.553
  774   2HZ   LYS 107          2HZ       LYS 107   5.581  -8.202   7.111
  775   3HZ   LYS 107          3HZ       LYS 107   6.107  -8.391   5.510
  776    H    GLY 108           H        GLY 108  -0.779  -4.657   4.557
  777   1HA   GLY 108          2HA       GLY 108  -2.622  -3.821   6.417
  778   2HA   GLY 108          1HA       GLY 108  -1.220  -2.808   6.700
  779    H    TYR 109           H        TYR 109  -3.070  -1.291   6.151
  780    HA   TYR 109           HA       TYR 109  -2.678  -0.307   3.477
  781   1HB   TYR 109          2HB       TYR 109  -4.375  -2.001   3.062
  782   2HB   TYR 109          1HB       TYR 109  -5.351  -1.396   4.396
  783    HD1  TYR 109           1HD      TYR 109  -4.685  -1.200   0.893
  784    HD2  TYR 109           2HD      TYR 109  -6.355   0.939   4.161
  785    HE1  TYR 109           1HE      TYR 109  -5.870   0.269  -0.686
  786    HE2  TYR 109           2HE      TYR 109  -7.560   2.408   2.596
  787    HH   TYR 109           HH       TYR 109  -7.285   3.160   0.197
  788    H    GLY 110           H        GLY 110  -2.640   1.912   3.665
  789   1HA   GLY 110          2HA       GLY 110  -4.237   3.131   5.815
  790   2HA   GLY 110          1HA       GLY 110  -2.499   3.392   5.803
  791    H    VAL 111           H        VAL 111  -5.258   4.875   5.145
  792    HA   VAL 111           HA       VAL 111  -4.415   6.087   2.605
  793    HB   VAL 111           HB       VAL 111  -7.043   6.562   4.008
  794   1HG1  VAL 111          1HG1      VAL 111  -6.204   6.848   1.125
  795   2HG1  VAL 111          2HG1      VAL 111  -6.449   8.164   2.273
  796   3HG1  VAL 111          3HG1      VAL 111  -7.814   7.169   1.767
  797   1HG2  VAL 111          1HG2      VAL 111  -6.425   4.437   1.962
  798   2HG2  VAL 111          2HG2      VAL 111  -8.031   4.854   2.563
  799   3HG2  VAL 111          3HG2      VAL 111  -6.830   4.167   3.656
  800    H    ASN 112           H        ASN 112  -3.789   8.156   2.462
  801    HA   ASN 112           HA       ASN 112  -3.306  10.311   2.976
  802   1HB   ASN 112          2HB       ASN 112  -5.136   9.864   5.334
  803   2HB   ASN 112          1HB       ASN 112  -4.352  11.398   4.988
  804   1HD2  ASN 112          1HD2      ASN 112  -6.808   9.168   4.052
  805   2HD2  ASN 112          2HD2      ASN 112  -7.617  10.205   2.930
  806    H    ILE 113           H        ILE 113  -1.900   7.851   4.131
  807    HA   ILE 113           HA       ILE 113  -0.578   8.988   6.446
  808    HB   ILE 113           HB       ILE 113  -0.366   6.363   5.018
  809   1HG1  ILE 113          2HG1      ILE 113  -0.536   5.520   7.378
  810   2HG1  ILE 113          1HG1      ILE 113  -0.714   7.188   7.906
  811   1HG2  ILE 113          1HG2      ILE 113   1.590   5.744   6.353
  812   2HG2  ILE 113          2HG2      ILE 113   1.703   7.399   6.949
  813   3HG2  ILE 113          3HG2      ILE 113   1.950   7.062   5.236
  814   1HD1  ILE 113          1HD1      ILE 113  -2.860   6.106   7.784
  815   2HD1  ILE 113          2HD1      ILE 113  -2.584   5.691   6.092
  816   3HD1  ILE 113          3HD1      ILE 113  -2.756   7.381   6.571
  817    H    SER 114           H        SER 114   1.047  10.351   6.310
  818    HA   SER 114           HA       SER 114   2.823  10.232   3.974
  819   1HB   SER 114          2HB       SER 114   1.727  12.441   4.502
  820   2HB   SER 114          1HB       SER 114   2.605  12.449   6.030
  821    HG   SER 114           HG       SER 114   4.335  13.049   5.016
  822    H    GLY 115           H        GLY 115   4.601   9.051   4.335
  823   1HA   GLY 115          2HA       GLY 115   6.603   8.793   5.813
  824   2HA   GLY 115          1HA       GLY 115   5.455   8.714   7.147
  825    H    GLU 116           H        GLU 116   5.957   7.198   3.999
  826    HA   GLU 116           HA       GLU 116   4.576   4.810   4.569
  827   1HB   GLU 116          2HB       GLU 116   5.939   6.031   2.382
  828   2HB   GLU 116          1HB       GLU 116   6.556   4.392   2.557
  829   1HG   GLU 116          2HG       GLU 116   4.550   3.434   2.057
  830   2HG   GLU 116          1HG       GLU 116   3.622   4.833   2.596
  831    H    ASN 117           H        ASN 117   7.952   5.728   4.843
  832    HA   ASN 117           HA       ASN 117   9.017   3.118   5.072
  833   1HB   ASN 117          2HB       ASN 117  10.337   5.114   4.421
  834   2HB   ASN 117          1HB       ASN 117  10.175   5.733   6.059
  835   1HD2  ASN 117          1HD2      ASN 117  11.666   3.340   4.029
  836   2HD2  ASN 117          2HD2      ASN 117  12.884   2.852   5.158
  837    H    ASN 118           H        ASN 118   7.531   5.280   7.335
  838    HA   ASN 118           HA       ASN 118   7.965   3.299   9.453
  839   1HB   ASN 118          2HB       ASN 118   8.152   5.108  11.116
  840   2HB   ASN 118          1HB       ASN 118   9.439   5.192   9.921
  841   1HD2  ASN 118          1HD2      ASN 118   8.466   7.256  11.665
  842   2HD2  ASN 118          2HD2      ASN 118   7.926   8.552  10.659
  843    H    ILE 119           H        ILE 119   5.849   2.838   8.191
  844    HA   ILE 119           HA       ILE 119   3.527   4.323   8.497
  845    HB   ILE 119           HB       ILE 119   3.731   2.394   7.000
  846   1HG1  ILE 119          2HG1      ILE 119   1.520   1.330   7.476
  847   2HG1  ILE 119          1HG1      ILE 119   1.497   2.166   9.026
  848   1HG2  ILE 119          1HG2      ILE 119   5.016   0.908   8.403
  849   2HG2  ILE 119          2HG2      ILE 119   3.540   0.108   7.863
  850   3HG2  ILE 119          3HG2      ILE 119   3.653   0.732   9.508
  851   1HD1  ILE 119          1HD1      ILE 119   1.540   4.311   7.852
  852   2HD1  ILE 119          2HD1      ILE 119   0.150   3.328   7.390
  853   3HD1  ILE 119          3HD1      ILE 119   1.539   3.457   6.309
  854    H    THR 120           H        THR 120   1.780   4.174   9.920
  855    HA   THR 120           HA       THR 120   2.581   3.689  12.672
  856    HB   THR 120           HB       THR 120   0.168   4.738  13.003
  857    HG1  THR 120           1HG      THR 120   0.904   5.938  10.542
  858   1HG2  THR 120          1HG2      THR 120   1.200   6.952  13.034
  859   2HG2  THR 120          2HG2      THR 120   2.553   6.349  12.077
  860   3HG2  THR 120          3HG2      THR 120   2.293   5.746  13.714
  861    H    SER 121           H        SER 121   0.649   2.946  14.129
  862    HA   SER 121           HA       SER 121   0.310   0.217  13.695
  863   1HB   SER 121          2HB       SER 121   0.197   1.436  15.897
  864   2HB   SER 121          1HB       SER 121  -1.437   1.939  15.467
  865    HG   SER 121           HG       SER 121  -0.447  -0.647  16.048
  866    H    PHE 122           H        PHE 122  -1.800  -0.965  13.643
  867    HA   PHE 122           HA       PHE 122  -3.486   0.204  11.521
  868   1HB   PHE 122          2HB       PHE 122  -2.600  -2.675  11.805
  869   2HB   PHE 122          1HB       PHE 122  -3.618  -2.029  10.524
  870    HD1  PHE 122           1HD      PHE 122  -2.675  -0.698   8.739
  871    HD2  PHE 122           2HD      PHE 122  -0.222  -2.265  11.839
  872    HE1  PHE 122           1HE      PHE 122  -0.674  -0.234   7.385
  873    HE2  PHE 122           2HE      PHE 122   1.783  -1.800  10.494
  874    HZ   PHE 122           HZ       PHE 122   1.558  -0.782   8.264
  875    H    GLY 123           H        GLY 123  -5.607   0.138  11.804
  876   1HA   GLY 123          2HA       GLY 123  -6.723  -1.795  13.749
  877   2HA   GLY 123          1HA       GLY 123  -7.403  -0.195  13.478
  878    H    ASN 124           H        ASN 124  -9.240  -0.282  12.338
  879    HA   ASN 124           HA       ASN 124  -9.225  -1.977   9.920
  880   1HB   ASN 124          2HB       ASN 124 -11.606  -1.470  11.715
  881   2HB   ASN 124          1HB       ASN 124 -11.676  -2.270  10.142
  882   1HD2  ASN 124          1HD2      ASN 124 -10.803  -4.349   9.931
  883   2HD2  ASN 124          2HD2      ASN 124 -10.457  -5.344  11.304
  884    H    SER 125           H        SER 125  -9.521   1.093  11.238
  885    HA   SER 125           HA       SER 125 -11.252   2.090   9.098
  886   1HB   SER 125          2HB       SER 125 -10.136   3.510  11.533
  887   2HB   SER 125          1HB       SER 125 -11.319   4.170  10.406
  888    HG   SER 125           HG       SER 125 -11.946   2.968  12.534
  889    H    ALA 126           H        ALA 126 -10.531   4.357   8.265
  890    HA   ALA 126           HA       ALA 126  -7.653   4.379   7.726
  891   1HB   ALA 126          1HB       ALA 126  -8.007   4.631   5.340
  892   2HB   ALA 126          2HB       ALA 126  -9.751   4.501   5.565
  893   3HB   ALA 126          3HB       ALA 126  -8.712   3.117   5.907
  894    H    ASP 127           H        ASP 127  -7.395   6.390   6.035
  895    HA   ASP 127           HA       ASP 127  -7.416   8.632   5.718
  896   1HB   ASP 127          2HB       ASP 127  -9.837   8.634   5.598
  897   2HB   ASP 127          1HB       ASP 127  -9.960   8.573   7.353
  898    H    GLN 128           H        GLN 128  -5.590   9.129   6.674
  899    HA   GLN 128           HA       GLN 128  -4.110   9.954   8.172
  900   1HB   GLN 128          2HB       GLN 128  -6.567  10.598   9.820
  901   2HB   GLN 128          1HB       GLN 128  -4.940  11.170  10.168
  902   1HG   GLN 128          2HG       GLN 128  -4.894  12.388   8.069
  903   2HG   GLN 128          1HG       GLN 128  -6.496  11.778   7.661
  904   1HE2  GLN 128          1HE2      GLN 128  -7.470  12.045  10.409
  905   2HE2  GLN 128          2HE2      GLN 128  -7.730  13.742  10.650
  906    H    ALA 129           H        ALA 129  -5.562   7.246   8.316
  907    HA   ALA 129           HA       ALA 129  -4.028   6.230  10.551
  908   1HB   ALA 129          1HB       ALA 129  -6.197   6.776  11.570
  909   2HB   ALA 129          2HB       ALA 129  -5.909   5.037  11.542
  910   3HB   ALA 129          3HB       ALA 129  -7.008   5.766  10.374
  911    H    ALA 130           H        ALA 130  -3.819   3.908  10.457
  912    HA   ALA 130           HA       ALA 130  -4.341   2.835   7.767
  913   1HB   ALA 130          1HB       ALA 130  -2.312   1.496   8.028
  914   2HB   ALA 130          2HB       ALA 130  -2.039   2.210   9.617
  915   3HB   ALA 130          3HB       ALA 130  -1.959   3.218   8.172
  916    H    LYS 131           H        LYS 131  -4.715   0.502   7.659
  917    HA   LYS 131           HA       LYS 131  -5.623  -0.636  10.201
  918   1HB   LYS 131          2HB       LYS 131  -7.749  -1.108   9.496
  919   2HB   LYS 131          1HB       LYS 131  -7.470   0.418   8.669
  920   1HG   LYS 131          2HG       LYS 131  -6.954  -2.208   7.320
  921   2HG   LYS 131          1HG       LYS 131  -8.564  -1.489   7.372
  922   1HD   LYS 131          2HD       LYS 131  -6.089  -0.202   6.239
  923   2HD   LYS 131          1HD       LYS 131  -7.399  -0.925   5.302
  924   1HE   LYS 131          2HE       LYS 131  -7.598   1.462   7.134
  925   2HE   LYS 131          1HE       LYS 131  -7.661   1.477   5.371
  926   1HZ   LYS 131          1HZ       LYS 131  -9.682   0.203   5.447
  927   2HZ   LYS 131          2HZ       LYS 131  -9.858   1.625   6.340
  928   3HZ   LYS 131          3HZ       LYS 131  -9.642   0.151   7.144
  929    H    SER 132           H        SER 132  -6.057  -2.985  10.037
  930    HA   SER 132           HA       SER 132  -3.825  -4.204   8.638
  931   1HB   SER 132          2HB       SER 132  -4.210  -4.684  11.024
  932   2HB   SER 132          1HB       SER 132  -5.787  -5.367  10.635
  933    HG   SER 132           HG       SER 132  -3.263  -6.343   9.725
  934    H    THR 133           H        THR 133  -7.363  -4.479   8.757
  935    HA   THR 133           HA       THR 133  -7.206  -6.202   6.378
  936    HB   THR 133           HB       THR 133  -9.495  -6.974   6.994
  937    HG1  THR 133           1HG      THR 133  -9.462  -6.450   9.598
  938   1HG2  THR 133          1HG2      THR 133  -7.347  -7.460   9.064
  939   2HG2  THR 133          2HG2      THR 133  -7.540  -8.331   7.543
  940   3HG2  THR 133          3HG2      THR 133  -8.767  -8.472   8.803
  941    H    ALA 134           H        ALA 134  -8.293  -5.633   4.583
  942    HA   ALA 134           HA       ALA 134  -9.727  -3.074   4.641
  943   1HB   ALA 134          1HB       ALA 134  -7.807  -3.155   3.127
  944   2HB   ALA 134          2HB       ALA 134  -9.317  -2.975   2.232
  945   3HB   ALA 134          3HB       ALA 134  -8.513  -4.543   2.300
  946    H    ILE 135           H        ILE 135 -11.866  -3.074   4.352
  947    HA   ILE 135           HA       ILE 135 -13.131  -5.167   2.799
  948    HB   ILE 135           HB       ILE 135 -13.064  -6.061   5.116
  949   1HG1  ILE 135          2HG1      ILE 135 -15.509  -6.567   5.280
  950   2HG1  ILE 135          1HG1      ILE 135 -15.790  -5.379   4.011
  951   1HG2  ILE 135          1HG2      ILE 135 -13.163  -4.006   6.380
  952   2HG2  ILE 135          2HG2      ILE 135 -14.490  -5.069   6.849
  953   3HG2  ILE 135          3HG2      ILE 135 -14.796  -3.690   5.791
  954   1HD1  ILE 135          1HD1      ILE 135 -14.439  -6.692   2.473
  955   2HD1  ILE 135          2HD1      ILE 135 -15.760  -7.652   3.136
  956   3HD1  ILE 135          3HD1      ILE 135 -14.121  -7.870   3.744
  957    H    THR 136           H        THR 136 -15.137  -4.560   1.988
  958    HA   THR 136           HA       THR 136 -15.017  -1.918   1.153
  959    HB   THR 136           HB       THR 136 -17.492  -3.562   0.812
  960    HG1  THR 136           1HG      THR 136 -14.866  -4.059  -0.054
  961   1HG2  THR 136          1HG2      THR 136 -15.930  -1.748  -1.034
  962   2HG2  THR 136          2HG2      THR 136 -17.405  -1.310  -0.175
  963   3HG2  THR 136          3HG2      THR 136 -17.449  -2.558  -1.419
  964    HA   PRO 137           HA       PRO 137 -19.382  -1.140   3.098
  965   1HB   PRO 137          2HB       PRO 137 -19.676  -2.493   5.549
  966   2HB   PRO 137          1HB       PRO 137 -20.523  -2.843   4.046
  967   1HG   PRO 137          2HG       PRO 137 -18.137  -4.155   5.222
  968   2HG   PRO 137          1HG       PRO 137 -19.439  -4.855   4.244
  969   1HD   PRO 137          2HD       PRO 137 -17.004  -4.385   3.227
  970   2HD   PRO 137          1HD       PRO 137 -18.479  -4.176   2.255
  971    H    ALA 138           H        ALA 138 -16.760  -1.956   5.326
  972    HA   ALA 138           HA       ALA 138 -17.270   0.309   7.035
  973   1HB   ALA 138          1HB       ALA 138 -14.969  -1.642   6.994
  974   2HB   ALA 138          2HB       ALA 138 -16.422  -1.764   7.985
  975   3HB   ALA 138          3HB       ALA 138 -15.278  -0.449   8.255
  976    H    GLU 139           H        GLU 139 -14.625  -0.671   4.880
  977    HA   GLU 139           HA       GLU 139 -12.998   1.560   5.146
  978   1HB   GLU 139          2HB       GLU 139 -12.288  -0.536   4.124
  979   2HB   GLU 139          1HB       GLU 139 -13.375  -0.268   2.769
  980   1HG   GLU 139          2HG       GLU 139 -11.242   0.298   1.980
  981   2HG   GLU 139          1HG       GLU 139 -12.049   1.842   2.304
  982    H    ALA 140           H        ALA 140 -15.522   0.931   2.710
  983    HA   ALA 140           HA       ALA 140 -15.062   3.310   1.243
  984   1HB   ALA 140          1HB       ALA 140 -16.145   1.352   0.264
  985   2HB   ALA 140          2HB       ALA 140 -17.150   2.791   0.103
  986   3HB   ALA 140          3HB       ALA 140 -17.532   1.582   1.328
  987    H    ALA 141           H        ALA 141 -16.972   2.604   4.066
  988    HA   ALA 141           HA       ALA 141 -18.500   5.052   3.876
  989   1HB   ALA 141          1HB       ALA 141 -19.459   4.378   6.014
  990   2HB   ALA 141          2HB       ALA 141 -18.290   3.062   6.130
  991   3HB   ALA 141          3HB       ALA 141 -19.505   3.051   4.851
  992    H    THR 142           H        THR 142 -15.556   3.953   5.338
  993    HA   THR 142           HA       THR 142 -15.476   6.140   7.241
  994    HB   THR 142           HB       THR 142 -13.368   4.053   6.667
  995    HG1  THR 142           1HG      THR 142 -15.202   3.008   7.393
  996   1HG2  THR 142          1HG2      THR 142 -12.547   4.613   8.916
  997   2HG2  THR 142          2HG2      THR 142 -13.775   5.871   9.049
  998   3HG2  THR 142          3HG2      THR 142 -12.495   6.014   7.845
  999    H    ALA 143           H        ALA 143 -13.445   5.048   4.489
 1000    HA   ALA 143           HA       ALA 143 -12.095   7.659   4.623
 1001   1HB   ALA 143          1HB       ALA 143 -11.141   5.125   3.309
 1002   2HB   ALA 143          2HB       ALA 143 -10.669   5.682   4.914
 1003   3HB   ALA 143          3HB       ALA 143 -10.230   6.624   3.490
 1004    H    CYS 144           H        CYS 144 -13.600   5.405   2.342
 1005    HA   CYS 144           HA       CYS 144 -12.970   7.121   0.107
 1006   1HB   CYS 144          2HB       CYS 144 -13.150   4.494   0.207
 1007   2HB   CYS 144          1HB       CYS 144 -14.851   4.806  -0.113
 1008    H    LYS 145           H        LYS 145 -14.197   8.925   1.215
 1009    HA   LYS 145           HA       LYS 145 -17.066   8.781   0.574
 1010   1HB   LYS 145          2HB       LYS 145 -15.592  10.565   2.514
 1011   2HB   LYS 145          1HB       LYS 145 -17.296  10.730   2.121
 1012   1HG   LYS 145          2HG       LYS 145 -17.706   8.477   2.986
 1013   2HG   LYS 145          1HG       LYS 145 -16.000   8.338   3.406
 1014   1HD   LYS 145          2HD       LYS 145 -17.339   8.947   5.354
 1015   2HD   LYS 145          1HD       LYS 145 -16.216  10.239   4.928
 1016   1HE   LYS 145          2HE       LYS 145 -18.415  11.131   5.498
 1017   2HE   LYS 145          1HE       LYS 145 -18.017  11.445   3.810
 1018   1HZ   LYS 145          1HZ       LYS 145 -19.776   9.251   4.781
 1019   2HZ   LYS 145          2HZ       LYS 145 -19.416   9.589   3.160
 1020   3HZ   LYS 145          3HZ       LYS 145 -20.305  10.701   4.077
 1021    H    ASN 146           H        ASN 146 -14.419  11.161   0.695
 1022    HA   ASN 146           HA       ASN 146 -15.587  12.507  -1.645
 1023   1HB   ASN 146          2HB       ASN 146 -15.083  13.942   0.298
 1024   2HB   ASN 146          1HB       ASN 146 -13.402  13.423   0.250
 1025   1HD2  ASN 146          1HD2      ASN 146 -12.502  15.384  -0.137
 1026   2HD2  ASN 146          2HD2      ASN 146 -12.745  16.282  -1.600
 1027    H    THR 147           H        THR 147 -12.412  11.606  -0.365
 1028    HA   THR 147           HA       THR 147 -10.441  11.075  -1.335
 1029    HB   THR 147           HB       THR 147 -10.600   9.261  -3.099
 1030    HG1  THR 147           1HG      THR 147 -12.955  10.153  -3.500
 1031   1HG2  THR 147          1HG2      THR 147 -10.389   8.756  -0.722
 1032   2HG2  THR 147          2HG2      THR 147 -11.457   7.595  -1.513
 1033   3HG2  THR 147          3HG2      THR 147 -12.138   8.889  -0.526
 1034    H    ASP 148           H        ASP 148 -10.055  13.246  -2.104
 1035    HA   ASP 148           HA       ASP 148  -9.776  13.193  -5.035
 1036   1HB   ASP 148          2HB       ASP 148 -11.438  14.919  -4.370
 1037   2HB   ASP 148          1HB       ASP 148 -10.207  15.688  -3.370
 1038    H    SER 149           H        SER 149  -8.484  15.737  -2.998
 1039    HA   SER 149           HA       SER 149  -5.788  15.040  -3.712
 1040   1HB   SER 149          2HB       SER 149  -6.718  17.013  -1.608
 1041   2HB   SER 149          1HB       SER 149  -5.152  16.985  -2.425
 1042    HG   SER 149           HG       SER 149  -7.128  17.049  -4.242
 1043    H    THR 150           H        THR 150  -8.010  14.158  -1.347
 1044    HA   THR 150           HA       THR 150  -6.092  13.198   0.590
 1045    HB   THR 150           HB       THR 150  -8.250  12.152   1.560
 1046    HG1  THR 150           1HG      THR 150  -9.946  13.878   0.516
 1047   1HG2  THR 150          1HG2      THR 150  -7.203  14.151   2.493
 1048   2HG2  THR 150          2HG2      THR 150  -8.958  14.313   2.505
 1049   3HG2  THR 150          3HG2      THR 150  -8.003  15.152   1.281
 1050    H    ASN 151           H        ASN 151  -7.141  12.133  -2.384
 1051    HA   ASN 151           HA       ASN 151  -7.498   9.341  -1.718
 1052   1HB   ASN 151          2HB       ASN 151  -8.736  10.576  -3.583
 1053   2HB   ASN 151          1HB       ASN 151  -7.232  10.495  -4.494
 1054   1HD2  ASN 151          1HD2      ASN 151  -8.018   9.182  -6.091
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.452   7.529  -5.823
 1056    H    LYS 152           H        LYS 152  -5.273   9.451  -0.694
 1057    HA   LYS 152           HA       LYS 152  -3.442   8.239  -2.606
 1058   1HB   LYS 152          2HB       LYS 152  -1.588   9.551  -1.180
 1059   2HB   LYS 152          1HB       LYS 152  -2.260  10.174  -2.679
 1060   1HG   LYS 152          2HG       LYS 152  -2.387  12.019  -1.318
 1061   2HG   LYS 152          1HG       LYS 152  -3.991  11.322  -1.090
 1062   1HD   LYS 152          2HD       LYS 152  -3.028  10.155   0.943
 1063   2HD   LYS 152          1HD       LYS 152  -1.621  11.204   0.749
 1064   1HE   LYS 152          2HE       LYS 152  -4.471  12.023   1.266
 1065   2HE   LYS 152          1HE       LYS 152  -3.088  12.215   2.339
 1066   1HZ   LYS 152          1HZ       LYS 152  -2.139  13.801   0.757
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.667  14.292   1.286
 1068   3HZ   LYS 152          3HZ       LYS 152  -3.488  13.612  -0.256
 1069    H    VAL 153           H        VAL 153  -3.052   6.296  -1.870
 1070    HA   VAL 153           HA       VAL 153  -2.883   5.916   1.035
 1071    HB   VAL 153           HB       VAL 153  -5.084   5.212   0.619
 1072   1HG1  VAL 153          1HG1      VAL 153  -4.056   3.719  -1.790
 1073   2HG1  VAL 153          2HG1      VAL 153  -5.060   5.170  -1.799
 1074   3HG1  VAL 153          3HG1      VAL 153  -5.710   3.651  -1.181
 1075   1HG2  VAL 153          1HG2      VAL 153  -3.362   2.741   0.485
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.048   2.800   1.002
 1077   3HG2  VAL 153          3HG2      VAL 153  -3.805   3.618   1.951
 1078    H    THR 154           H        THR 154  -0.900   5.254   1.415
 1079    HA   THR 154           HA       THR 154   0.428   3.272  -0.194
 1080    HB   THR 154           HB       THR 154   2.191   4.055   0.903
 1081    HG1  THR 154           1HG      THR 154   0.924   2.904   3.179
 1082   1HG2  THR 154          1HG2      THR 154   0.327   5.347   2.903
 1083   2HG2  THR 154          2HG2      THR 154   0.908   6.089   1.410
 1084   3HG2  THR 154          3HG2      THR 154   2.042   5.705   2.705
 1085    H    TYR 155           H        TYR 155   0.189   1.044  -0.013
 1086    HA   TYR 155           HA       TYR 155  -0.570   0.121   2.662
 1087   1HB   TYR 155          2HB       TYR 155  -2.165  -1.544   1.752
 1088   2HB   TYR 155          1HB       TYR 155  -2.683   0.125   1.600
 1089    HD1  TYR 155           1HD      TYR 155  -2.107  -2.963  -0.113
 1090    HD2  TYR 155           2HD      TYR 155  -2.427   1.241  -0.665
 1091    HE1  TYR 155           1HE      TYR 155  -2.487  -3.316  -2.519
 1092    HE2  TYR 155           2HE      TYR 155  -2.824   0.904  -3.070
 1093    HH   TYR 155           HH       TYR 155  -3.547  -2.106  -4.413
 1094    H    PHE 156           H        PHE 156   0.453  -1.533   3.419
 1095    HA   PHE 156           HA       PHE 156   2.541  -2.743   1.824
 1096   1HB   PHE 156          2HB       PHE 156   1.848  -2.752   4.754
 1097   2HB   PHE 156          1HB       PHE 156   3.120  -3.762   4.085
 1098    HD1  PHE 156           1HD      PHE 156   4.995  -2.645   2.826
 1099    HD2  PHE 156           2HD      PHE 156   2.253  -0.526   5.292
 1100    HE1  PHE 156           1HE      PHE 156   6.576  -0.770   2.966
 1101    HE2  PHE 156           2HE      PHE 156   3.833   1.353   5.440
 1102    HZ   PHE 156           HZ       PHE 156   5.998   1.226   4.278
 1103    H    MET 157           H        MET 157   2.838  -5.055   1.717
 1104    HA   MET 157           HA       MET 157   0.513  -6.652   2.322
 1105   1HB   MET 157          2HB       MET 157   0.355  -7.372  -0.153
 1106   2HB   MET 157          1HB       MET 157  -0.408  -5.867   0.357
 1107   1HG   MET 157          2HG       MET 157   0.664  -5.476  -1.716
 1108   2HG   MET 157          1HG       MET 157   1.592  -4.650  -0.469
 1109   1HE   MET 157          1HE       MET 157   3.660  -4.332  -2.062
 1110   2HE   MET 157          2HE       MET 157   2.752  -5.089  -3.371
 1111   3HE   MET 157          3HE       MET 157   4.387  -5.636  -3.002
 1112    H    LYS 158           H        LYS 158   0.786  -8.829   2.191
 1113    HA   LYS 158           HA       LYS 158   3.535  -9.777   1.754
 1114   1HB   LYS 158          2HB       LYS 158   2.407  -9.955   4.056
 1115   2HB   LYS 158          1HB       LYS 158   1.368 -11.166   3.328
 1116   1HG   LYS 158          2HG       LYS 158   4.364 -11.371   3.416
 1117   2HG   LYS 158          1HG       LYS 158   3.294 -12.038   4.642
 1118   1HD   LYS 158          2HD       LYS 158   3.338 -12.786   1.721
 1119   2HD   LYS 158          1HD       LYS 158   3.976 -13.751   3.053
 1120   1HE   LYS 158          2HE       LYS 158   1.095 -12.971   2.624
 1121   2HE   LYS 158          1HE       LYS 158   1.793 -14.568   2.362
 1122   1HZ   LYS 158          1HZ       LYS 158   0.669 -14.521   4.468
 1123   2HZ   LYS 158          2HZ       LYS 158   1.533 -13.152   4.966
 1124   3HZ   LYS 158          3HZ       LYS 158   2.336 -14.629   4.760
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1 -23.236  -7.348   8.085
    2   2H    MET   1          2HT       MET   1 -24.217  -8.684   8.449
    3   3H    MET   1          3HT       MET   1 -24.059  -8.153   6.844
    4    HA   MET   1           HA       MET   1 -21.902  -9.287   8.521
    5   1HB   MET   1          2HB       MET   1 -23.493 -10.994   7.819
    6   2HB   MET   1          1HB       MET   1 -23.390 -10.440   6.153
    7   1HG   MET   1          2HG       MET   1 -22.091 -12.494   6.619
    8   2HG   MET   1          1HG       MET   1 -21.122 -11.166   5.979
    9   1HE   MET   1          1HE       MET   1 -19.798 -13.709   7.372
   10   2HE   MET   1          2HE       MET   1 -18.573 -12.911   8.359
   11   3HE   MET   1          3HE       MET   1 -18.898 -12.340   6.723
   12    H    GLU   2           H        GLU   2 -19.880  -8.972   7.810
   13    HA   GLU   2           HA       GLU   2 -19.587  -7.058   5.656
   14   1HB   GLU   2          2HB       GLU   2 -17.550  -8.147   7.605
   15   2HB   GLU   2          1HB       GLU   2 -17.259  -6.857   6.446
   16   1HG   GLU   2          2HG       GLU   2 -18.954  -5.485   7.537
   17   2HG   GLU   2          1HG       GLU   2 -19.257  -6.779   8.694
   18    H    GLN   3           H        GLN   3 -20.129  -8.540   3.958
   19    HA   GLN   3           HA       GLN   3 -17.693  -9.908   3.024
   20   1HB   GLN   3          2HB       GLN   3 -20.552 -10.642   2.349
   21   2HB   GLN   3          1HB       GLN   3 -19.121 -11.373   1.638
   22   1HG   GLN   3          2HG       GLN   3 -18.466 -12.088   3.956
   23   2HG   GLN   3          1HG       GLN   3 -20.062 -11.561   4.486
   24   1HE2  GLN   3          1HE2      GLN   3 -21.249 -12.387   1.903
   25   2HE2  GLN   3          2HE2      GLN   3 -21.368 -14.110   1.984
   26    H    SER   4           H        SER   4 -16.800  -8.853   1.381
   27    HA   SER   4           HA       SER   4 -18.311  -6.619   0.289
   28   1HB   SER   4          2HB       SER   4 -15.353  -7.234   0.201
   29   2HB   SER   4          1HB       SER   4 -16.108  -5.734  -0.336
   30    HG   SER   4           HG       SER   4 -15.210  -5.857   1.912
   31    H    ALA   5           H        ALA   5 -18.152  -9.624  -0.683
   32    HA   ALA   5           HA       ALA   5 -18.685 -10.657  -2.634
   33   1HB   ALA   5          1HB       ALA   5 -18.648  -7.927  -3.911
   34   2HB   ALA   5          2HB       ALA   5 -20.049  -8.672  -3.139
   35   3HB   ALA   5          3HB       ALA   5 -19.349  -9.400  -4.586
   36    H    SER   6           H        SER   6 -16.490  -8.003  -3.574
   37    HA   SER   6           HA       SER   6 -14.812  -9.682  -5.147
   38   1HB   SER   6          2HB       SER   6 -14.018  -7.061  -3.862
   39   2HB   SER   6          1HB       SER   6 -13.393  -7.769  -5.352
   40    HG   SER   6           HG       SER   6 -15.151  -6.000  -5.339
   41    H    ASP   7           H        ASP   7 -15.328  -9.360  -1.897
   42    HA   ASP   7           HA       ASP   7 -12.831  -9.729  -0.690
   43   1HB   ASP   7          2HB       ASP   7 -14.044 -10.231   1.265
   44   2HB   ASP   7          1HB       ASP   7 -15.180  -9.256   0.343
   45    H    SER   8           H        SER   8 -14.924 -11.838  -2.430
   46    HA   SER   8           HA       SER   8 -13.236 -14.147  -1.763
   47   1HB   SER   8          2HB       SER   8 -15.414 -15.269  -2.873
   48   2HB   SER   8          1HB       SER   8 -15.301 -14.899  -1.153
   49    HG   SER   8           HG       SER   8 -16.437 -12.985  -1.518
   50    H    ASN   9           H        ASN   9 -14.376 -12.106  -4.322
   51    HA   ASN   9           HA       ASN   9 -13.643 -14.009  -6.391
   52   1HB   ASN   9          2HB       ASN   9 -14.900 -11.278  -6.446
   53   2HB   ASN   9          1HB       ASN   9 -14.326 -12.050  -7.918
   54   1HD2  ASN   9          1HD2      ASN   9 -15.736 -13.819  -5.242
   55   2HD2  ASN   9          2HD2      ASN   9 -17.187 -14.278  -6.066
   56    H    LYS  10           H        LYS  10 -12.685 -10.639  -5.618
   57    HA   LYS  10           HA       LYS  10 -10.488 -10.927  -7.497
   58   1HB   LYS  10          2HB       LYS  10 -11.938  -8.871  -7.422
   59   2HB   LYS  10          1HB       LYS  10 -11.194  -8.485  -5.875
   60   1HG   LYS  10          2HG       LYS  10  -9.009  -8.368  -6.931
   61   2HG   LYS  10          1HG       LYS  10  -9.722  -8.801  -8.486
   62   1HD   LYS  10          2HD       LYS  10 -11.119  -6.753  -8.352
   63   2HD   LYS  10          1HD       LYS  10 -10.263  -6.310  -6.872
   64   1HE   LYS  10          2HE       LYS  10  -9.309  -5.143  -8.772
   65   2HE   LYS  10          1HE       LYS  10  -8.148  -6.294  -8.110
   66   1HZ   LYS  10          1HZ       LYS  10  -8.586  -7.800  -9.892
   67   2HZ   LYS  10          2HZ       LYS  10  -8.278  -6.275 -10.574
   68   3HZ   LYS  10          3HZ       LYS  10  -9.868  -6.851 -10.468
   69    H    SER  11           H        SER  11 -10.993 -10.625  -4.045
   70    HA   SER  11           HA       SER  11  -8.483  -9.768  -3.243
   71   1HB   SER  11          2HB       SER  11 -10.508  -9.967  -1.797
   72   2HB   SER  11          1HB       SER  11 -10.254 -11.710  -1.743
   73    HG   SER  11           HG       SER  11  -8.730 -11.430  -0.333
   74    H    GLN  12           H        GLN  12  -9.624 -13.153  -3.407
   75    HA   GLN  12           HA       GLN  12  -7.152 -14.295  -2.735
   76   1HB   GLN  12          2HB       GLN  12  -9.561 -15.411  -4.161
   77   2HB   GLN  12          1HB       GLN  12  -8.145 -16.390  -3.802
   78   1HG   GLN  12          2HG       GLN  12  -9.500 -16.877  -2.021
   79   2HG   GLN  12          1HG       GLN  12  -8.525 -15.569  -1.362
   80   1HE2  GLN  12          1HE2      GLN  12 -11.113 -16.468  -0.481
   81   2HE2  GLN  12          2HE2      GLN  12 -12.186 -15.117  -0.630
   82    H    ASN  13           H        ASN  13  -8.327 -13.035  -5.723
   83    HA   ASN  13           HA       ASN  13  -6.435 -14.444  -7.383
   84   1HB   ASN  13          2HB       ASN  13  -8.346 -12.171  -7.874
   85   2HB   ASN  13          1HB       ASN  13  -7.163 -12.648  -9.085
   86   1HD2  ASN  13          1HD2      ASN  13  -8.635 -15.000  -6.975
   87   2HD2  ASN  13          2HD2      ASN  13  -9.645 -15.728  -8.176
   88    H    ALA  14           H        ALA  14  -6.625 -11.384  -5.721
   89    HA   ALA  14           HA       ALA  14  -4.296 -10.252  -6.957
   90   1HB   ALA  14          1HB       ALA  14  -6.066  -8.839  -6.018
   91   2HB   ALA  14          2HB       ALA  14  -4.502  -8.499  -5.276
   92   3HB   ALA  14          3HB       ALA  14  -5.702  -9.456  -4.408
   93    H    ILE  15           H        ILE  15  -5.015 -12.014  -4.001
   94    HA   ILE  15           HA       ILE  15  -2.627 -11.776  -2.628
   95    HB   ILE  15           HB       ILE  15  -4.437 -14.191  -2.829
   96   1HG1  ILE  15          2HG1      ILE  15  -4.251 -12.010  -0.739
   97   2HG1  ILE  15          1HG1      ILE  15  -5.489 -12.114  -1.985
   98   1HG2  ILE  15          1HG2      ILE  15  -2.258 -13.584  -0.833
   99   2HG2  ILE  15          2HG2      ILE  15  -2.261 -14.886  -2.022
  100   3HG2  ILE  15          3HG2      ILE  15  -3.423 -14.900  -0.697
  101   1HD1  ILE  15          1HD1      ILE  15  -5.030 -14.096   0.232
  102   2HD1  ILE  15          2HD1      ILE  15  -6.259 -14.230  -1.025
  103   3HD1  ILE  15          3HD1      ILE  15  -6.331 -12.906   0.141
  104    H    SER  16           H        SER  16  -3.462 -14.030  -5.228
  105    HA   SER  16           HA       SER  16  -1.151 -15.585  -5.206
  106   1HB   SER  16          2HB       SER  16  -2.758 -14.817  -7.650
  107   2HB   SER  16          1HB       SER  16  -1.776 -16.265  -7.436
  108    HG   SER  16           HG       SER  16  -4.258 -16.212  -7.033
  109    H    GLU  17           H        GLU  17  -1.839 -12.527  -6.855
  110    HA   GLU  17           HA       GLU  17   0.580 -12.433  -8.337
  111   1HB   GLU  17          2HB       GLU  17  -1.195 -10.134  -7.492
  112   2HB   GLU  17          1HB       GLU  17   0.006 -10.097  -8.773
  113   1HG   GLU  17          2HG       GLU  17  -2.542 -11.695  -8.729
  114   2HG   GLU  17          1HG       GLU  17  -2.183 -10.289  -9.730
  115    H    VAL  18           H        VAL  18  -0.456 -11.004  -5.270
  116    HA   VAL  18           HA       VAL  18   1.914  -9.527  -4.808
  117    HB   VAL  18           HB       VAL  18  -0.135 -10.515  -2.816
  118   1HG1  VAL  18          1HG1      VAL  18   1.972  -8.375  -2.551
  119   2HG1  VAL  18          2HG1      VAL  18   1.923  -9.915  -1.694
  120   3HG1  VAL  18          3HG1      VAL  18   0.689  -8.694  -1.383
  121   1HG2  VAL  18          1HG2      VAL  18  -1.136  -9.124  -4.530
  122   2HG2  VAL  18          2HG2      VAL  18   0.098  -7.889  -4.283
  123   3HG2  VAL  18          3HG2      VAL  18  -1.063  -8.244  -3.003
  124    H    MET  19           H        MET  19   0.814 -12.699  -3.641
  125    HA   MET  19           HA       MET  19   3.033 -13.272  -2.018
  126   1HB   MET  19          2HB       MET  19   0.892 -14.526  -1.977
  127   2HB   MET  19          1HB       MET  19   1.290 -15.214  -3.545
  128   1HG   MET  19          2HG       MET  19   3.205 -16.348  -2.595
  129   2HG   MET  19          1HG       MET  19   2.897 -15.602  -1.029
  130   1HE   MET  19          1HE       MET  19   0.104 -18.703  -3.008
  131   2HE   MET  19          2HE       MET  19   1.616 -18.144  -3.721
  132   3HE   MET  19          3HE       MET  19   0.249 -17.041  -3.579
  133    H    SER  20           H        SER  20   2.477 -13.704  -5.463
  134    HA   SER  20           HA       SER  20   4.867 -15.151  -5.974
  135   1HB   SER  20          2HB       SER  20   2.914 -15.121  -7.514
  136   2HB   SER  20          1HB       SER  20   3.233 -13.424  -7.857
  137    HG   SER  20           HG       SER  20   4.756 -13.993  -9.183
  138    H    ALA  21           H        ALA  21   4.002 -11.729  -5.985
  139    HA   ALA  21           HA       ALA  21   6.417 -10.761  -7.084
  140   1HB   ALA  21          1HB       ALA  21   5.690  -8.574  -6.324
  141   2HB   ALA  21          2HB       ALA  21   4.481  -9.320  -5.277
  142   3HB   ALA  21          3HB       ALA  21   4.334  -9.457  -7.029
  143    H    THR  22           H        THR  22   5.338 -11.208  -3.737
  144    HA   THR  22           HA       THR  22   7.571 -10.016  -2.516
  145    HB   THR  22           HB       THR  22   5.321 -10.625  -1.440
  146    HG1  THR  22           1HG      THR  22   6.312 -10.162   0.346
  147   1HG2  THR  22          1HG2      THR  22   6.743 -13.254  -1.011
  148   2HG2  THR  22          2HG2      THR  22   5.301 -13.006  -1.999
  149   3HG2  THR  22          3HG2      THR  22   5.228 -12.757  -0.254
  150    H    SER  23           H        SER  23   7.110 -13.162  -3.919
  151    HA   SER  23           HA       SER  23   9.516 -14.262  -2.764
  152   1HB   SER  23          2HB       SER  23   7.617 -15.721  -3.376
  153   2HB   SER  23          1HB       SER  23   7.818 -15.265  -5.067
  154    HG   SER  23           HG       SER  23   8.983 -17.068  -4.949
  155    H    ALA  24           H        ALA  24   8.499 -12.796  -5.801
  156    HA   ALA  24           HA       ALA  24  10.830 -13.290  -7.286
  157   1HB   ALA  24          1HB       ALA  24   8.905 -10.985  -7.552
  158   2HB   ALA  24          2HB       ALA  24   8.718 -12.573  -8.297
  159   3HB   ALA  24          3HB       ALA  24  10.056 -11.529  -8.773
  160    H    ILE  25           H        ILE  25   9.857 -10.418  -5.409
  161    HA   ILE  25           HA       ILE  25  12.211  -8.957  -5.947
  162    HB   ILE  25           HB       ILE  25  10.153  -7.874  -5.186
  163   1HG1  ILE  25          2HG1      ILE  25  12.444  -7.444  -3.256
  164   2HG1  ILE  25          1HG1      ILE  25  12.345  -6.763  -4.874
  165   1HG2  ILE  25          1HG2      ILE  25   9.373  -9.536  -3.603
  166   2HG2  ILE  25          2HG2      ILE  25   9.484  -7.956  -2.826
  167   3HG2  ILE  25          3HG2      ILE  25  10.724  -9.175  -2.525
  168   1HD1  ILE  25          1HD1      ILE  25  10.370  -5.494  -4.222
  169   2HD1  ILE  25          2HD1      ILE  25  11.749  -5.126  -3.186
  170   3HD1  ILE  25          3HD1      ILE  25  10.462  -6.183  -2.600
  171    H    ASN  26           H        ASN  26  11.456 -11.378  -3.561
  172    HA   ASN  26           HA       ASN  26  13.630 -10.952  -1.806
  173   1HB   ASN  26          2HB       ASN  26  11.720 -12.414  -1.249
  174   2HB   ASN  26          1HB       ASN  26  12.217 -13.536  -2.512
  175   1HD2  ASN  26          1HD2      ASN  26  12.580 -15.259  -1.208
  176   2HD2  ASN  26          2HD2      ASN  26  13.851 -15.322  -0.029
  177    H    GLY  27           H        GLY  27  13.203 -13.018  -4.648
  178   1HA   GLY  27          2HA       GLY  27  15.831 -14.112  -4.583
  179   2HA   GLY  27          1HA       GLY  27  14.697 -14.211  -5.919
  180    H    LEU  28           H        LEU  28  14.594 -11.131  -5.726
  181    HA   LEU  28           HA       LEU  28  16.573 -10.614  -7.712
  182   1HB   LEU  28          2HB       LEU  28  14.895  -8.691  -6.094
  183   2HB   LEU  28          1HB       LEU  28  15.859  -8.253  -7.489
  184    HG   LEU  28           HG       LEU  28  13.464 -10.089  -7.498
  185   1HD1  LEU  28          1HD1      LEU  28  12.867  -7.757  -7.172
  186   2HD1  LEU  28          2HD1      LEU  28  12.410  -8.295  -8.789
  187   3HD1  LEU  28          3HD1      LEU  28  13.845  -7.294  -8.564
  188   1HD2  LEU  28          1HD2      LEU  28  15.102 -10.774  -9.158
  189   2HD2  LEU  28          2HD2      LEU  28  15.202  -9.123  -9.766
  190   3HD2  LEU  28          3HD2      LEU  28  13.703 -10.036  -9.938
  191    H    TYR  29           H        TYR  29  16.501 -10.473  -4.282
  192    HA   TYR  29           HA       TYR  29  19.002  -8.924  -4.248
  193   1HB   TYR  29          2HB       TYR  29  16.767  -9.157  -2.248
  194   2HB   TYR  29          1HB       TYR  29  18.367  -8.613  -1.760
  195    HD1  TYR  29           1HD      TYR  29  16.093  -7.889  -4.652
  196    HD2  TYR  29           2HD      TYR  29  18.483  -6.334  -1.497
  197    HE1  TYR  29           1HE      TYR  29  15.544  -5.607  -5.375
  198    HE2  TYR  29           2HE      TYR  29  17.940  -4.042  -2.206
  199    HH   TYR  29           HH       TYR  29  15.501  -3.359  -4.546
  200    H    ILE  30           H        ILE  30  17.360 -11.460  -2.346
  201    HA   ILE  30           HA       ILE  30  18.109 -13.315  -1.280
  202    HB   ILE  30           HB       ILE  30  20.453 -13.121  -3.174
  203   1HG1  ILE  30          2HG1      ILE  30  17.899 -14.741  -3.364
  204   2HG1  ILE  30          1HG1      ILE  30  18.245 -13.284  -4.288
  205   1HG2  ILE  30          1HG2      ILE  30  20.983 -14.527  -1.269
  206   2HG2  ILE  30          2HG2      ILE  30  20.757 -15.519  -2.709
  207   3HG2  ILE  30          3HG2      ILE  30  19.486 -15.431  -1.490
  208   1HD1  ILE  30          1HD1      ILE  30  19.784 -15.864  -4.442
  209   2HD1  ILE  30          2HD1      ILE  30  20.095 -14.408  -5.392
  210   3HD1  ILE  30          3HD1      ILE  30  18.588 -15.298  -5.609
  211    H    GLY  31           H        GLY  31  18.628 -13.086   0.768
  212   1HA   GLY  31          2HA       GLY  31  19.972 -12.800   2.630
  213   2HA   GLY  31          1HA       GLY  31  21.319 -12.432   1.561
  214    H    GLN  32           H        GLN  32  18.186 -10.837   1.726
  215    HA   GLN  32           HA       GLN  32  19.606  -8.317   2.085
  216   1HB   GLN  32          2HB       GLN  32  17.179  -7.425   1.593
  217   2HB   GLN  32          1HB       GLN  32  18.242  -7.952   0.309
  218   1HG   GLN  32          2HG       GLN  32  16.097  -8.823  -0.153
  219   2HG   GLN  32          1HG       GLN  32  17.096 -10.174   0.369
  220   1HE2  GLN  32          1HE2      GLN  32  15.353 -11.419   0.966
  221   2HE2  GLN  32          2HE2      GLN  32  14.387 -11.057   2.354
  222    H    THR  33           H        THR  33  17.758 -10.504   3.853
  223    HA   THR  33           HA       THR  33  17.047 -10.540   6.015
  224    HB   THR  33           HB       THR  33  18.295  -7.790   6.237
  225    HG1  THR  33           1HG      THR  33  19.300 -10.426   6.584
  226   1HG2  THR  33          1HG2      THR  33  18.350  -8.257   8.646
  227   2HG2  THR  33          2HG2      THR  33  17.500  -9.776   8.369
  228   3HG2  THR  33          3HG2      THR  33  16.698  -8.242   8.034
  229    H    SER  34           H        SER  34  16.645  -7.224   4.798
  230    HA   SER  34           HA       SER  34  13.783  -7.407   4.863
  231   1HB   SER  34          2HB       SER  34  13.707  -5.340   6.469
  232   2HB   SER  34          1HB       SER  34  13.837  -6.961   7.150
  233    HG   SER  34           HG       SER  34  16.126  -5.387   6.586
  234    H    TYR  35           H        TYR  35  16.059  -6.749   3.091
  235    HA   TYR  35           HA       TYR  35  16.671  -5.297   1.443
  236   1HB   TYR  35          2HB       TYR  35  14.031  -3.901   1.924
  237   2HB   TYR  35          1HB       TYR  35  14.979  -3.931   0.441
  238    HD1  TYR  35           1HD      TYR  35  15.157  -6.122  -0.831
  239    HD2  TYR  35           2HD      TYR  35  12.420  -5.548   2.375
  240    HE1  TYR  35           1HE      TYR  35  13.854  -8.064  -1.599
  241    HE2  TYR  35           2HE      TYR  35  11.109  -7.483   1.617
  242    HH   TYR  35           HH       TYR  35  12.266  -9.693  -0.703
  243    H    SER  36           H        SER  36  16.981  -4.706   4.380
  244    HA   SER  36           HA       SER  36  16.926  -1.933   4.793
  245   1HB   SER  36          2HB       SER  36  18.741  -2.661   6.577
  246   2HB   SER  36          1HB       SER  36  17.051  -3.126   6.771
  247    HG   SER  36           HG       SER  36  19.267  -4.674   6.018
  248    H    GLY  37           H        GLY  37  18.463  -0.375   4.571
  249   1HA   GLY  37          2HA       GLY  37  20.781   0.216   3.966
  250   2HA   GLY  37          1HA       GLY  37  20.734  -1.125   2.823
  251    H    LEU  38           H        LEU  38  18.054  -0.673   1.909
  252    HA   LEU  38           HA       LEU  38  18.499   1.586   0.146
  253   1HB   LEU  38          2HB       LEU  38  16.048  -0.148   0.422
  254   2HB   LEU  38          1HB       LEU  38  16.412   0.939  -0.901
  255    HG   LEU  38           HG       LEU  38  17.930  -1.579  -0.227
  256   1HD1  LEU  38          1HD1      LEU  38  16.953  -2.400  -2.325
  257   2HD1  LEU  38          2HD1      LEU  38  16.004  -0.918  -2.447
  258   3HD1  LEU  38          3HD1      LEU  38  15.724  -2.037  -1.113
  259   1HD2  LEU  38          1HD2      LEU  38  19.387   0.105  -1.211
  260   2HD2  LEU  38          2HD2      LEU  38  18.231   0.364  -2.516
  261   3HD2  LEU  38          3HD2      LEU  38  19.063  -1.183  -2.373
  262    H    ASP  39           H        ASP  39  16.890   0.917   3.092
  263    HA   ASP  39           HA       ASP  39  14.692   2.630   3.003
  264   1HB   ASP  39          2HB       ASP  39  14.780   2.522   5.498
  265   2HB   ASP  39          1HB       ASP  39  14.870   0.946   4.721
  266    H    SER  40           H        SER  40  17.929   3.236   4.308
  267    HA   SER  40           HA       SER  40  17.353   5.851   5.181
  268   1HB   SER  40          2HB       SER  40  20.029   4.575   4.560
  269   2HB   SER  40          1HB       SER  40  19.782   6.045   5.502
  270    HG   SER  40           HG       SER  40  18.342   3.802   6.325
  271    H    THR  41           H        THR  41  18.794   4.585   2.195
  272    HA   THR  41           HA       THR  41  19.590   7.108   1.196
  273    HB   THR  41           HB       THR  41  19.454   5.721  -1.061
  274    HG1  THR  41           1HG      THR  41  19.975   3.438  -0.240
  275   1HG2  THR  41          1HG2      THR  41  21.701   4.881  -0.592
  276   2HG2  THR  41          2HG2      THR  41  21.450   5.154   1.133
  277   3HG2  THR  41          3HG2      THR  41  21.502   6.523   0.024
  278    H    ILE  42           H        ILE  42  16.699   5.107   0.586
  279    HA   ILE  42           HA       ILE  42  15.516   6.848  -1.298
  280    HB   ILE  42           HB       ILE  42  14.175   4.931   0.623
  281   1HG1  ILE  42          2HG1      ILE  42  15.744   3.813  -0.885
  282   2HG1  ILE  42          1HG1      ILE  42  14.085   3.411  -1.320
  283   1HG2  ILE  42          1HG2      ILE  42  12.259   5.012  -0.915
  284   2HG2  ILE  42          2HG2      ILE  42  13.069   6.278  -1.838
  285   3HG2  ILE  42          3HG2      ILE  42  12.583   6.579  -0.170
  286   1HD1  ILE  42          1HD1      ILE  42  14.186   5.049  -3.140
  287   2HD1  ILE  42          2HD1      ILE  42  15.419   3.798  -3.295
  288   3HD1  ILE  42          3HD1      ILE  42  15.859   5.403  -2.711
  289    H    LEU  43           H        LEU  43  15.492   6.774   2.210
  290    HA   LEU  43           HA       LEU  43  13.455   8.698   2.606
  291   1HB   LEU  43          2HB       LEU  43  14.262   7.123   4.333
  292   2HB   LEU  43          1HB       LEU  43  15.780   7.995   4.397
  293    HG   LEU  43           HG       LEU  43  14.454  10.030   5.103
  294   1HD1  LEU  43          1HD1      LEU  43  12.290   7.966   5.486
  295   2HD1  LEU  43          2HD1      LEU  43  12.270   9.282   4.311
  296   3HD1  LEU  43          3HD1      LEU  43  12.236   9.642   6.038
  297   1HD2  LEU  43          1HD2      LEU  43  15.755   8.726   6.685
  298   2HD2  LEU  43          2HD2      LEU  43  14.416   7.595   6.884
  299   3HD2  LEU  43          3HD2      LEU  43  14.249   9.265   7.427
  300    H    LEU  44           H        LEU  44  17.005   9.033   2.874
  301    HA   LEU  44           HA       LEU  44  16.839  11.862   3.184
  302   1HB   LEU  44          2HB       LEU  44  19.328  11.803   2.970
  303   2HB   LEU  44          1HB       LEU  44  18.670  10.795   4.238
  304    HG   LEU  44           HG       LEU  44  18.895   8.861   2.548
  305   1HD1  LEU  44          1HD1      LEU  44  20.656   9.122   0.891
  306   2HD1  LEU  44          2HD1      LEU  44  20.797  10.833   1.294
  307   3HD1  LEU  44          3HD1      LEU  44  19.314  10.219   0.564
  308   1HD2  LEU  44          1HD2      LEU  44  20.249   9.092   4.552
  309   2HD2  LEU  44          2HD2      LEU  44  21.342  10.183   3.702
  310   3HD2  LEU  44          3HD2      LEU  44  21.217   8.496   3.204
  311    H    ASN  45           H        ASN  45  16.593   9.913   0.497
  312    HA   ASN  45           HA       ASN  45  17.866  11.125  -1.594
  313   1HB   ASN  45          2HB       ASN  45  16.386   9.150  -1.789
  314   2HB   ASN  45          1HB       ASN  45  14.988  10.201  -1.572
  315   1HD2  ASN  45          1HD2      ASN  45  14.098   9.725  -3.534
  316   2HD2  ASN  45          2HD2      ASN  45  14.773  10.259  -5.029
  317    H    THR  46           H        THR  46  14.613  12.015  -0.445
  318    HA   THR  46           HA       THR  46  15.000  14.631  -1.731
  319    HB   THR  46           HB       THR  46  12.371  13.222  -1.240
  320    HG1  THR  46           1HG      THR  46  12.485  12.995  -3.616
  321   1HG2  THR  46          1HG2      THR  46  13.067  15.652  -2.899
  322   2HG2  THR  46          2HG2      THR  46  12.191  15.660  -1.369
  323   3HG2  THR  46          3HG2      THR  46  11.475  14.902  -2.792
  324    H    SER  47           H        SER  47  15.756  15.751   0.039
  325    HA   SER  47           HA       SER  47  15.603  17.086   1.865
  326   1HB   SER  47          2HB       SER  47  13.540  17.760   0.591
  327   2HB   SER  47          1HB       SER  47  12.620  16.662   1.613
  328    HG   SER  47           HG       SER  47  13.791  18.000   3.371
  329    H    ALA  48           H        ALA  48  15.447  14.021   2.153
  330    HA   ALA  48           HA       ALA  48  15.396  12.471   3.800
  331   1HB   ALA  48          1HB       ALA  48  15.485  13.176   6.147
  332   2HB   ALA  48          2HB       ALA  48  15.137  14.835   5.655
  333   3HB   ALA  48          3HB       ALA  48  16.638  14.061   5.147
  334    H    ILE  49           H        ILE  49  12.898  14.005   2.696
  335    HA   ILE  49           HA       ILE  49  10.986  12.347   4.163
  336    HB   ILE  49           HB       ILE  49  10.441  15.255   3.503
  337   1HG1  ILE  49          2HG1      ILE  49  10.765  13.946   6.217
  338   2HG1  ILE  49          1HG1      ILE  49  11.957  14.989   5.448
  339   1HG2  ILE  49          1HG2      ILE  49   8.738  13.206   4.917
  340   2HG2  ILE  49          2HG2      ILE  49   8.477  13.825   3.287
  341   3HG2  ILE  49          3HG2      ILE  49   8.322  14.903   4.675
  342   1HD1  ILE  49          1HD1      ILE  49   9.177  15.811   6.252
  343   2HD1  ILE  49          2HD1      ILE  49  10.407  16.853   5.539
  344   3HD1  ILE  49          3HD1      ILE  49  10.657  16.167   7.143
  345    HA   PRO  50           HA       PRO  50  10.822  11.659  -0.353
  346   1HB   PRO  50          2HB       PRO  50   9.204   9.341   0.532
  347   2HB   PRO  50          1HB       PRO  50  10.617   9.397  -0.524
  348   1HG   PRO  50          2HG       PRO  50  10.789   8.460   1.980
  349   2HG   PRO  50          1HG       PRO  50  12.112   9.371   1.228
  350   1HD   PRO  50          2HD       PRO  50  10.100  10.266   3.247
  351   2HD   PRO  50          1HD       PRO  50  11.820  10.683   3.106
  352    H    ASP  51           H        ASP  51   9.485  12.942  -1.372
  353    HA   ASP  51           HA       ASP  51   6.884  13.641  -0.454
  354   1HB   ASP  51          2HB       ASP  51   6.760  14.940  -2.545
  355   2HB   ASP  51          1HB       ASP  51   8.286  15.208  -1.709
  356    H    ASN  52           H        ASN  52   8.009  10.970  -2.147
  357    HA   ASN  52           HA       ASN  52   5.834  10.601  -3.955
  358   1HB   ASN  52          2HB       ASN  52   6.763   8.430  -4.396
  359   2HB   ASN  52          1HB       ASN  52   8.098   9.570  -4.258
  360   1HD2  ASN  52          1HD2      ASN  52   6.479   6.859  -2.835
  361   2HD2  ASN  52          2HD2      ASN  52   7.686   6.490  -1.658
  362    H    TYR  53           H        TYR  53   6.081  10.296  -0.623
  363    HA   TYR  53           HA       TYR  53   4.454   7.991  -0.232
  364   1HB   TYR  53          2HB       TYR  53   5.299  10.242   1.577
  365   2HB   TYR  53          1HB       TYR  53   4.196   8.986   2.116
  366    HD1  TYR  53           1HD      TYR  53   5.540   6.690   0.588
  367    HD2  TYR  53           2HD      TYR  53   7.081   9.777   3.076
  368    HE1  TYR  53           1HE      TYR  53   7.433   5.244   1.202
  369    HE2  TYR  53           2HE      TYR  53   8.979   8.342   3.692
  370    HH   TYR  53           HH       TYR  53   9.695   5.414   2.065
  371    H    LYS  54           H        LYS  54   3.638  10.888  -1.529
  372    HA   LYS  54           HA       LYS  54   0.837  10.407  -1.039
  373   1HB   LYS  54          2HB       LYS  54   0.402  12.722  -0.242
  374   2HB   LYS  54          1HB       LYS  54   1.349  11.774   0.895
  375   1HG   LYS  54          2HG       LYS  54   3.398  12.881  -0.086
  376   2HG   LYS  54          1HG       LYS  54   2.290  13.980  -0.913
  377   1HD   LYS  54          2HD       LYS  54   1.337  14.629   1.251
  378   2HD   LYS  54          1HD       LYS  54   2.465  13.545   2.066
  379   1HE   LYS  54          2HE       LYS  54   3.138  16.004   0.459
  380   2HE   LYS  54          1HE       LYS  54   3.314  15.790   2.198
  381   1HZ   LYS  54          1HZ       LYS  54   4.922  14.647   0.014
  382   2HZ   LYS  54          2HZ       LYS  54   4.865  13.877   1.520
  383   3HZ   LYS  54          3HZ       LYS  54   5.440  15.466   1.410
  384    H    ASP  55           H        ASP  55  -0.475  11.363  -2.616
  385    HA   ASP  55           HA       ASP  55   0.899  12.936  -4.682
  386   1HB   ASP  55          2HB       ASP  55   0.585  10.698  -5.572
  387   2HB   ASP  55          1HB       ASP  55  -1.112  10.725  -5.104
  388    H    THR  56           H        THR  56  -0.145  14.733  -5.362
  389    HA   THR  56           HA       THR  56  -2.731  15.300  -4.108
  390    HB   THR  56           HB       THR  56  -2.170  17.690  -4.868
  391    HG1  THR  56           1HG      THR  56  -0.120  18.075  -5.520
  392   1HG2  THR  56          1HG2      THR  56  -0.406  16.326  -2.828
  393   2HG2  THR  56          2HG2      THR  56  -2.028  16.954  -2.539
  394   3HG2  THR  56          3HG2      THR  56  -0.710  18.060  -2.929
  395    H    THR  57           H        THR  57  -1.660  14.024  -6.848
  396    HA   THR  57           HA       THR  57  -3.376  15.419  -8.733
  397    HB   THR  57           HB       THR  57  -2.046  12.795  -9.319
  398    HG1  THR  57           1HG      THR  57  -0.289  13.787  -8.527
  399   1HG2  THR  57          1HG2      THR  57  -3.460  13.844 -11.027
  400   2HG2  THR  57          2HG2      THR  57  -1.772  13.810 -11.534
  401   3HG2  THR  57          3HG2      THR  57  -2.483  15.310 -10.939
  402    H    ASN  58           H        ASN  58  -3.704  13.208  -6.348
  403    HA   ASN  58           HA       ASN  58  -5.627  12.292  -5.520
  404   1HB   ASN  58          2HB       ASN  58  -6.824  12.417  -8.290
  405   2HB   ASN  58          1HB       ASN  58  -7.669  12.056  -6.792
  406   1HD2  ASN  58          1HD2      ASN  58  -6.018  14.222  -5.455
  407   2HD2  ASN  58          2HD2      ASN  58  -6.810  15.687  -5.921
  408    H    LYS  59           H        LYS  59  -3.294  10.961  -6.929
  409    HA   LYS  59           HA       LYS  59  -4.424   8.318  -6.726
  410   1HB   LYS  59          2HB       LYS  59  -3.251   7.842  -9.097
  411   2HB   LYS  59          1HB       LYS  59  -4.957   8.213  -8.905
  412   1HG   LYS  59          2HG       LYS  59  -4.258   9.565 -10.669
  413   2HG   LYS  59          1HG       LYS  59  -4.302  10.651  -9.283
  414   1HD   LYS  59          2HD       LYS  59  -2.308  11.087 -10.538
  415   2HD   LYS  59          1HD       LYS  59  -1.849  10.309  -9.019
  416   1HE   LYS  59          2HE       LYS  59  -0.577   9.353 -10.829
  417   2HE   LYS  59          1HE       LYS  59  -1.707   8.152 -10.210
  418   1HZ   LYS  59          1HZ       LYS  59  -3.190   8.676 -12.071
  419   2HZ   LYS  59          2HZ       LYS  59  -1.679   8.129 -12.607
  420   3HZ   LYS  59          3HZ       LYS  59  -2.051   9.781 -12.675
  421    H    LYS  60           H        LYS  60  -2.899   8.201  -4.980
  422    HA   LYS  60           HA       LYS  60  -0.417   7.029  -6.029
  423   1HB   LYS  60          2HB       LYS  60   0.122   9.221  -4.959
  424   2HB   LYS  60          1HB       LYS  60  -0.537   8.600  -3.452
  425   1HG   LYS  60          2HG       LYS  60   1.683   8.187  -3.122
  426   2HG   LYS  60          1HG       LYS  60   1.207   6.664  -3.874
  427   1HD   LYS  60          2HD       LYS  60   3.206   7.355  -4.939
  428   2HD   LYS  60          1HD       LYS  60   1.894   7.674  -6.080
  429   1HE   LYS  60          2HE       LYS  60   1.906  10.006  -5.544
  430   2HE   LYS  60          1HE       LYS  60   3.032   9.750  -4.214
  431   1HZ   LYS  60          1HZ       LYS  60   4.261  10.626  -6.008
  432   2HZ   LYS  60          2HZ       LYS  60   3.592   9.538  -7.120
  433   3HZ   LYS  60          3HZ       LYS  60   4.664   8.977  -5.935
  434    H    ILE  61           H        ILE  61  -0.305   4.932  -5.473
  435    HA   ILE  61           HA       ILE  61  -1.260   4.149  -2.817
  436    HB   ILE  61           HB       ILE  61  -2.244   2.053  -3.739
  437   1HG1  ILE  61          2HG1      ILE  61  -1.968   3.487  -6.391
  438   2HG1  ILE  61          1HG1      ILE  61  -1.150   1.997  -5.921
  439   1HG2  ILE  61          1HG2      ILE  61  -4.347   3.090  -4.497
  440   2HG2  ILE  61          2HG2      ILE  61  -3.511   4.636  -4.628
  441   3HG2  ILE  61          3HG2      ILE  61  -3.685   3.858  -3.056
  442   1HD1  ILE  61          1HD1      ILE  61  -4.124   2.328  -6.222
  443   2HD1  ILE  61          2HD1      ILE  61  -3.271   0.837  -5.822
  444   3HD1  ILE  61          3HD1      ILE  61  -3.044   1.587  -7.403
  445    H    THR  62           H        THR  62   0.170   2.909  -1.764
  446    HA   THR  62           HA       THR  62   2.446   1.820  -3.205
  447    HB   THR  62           HB       THR  62   1.757   1.899  -0.265
  448    HG1  THR  62           1HG      THR  62   3.660   3.226  -0.229
  449   1HG2  THR  62          1HG2      THR  62   4.306   0.827  -1.444
  450   2HG2  THR  62          2HG2      THR  62   2.964  -0.203  -0.945
  451   3HG2  THR  62          3HG2      THR  62   3.787   0.805   0.243
  452    H    ASN  63           H        ASN  63   2.409  -0.123  -4.073
  453    HA   ASN  63           HA       ASN  63   1.892  -2.571  -3.097
  454   1HB   ASN  63          2HB       ASN  63  -0.367  -2.040  -2.444
  455   2HB   ASN  63          1HB       ASN  63  -0.730  -1.397  -4.041
  456   1HD2  ASN  63          1HD2      ASN  63  -0.320  -4.260  -2.133
  457   2HD2  ASN  63          2HD2      ASN  63  -0.941  -5.373  -3.297
  458    HA   PRO  64           HA       PRO  64   0.675  -2.984  -7.647
  459   1HB   PRO  64          2HB       PRO  64   0.444  -0.443  -8.984
  460   2HB   PRO  64          1HB       PRO  64  -0.837  -1.590  -8.581
  461   1HG   PRO  64          2HG       PRO  64  -0.583   0.887  -7.441
  462   2HG   PRO  64          1HG       PRO  64  -1.385  -0.480  -6.652
  463   1HD   PRO  64          2HD       PRO  64   1.405   0.547  -6.299
  464   2HD   PRO  64          1HD       PRO  64   0.243   0.023  -5.045
  465    H    PHE  65           H        PHE  65   1.702  -3.147  -9.688
  466    HA   PHE  65           HA       PHE  65   4.255  -1.720  -9.934
  467   1HB   PHE  65          2HB       PHE  65   5.295  -3.866 -10.724
  468   2HB   PHE  65          1HB       PHE  65   4.863  -3.855  -9.019
  469    HD1  PHE  65           1HD      PHE  65   3.147  -5.307  -8.163
  470    HD2  PHE  65           2HD      PHE  65   4.048  -5.214 -12.320
  471    HE1  PHE  65           1HE      PHE  65   1.858  -7.376  -8.484
  472    HE2  PHE  65           2HE      PHE  65   2.759  -7.283 -12.650
  473    HZ   PHE  65           HZ       PHE  65   1.679  -8.382 -10.698
  474    H    GLY  66           H        GLY  66   1.380  -2.077 -11.260
  475   1HA   GLY  66          2HA       GLY  66   2.290  -2.545 -14.020
  476   2HA   GLY  66          1HA       GLY  66   0.620  -2.560 -13.468
  477    H    GLY  67           H        GLY  67   2.989  -0.112 -12.680
  478   1HA   GLY  67          2HA       GLY  67   2.032   1.785 -14.601
  479   2HA   GLY  67          1HA       GLY  67   1.449   2.085 -12.963
  480    H    GLU  68           H        GLU  68   2.640   3.984 -12.717
  481    HA   GLU  68           HA       GLU  68   5.536   3.802 -12.831
  482   1HB   GLU  68          2HB       GLU  68   3.672   5.994 -11.951
  483   2HB   GLU  68          1HB       GLU  68   5.420   6.170 -12.057
  484   1HG   GLU  68          2HG       GLU  68   3.475   5.695 -14.298
  485   2HG   GLU  68          1HG       GLU  68   4.430   7.144 -13.999
  486    H    LEU  69           H        LEU  69   6.290   2.516 -11.235
  487    HA   LEU  69           HA       LEU  69   5.293   2.964  -8.513
  488   1HB   LEU  69          2HB       LEU  69   5.813   0.750  -7.946
  489   2HB   LEU  69          1HB       LEU  69   5.031   0.668  -9.508
  490    HG   LEU  69           HG       LEU  69   8.034   0.576  -9.208
  491   1HD1  LEU  69          1HD1      LEU  69   6.092  -1.727  -9.278
  492   2HD1  LEU  69          2HD1      LEU  69   7.111  -1.255  -7.916
  493   3HD1  LEU  69          3HD1      LEU  69   7.844  -1.860  -9.403
  494   1HD2  LEU  69          1HD2      LEU  69   7.720  -0.733 -11.393
  495   2HD2  LEU  69          2HD2      LEU  69   7.525   1.014 -11.447
  496   3HD2  LEU  69          3HD2      LEU  69   6.101  -0.030 -11.426
  497    H    ASN  70           H        ASN  70   6.622   3.383  -6.857
  498    HA   ASN  70           HA       ASN  70   9.475   3.814  -7.441
  499   1HB   ASN  70          2HB       ASN  70   8.212   5.762  -6.554
  500   2HB   ASN  70          1HB       ASN  70   7.792   4.820  -5.128
  501   1HD2  ASN  70          1HD2      ASN  70   8.810   6.180  -3.686
  502   2HD2  ASN  70          2HD2      ASN  70  10.531   6.333  -3.608
  503    H    VAL  71           H        VAL  71  11.041   2.856  -6.114
  504    HA   VAL  71           HA       VAL  71  10.047   0.504  -4.667
  505    HB   VAL  71           HB       VAL  71  12.340  -0.400  -4.910
  506   1HG1  VAL  71          1HG1      VAL  71  12.233  -0.795  -7.347
  507   2HG1  VAL  71          2HG1      VAL  71  11.009   0.469  -7.476
  508   3HG1  VAL  71          3HG1      VAL  71  10.669  -0.997  -6.553
  509   1HG2  VAL  71          1HG2      VAL  71  13.931   0.696  -6.414
  510   2HG2  VAL  71          2HG2      VAL  71  13.566   1.711  -5.016
  511   3HG2  VAL  71          3HG2      VAL  71  12.831   2.066  -6.580
  512    H    GLY  72           H        GLY  72  10.592   0.083  -2.572
  513   1HA   GLY  72          2HA       GLY  72  12.724   1.348  -1.192
  514   2HA   GLY  72          1HA       GLY  72  11.194   2.119  -0.793
  515    HA   PRO  73           HA       PRO  73  11.419  -1.910   1.585
  516   1HB   PRO  73          2HB       PRO  73  13.554  -1.978   3.134
  517   2HB   PRO  73          1HB       PRO  73  13.712  -2.332   1.407
  518   1HG   PRO  73          2HG       PRO  73  14.437   0.140   2.906
  519   2HG   PRO  73          1HG       PRO  73  15.251  -0.620   1.530
  520   1HD   PRO  73          2HD       PRO  73  13.432   1.543   1.433
  521   2HD   PRO  73          1HD       PRO  73  14.059   0.619   0.054
  522    H    ALA  74           H        ALA  74  11.643  -2.264   4.100
  523    HA   ALA  74           HA       ALA  74  10.662   0.161   5.455
  524   1HB   ALA  74          1HB       ALA  74   9.478  -1.319   6.985
  525   2HB   ALA  74          2HB       ALA  74  10.119  -2.725   6.138
  526   3HB   ALA  74          3HB       ALA  74   9.004  -1.634   5.316
  527    H    ASN  75           H        ASN  75  10.934  -0.477   8.047
  528    HA   ASN  75           HA       ASN  75  13.694  -0.149   8.530
  529   1HB   ASN  75          2HB       ASN  75  12.349   0.853  10.148
  530   2HB   ASN  75          1HB       ASN  75  11.308  -0.562  10.301
  531   1HD2  ASN  75          1HD2      ASN  75  14.534   0.680  11.016
  532   2HD2  ASN  75          2HD2      ASN  75  14.817  -0.353  12.378
  533    H    ASN  76           H        ASN  76  11.552  -2.957   9.041
  534    HA   ASN  76           HA       ASN  76  13.761  -4.759   8.788
  535   1HB   ASN  76          2HB       ASN  76  14.006  -3.904  11.142
  536   2HB   ASN  76          1HB       ASN  76  12.433  -4.612  11.499
  537   1HD2  ASN  76          1HD2      ASN  76  14.933  -5.978   9.415
  538   2HD2  ASN  76          2HD2      ASN  76  15.221  -7.383  10.397
  539    H    ASN  77           H        ASN  77  13.110  -7.006   8.932
  540    HA   ASN  77           HA       ASN  77  10.648  -7.423   7.576
  541   1HB   ASN  77          2HB       ASN  77  12.671  -8.739   7.104
  542   2HB   ASN  77          1HB       ASN  77  12.607  -9.423   8.725
  543   1HD2  ASN  77          1HD2      ASN  77  11.164  -9.397   5.571
  544   2HD2  ASN  77          2HD2      ASN  77  10.225 -10.835   5.757
  545    H    THR  78           H        THR  78  11.614  -7.656  10.895
  546    HA   THR  78           HA       THR  78   9.493  -9.337  11.763
  547    HB   THR  78           HB       THR  78  11.119  -7.406  13.426
  548    HG1  THR  78           1HG      THR  78  11.764  -9.840  12.185
  549   1HG2  THR  78          1HG2      THR  78   9.208  -8.446  14.570
  550   2HG2  THR  78          2HG2      THR  78  10.744  -9.029  15.211
  551   3HG2  THR  78          3HG2      THR  78   9.809 -10.039  14.109
  552    H    ALA  79           H        ALA  79   9.523  -6.196  10.662
  553    HA   ALA  79           HA       ALA  79   7.039  -5.573  12.119
  554   1HB   ALA  79          1HB       ALA  79   8.845  -4.011  12.674
  555   2HB   ALA  79          2HB       ALA  79   7.535  -3.206  11.810
  556   3HB   ALA  79          3HB       ALA  79   9.027  -3.617  10.965
  557    H    PHE  80           H        PHE  80   8.775  -4.937   9.088
  558    HA   PHE  80           HA       PHE  80   6.297  -5.356   7.592
  559   1HB   PHE  80          2HB       PHE  80   8.074  -2.920   7.281
  560   2HB   PHE  80          1HB       PHE  80   6.737  -3.337   6.217
  561    HD1  PHE  80           1HD      PHE  80   7.724  -1.585   9.139
  562    HD2  PHE  80           2HD      PHE  80   4.408  -3.503   7.283
  563    HE1  PHE  80           1HE      PHE  80   6.186  -0.327  10.592
  564    HE2  PHE  80           2HE      PHE  80   2.868  -2.255   8.733
  565    HZ   PHE  80           HZ       PHE  80   3.755  -0.663  10.389
  566    H    GLY  81           H        GLY  81   7.783  -4.250   5.189
  567   1HA   GLY  81          2HA       GLY  81  10.083  -6.003   4.958
  568   2HA   GLY  81          1HA       GLY  81   8.711  -6.455   3.957
  569    H    TYR  82           H        TYR  82   7.990  -4.997   2.352
  570    HA   TYR  82           HA       TYR  82   9.833  -2.845   1.631
  571   1HB   TYR  82          2HB       TYR  82   9.828  -3.603  -0.720
  572   2HB   TYR  82          1HB       TYR  82  10.538  -4.819   0.340
  573    HD1  TYR  82           1HD      TYR  82   9.152  -6.830   0.982
  574    HD2  TYR  82           2HD      TYR  82   7.933  -4.101  -2.048
  575    HE1  TYR  82           1HE      TYR  82   7.566  -8.498   0.124
  576    HE2  TYR  82           2HE      TYR  82   6.343  -5.766  -2.911
  577    HH   TYR  82           HH       TYR  82   5.471  -8.537  -1.180
  578    H    TYR  83           H        TYR  83   8.851  -1.434  -0.065
  579    HA   TYR  83           HA       TYR  83   5.960  -1.668  -0.314
  580   1HB   TYR  83          2HB       TYR  83   5.514   0.565   0.408
  581   2HB   TYR  83          1HB       TYR  83   6.463  -0.200   1.669
  582    HD1  TYR  83           1HD      TYR  83   8.526   0.719   2.354
  583    HD2  TYR  83           2HD      TYR  83   6.626   2.207  -1.148
  584    HE1  TYR  83           1HE      TYR  83  10.128   2.583   2.287
  585    HE2  TYR  83           2HE      TYR  83   8.224   4.075  -1.223
  586    HH   TYR  83           HH       TYR  83  10.968   4.235   0.959
  587    H    LEU  84           H        LEU  84   5.143  -0.742  -2.177
  588    HA   LEU  84           HA       LEU  84   7.088   0.509  -3.994
  589   1HB   LEU  84          2HB       LEU  84   4.922  -1.462  -4.736
  590   2HB   LEU  84          1HB       LEU  84   5.954  -0.621  -5.875
  591    HG   LEU  84           HG       LEU  84   6.933  -2.583  -3.799
  592   1HD1  LEU  84          1HD1      LEU  84   5.559  -3.686  -5.481
  593   2HD1  LEU  84          2HD1      LEU  84   7.258  -4.107  -5.679
  594   3HD1  LEU  84          3HD1      LEU  84   6.509  -2.935  -6.762
  595   1HD2  LEU  84          1HD2      LEU  84   9.025  -2.495  -5.064
  596   2HD2  LEU  84          2HD2      LEU  84   8.597  -0.911  -4.419
  597   3HD2  LEU  84          3HD2      LEU  84   8.332  -1.267  -6.126
  598    H    THR  85           H        THR  85   6.414   2.610  -3.795
  599    HA   THR  85           HA       THR  85   3.600   3.225  -3.626
  600    HB   THR  85           HB       THR  85   5.787   5.276  -3.922
  601    HG1  THR  85           1HG      THR  85   5.035   3.926  -1.508
  602   1HG2  THR  85          1HG2      THR  85   3.454   6.032  -3.896
  603   2HG2  THR  85          2HG2      THR  85   4.315   6.565  -2.452
  604   3HG2  THR  85          3HG2      THR  85   3.202   5.200  -2.360
  605    H    LEU  86           H        LEU  86   2.465   3.178  -5.430
  606    HA   LEU  86           HA       LEU  86   3.747   4.043  -7.933
  607   1HB   LEU  86          2HB       LEU  86   3.337   1.667  -7.913
  608   2HB   LEU  86          1HB       LEU  86   1.681   1.912  -7.404
  609    HG   LEU  86           HG       LEU  86   2.450   3.131  -9.994
  610   1HD1  LEU  86          1HD1      LEU  86   3.583   0.967 -10.093
  611   2HD1  LEU  86          2HD1      LEU  86   2.185   1.007 -11.168
  612   3HD1  LEU  86          3HD1      LEU  86   2.087   0.160  -9.622
  613   1HD2  LEU  86          1HD2      LEU  86   0.211   2.350 -10.588
  614   2HD2  LEU  86          2HD2      LEU  86   0.181   3.297  -9.100
  615   3HD2  LEU  86          3HD2      LEU  86   0.077   1.537  -9.029
  616    H    THR  87           H        THR  87   2.608   5.384  -9.320
  617    HA   THR  87           HA       THR  87   0.225   6.637  -8.191
  618    HB   THR  87           HB       THR  87   0.506   8.187 -10.189
  619    HG1  THR  87           1HG      THR  87   2.083   7.806 -11.569
  620   1HG2  THR  87          1HG2      THR  87   1.297   8.840  -7.988
  621   2HG2  THR  87          2HG2      THR  87   2.439   9.372  -9.222
  622   3HG2  THR  87          3HG2      THR  87   2.800   7.951  -8.243
  623    H    ARG  88           H        ARG  88  -1.715   6.018  -8.784
  624    HA   ARG  88           HA       ARG  88  -2.908   5.834 -11.168
  625   1HB   ARG  88          2HB       ARG  88  -1.215   4.008 -11.738
  626   2HB   ARG  88          1HB       ARG  88  -2.007   2.996 -10.542
  627   1HG   ARG  88          2HG       ARG  88  -4.136   3.285 -11.814
  628   2HG   ARG  88          1HG       ARG  88  -3.208   4.111 -13.068
  629   1HD   ARG  88          2HD       ARG  88  -3.410   1.852 -13.752
  630   2HD   ARG  88          1HD       ARG  88  -1.754   2.067 -13.184
  631    HE   ARG  88           HE       ARG  88  -3.896   0.751 -11.630
  632   1HH1  ARG  88          1HH1      ARG  88  -0.512   1.185 -12.425
  633   2HH1  ARG  88          2HH1      ARG  88   0.013  -0.156 -11.462
  634   1HH2  ARG  88          1HH2      ARG  88  -3.233  -1.018 -10.397
  635   2HH2  ARG  88          2HH2      ARG  88  -1.548  -1.451 -10.332
  636    H    LEU  89           H        LEU  89  -4.767   6.340 -10.104
  637    HA   LEU  89           HA       LEU  89  -6.109   4.225  -8.685
  638   1HB   LEU  89          2HB       LEU  89  -4.561   5.509  -7.034
  639   2HB   LEU  89          1HB       LEU  89  -5.755   6.783  -7.156
  640    HG   LEU  89           HG       LEU  89  -6.002   5.295  -5.160
  641   1HD1  LEU  89          1HD1      LEU  89  -8.328   5.326  -7.071
  642   2HD1  LEU  89          2HD1      LEU  89  -7.891   6.599  -5.931
  643   3HD1  LEU  89          3HD1      LEU  89  -8.423   5.027  -5.337
  644   1HD2  LEU  89          1HD2      LEU  89  -5.373   3.193  -6.254
  645   2HD2  LEU  89          2HD2      LEU  89  -6.868   3.243  -7.188
  646   3HD2  LEU  89          3HD2      LEU  89  -6.927   3.082  -5.434
  647    H    ASP  90           H        ASP  90  -8.118   4.289  -9.302
  648    HA   ASP  90           HA       ASP  90  -9.320   6.856 -10.079
  649   1HB   ASP  90          2HB       ASP  90 -10.798   5.492 -11.579
  650   2HB   ASP  90          1HB       ASP  90  -9.102   5.493 -12.050
  651    H    LYS  91           H        LYS  91 -11.884   6.487 -10.113
  652    HA   LYS  91           HA       LYS  91 -12.506   6.306  -7.345
  653   1HB   LYS  91          2HB       LYS  91 -13.626   7.899  -8.836
  654   2HB   LYS  91          1HB       LYS  91 -14.355   6.566  -9.720
  655   1HG   LYS  91          2HG       LYS  91 -15.880   7.684  -8.111
  656   2HG   LYS  91          1HG       LYS  91 -15.690   5.952  -7.837
  657   1HD   LYS  91          2HD       LYS  91 -14.206   6.341  -5.995
  658   2HD   LYS  91          1HD       LYS  91 -14.137   8.067  -6.350
  659   1HE   LYS  91          2HE       LYS  91 -15.624   7.371  -4.422
  660   2HE   LYS  91          1HE       LYS  91 -16.363   8.403  -5.647
  661   1HZ   LYS  91          1HZ       LYS  91 -17.560   6.614  -6.526
  662   2HZ   LYS  91          2HZ       LYS  91 -17.699   6.420  -4.847
  663   3HZ   LYS  91          3HZ       LYS  91 -16.622   5.455  -5.728
  664    H    ALA  92           H        ALA  92 -13.033   4.188 -10.111
  665    HA   ALA  92           HA       ALA  92 -14.627   2.302  -8.665
  666   1HB   ALA  92          1HB       ALA  92 -14.289   0.829 -10.571
  667   2HB   ALA  92          2HB       ALA  92 -13.025   1.893 -11.191
  668   3HB   ALA  92          3HB       ALA  92 -14.693   2.456 -11.117
  669    H    ALA  93           H        ALA  93 -11.198   2.694  -9.353
  670    HA   ALA  93           HA       ALA  93 -10.254   0.298  -8.301
  671   1HB   ALA  93          1HB       ALA  93  -8.119   1.433  -7.987
  672   2HB   ALA  93          2HB       ALA  93  -8.915   2.990  -8.222
  673   3HB   ALA  93          3HB       ALA  93  -8.839   1.830  -9.548
  674    H    CYS  94           H        CYS  94 -11.140   3.306  -6.716
  675    HA   CYS  94           HA       CYS  94 -10.238   2.800  -4.134
  676   1HB   CYS  94          2HB       CYS  94 -11.215   4.958  -4.888
  677   2HB   CYS  94          1HB       CYS  94 -12.805   4.206  -4.936
  678    H    VAL  95           H        VAL  95 -13.382   1.986  -5.600
  679    HA   VAL  95           HA       VAL  95 -14.378   0.649  -3.315
  680    HB   VAL  95           HB       VAL  95 -15.236   0.293  -6.192
  681   1HG1  VAL  95          1HG1      VAL  95 -16.680  -0.278  -3.604
  682   2HG1  VAL  95          2HG1      VAL  95 -16.091  -1.470  -4.762
  683   3HG1  VAL  95          3HG1      VAL  95 -17.397  -0.374  -5.214
  684   1HG2  VAL  95          1HG2      VAL  95 -15.324   2.635  -5.553
  685   2HG2  VAL  95          2HG2      VAL  95 -16.234   2.223  -4.101
  686   3HG2  VAL  95          3HG2      VAL  95 -16.952   1.974  -5.693
  687    H    SER  96           H        SER  96 -12.535  -0.365  -6.092
  688    HA   SER  96           HA       SER  96 -12.750  -3.140  -5.793
  689   1HB   SER  96          2HB       SER  96 -11.780  -1.963  -7.765
  690   2HB   SER  96          1HB       SER  96 -10.360  -1.574  -6.789
  691    HG   SER  96           HG       SER  96 -10.807  -4.179  -6.566
  692    H    LEU  97           H        LEU  97 -10.350  -0.860  -4.482
  693    HA   LEU  97           HA       LEU  97  -8.891  -2.873  -3.090
  694   1HB   LEU  97          2HB       LEU  97  -8.949   0.124  -2.749
  695   2HB   LEU  97          1HB       LEU  97  -7.788  -0.949  -1.984
  696    HG   LEU  97           HG       LEU  97  -8.102  -0.690  -4.975
  697   1HD1  LEU  97          1HD1      LEU  97  -6.070   0.654  -4.910
  698   2HD1  LEU  97          2HD1      LEU  97  -6.079   0.601  -3.148
  699   3HD1  LEU  97          3HD1      LEU  97  -7.371   1.432  -4.013
  700   1HD2  LEU  97          1HD2      LEU  97  -5.952  -1.927  -3.262
  701   2HD2  LEU  97          2HD2      LEU  97  -5.932  -1.812  -5.021
  702   3HD2  LEU  97          3HD2      LEU  97  -7.147  -2.803  -4.214
  703    H    ALA  98           H        ALA  98 -11.560  -0.767  -2.287
  704    HA   ALA  98           HA       ALA  98 -11.542  -1.322   0.516
  705   1HB   ALA  98          1HB       ALA  98 -13.702  -0.207   0.552
  706   2HB   ALA  98          2HB       ALA  98 -13.778  -0.263  -1.209
  707   3HB   ALA  98          3HB       ALA  98 -12.546   0.712  -0.410
  708    H    THR  99           H        THR  99 -12.307  -3.223  -2.108
  709    HA   THR  99           HA       THR  99 -13.961  -4.966  -0.414
  710    HB   THR  99           HB       THR  99 -14.923  -5.906  -2.533
  711    HG1  THR  99           1HG      THR  99 -13.821  -3.556  -3.717
  712   1HG2  THR  99          1HG2      THR  99 -16.519  -4.099  -2.869
  713   2HG2  THR  99          2HG2      THR  99 -15.416  -2.960  -2.095
  714   3HG2  THR  99          3HG2      THR  99 -16.138  -4.265  -1.155
  715    H    LEU 100           H        LEU 100 -10.983  -4.558  -1.391
  716    HA   LEU 100           HA       LEU 100 -10.449  -7.414  -1.897
  717   1HB   LEU 100          2HB       LEU 100  -9.674  -5.488  -3.495
  718   2HB   LEU 100          1HB       LEU 100  -8.453  -5.201  -2.271
  719    HG   LEU 100           HG       LEU 100  -8.790  -7.877  -3.621
  720   1HD1  LEU 100          1HD1      LEU 100  -6.968  -5.607  -4.404
  721   2HD1  LEU 100          2HD1      LEU 100  -8.364  -6.175  -5.320
  722   3HD1  LEU 100          3HD1      LEU 100  -6.965  -7.227  -5.098
  723   1HD2  LEU 100          1HD2      LEU 100  -7.530  -7.912  -1.531
  724   2HD2  LEU 100          2HD2      LEU 100  -6.489  -6.617  -2.124
  725   3HD2  LEU 100          3HD2      LEU 100  -6.465  -8.197  -2.908
  726    H    ASN 101           H        ASN 101  -9.159  -8.519  -0.407
  727    HA   ASN 101           HA       ASN 101  -8.913  -7.158   2.126
  728   1HB   ASN 101          2HB       ASN 101  -9.791  -9.418   2.150
  729   2HB   ASN 101          1HB       ASN 101  -8.318 -10.026   1.397
  730   1HD2  ASN 101          1HD2      ASN 101  -9.630  -8.532   4.294
  731   2HD2  ASN 101          2HD2      ASN 101  -8.396  -9.106   5.362
  732    H    LEU 102           H        LEU 102  -7.282  -5.655   1.647
  733    HA   LEU 102           HA       LEU 102  -4.587  -6.623   1.336
  734   1HB   LEU 102          2HB       LEU 102  -5.713  -3.910   1.991
  735   2HB   LEU 102          1HB       LEU 102  -3.993  -4.236   2.017
  736    HG   LEU 102           HG       LEU 102  -4.430  -3.226  -0.067
  737   1HD1  LEU 102          1HD1      LEU 102  -4.322  -6.199  -0.542
  738   2HD1  LEU 102          2HD1      LEU 102  -2.945  -5.158  -0.183
  739   3HD1  LEU 102          3HD1      LEU 102  -3.845  -4.940  -1.683
  740   1HD2  LEU 102          1HD2      LEU 102  -6.852  -3.485  -0.095
  741   2HD2  LEU 102          2HD2      LEU 102  -6.673  -5.201  -0.458
  742   3HD2  LEU 102          3HD2      LEU 102  -6.141  -3.993  -1.626
  743    H    GLY 103           H        GLY 103  -5.187  -8.189   3.135
  744   1HA   GLY 103          2HA       GLY 103  -3.979  -7.137   5.594
  745   2HA   GLY 103          1HA       GLY 103  -5.520  -7.979   5.714
  746    H    THR 104           H        THR 104  -5.363 -10.101   4.162
  747    HA   THR 104           HA       THR 104  -3.407 -11.785   5.384
  748    HB   THR 104           HB       THR 104  -5.217 -12.400   3.037
  749    HG1  THR 104           1HG      THR 104  -6.520 -13.356   4.810
  750   1HG2  THR 104          1HG2      THR 104  -4.973 -14.732   3.768
  751   2HG2  THR 104          2HG2      THR 104  -3.854 -14.217   5.030
  752   3HG2  THR 104          3HG2      THR 104  -3.414 -14.030   3.333
  753    H    SER 105           H        SER 105  -3.547  -9.898   2.504
  754    HA   SER 105           HA       SER 105  -1.048 -11.137   1.564
  755   1HB   SER 105          2HB       SER 105  -3.064 -11.388   0.056
  756   2HB   SER 105          1HB       SER 105  -3.055  -9.635  -0.135
  757    HG   SER 105           HG       SER 105  -0.739 -10.033  -0.783
  758    H    ALA 106           H        ALA 106  -1.626  -8.886   3.484
  759    HA   ALA 106           HA       ALA 106   0.301  -7.037   2.328
  760   1HB   ALA 106          1HB       ALA 106  -2.363  -6.110   3.403
  761   2HB   ALA 106          2HB       ALA 106  -1.839  -6.042   1.721
  762   3HB   ALA 106          3HB       ALA 106  -1.020  -5.063   2.938
  763    H    LYS 107           H        LYS 107   1.351  -5.719   3.947
  764    HA   LYS 107           HA       LYS 107   1.408  -6.984   6.530
  765   1HB   LYS 107          2HB       LYS 107   2.945  -4.739   5.273
  766   2HB   LYS 107          1HB       LYS 107   2.960  -4.914   7.019
  767   1HG   LYS 107          2HG       LYS 107   4.853  -6.051   6.397
  768   2HG   LYS 107          1HG       LYS 107   3.675  -7.353   6.520
  769   1HD   LYS 107          2HD       LYS 107   3.413  -7.447   4.150
  770   2HD   LYS 107          1HD       LYS 107   4.347  -5.962   3.935
  771   1HE   LYS 107          2HE       LYS 107   6.311  -7.160   4.941
  772   2HE   LYS 107          1HE       LYS 107   5.355  -8.638   4.894
  773   1HZ   LYS 107          1HZ       LYS 107   6.863  -8.402   2.983
  774   2HZ   LYS 107          2HZ       LYS 107   6.036  -7.004   2.506
  775   3HZ   LYS 107          3HZ       LYS 107   5.242  -8.491   2.501
  776    H    GLY 108           H        GLY 108   0.389  -3.936   5.109
  777   1HA   GLY 108          2HA       GLY 108  -1.805  -3.641   6.860
  778   2HA   GLY 108          1HA       GLY 108  -0.505  -2.584   7.371
  779    H    TYR 109           H        TYR 109  -3.019  -1.734   6.442
  780    HA   TYR 109           HA       TYR 109  -2.298  -0.527   3.858
  781   1HB   TYR 109          2HB       TYR 109  -3.992  -2.313   3.689
  782   2HB   TYR 109          1HB       TYR 109  -5.009  -1.448   4.843
  783    HD1  TYR 109           1HD      TYR 109  -4.209  -1.971   1.458
  784    HD2  TYR 109           2HD      TYR 109  -5.823   0.888   4.126
  785    HE1  TYR 109           1HE      TYR 109  -5.333  -0.865  -0.438
  786    HE2  TYR 109           2HE      TYR 109  -6.958   2.018   2.254
  787    HH   TYR 109           HH       TYR 109  -6.817   2.226  -0.131
  788    H    GLY 110           H        GLY 110  -2.225   1.680   3.900
  789   1HA   GLY 110          2HA       GLY 110  -3.569   3.006   6.175
  790   2HA   GLY 110          1HA       GLY 110  -1.897   3.354   5.764
  791    H    VAL 111           H        VAL 111  -5.083   4.282   5.345
  792    HA   VAL 111           HA       VAL 111  -4.725   5.546   2.753
  793    HB   VAL 111           HB       VAL 111  -7.073   5.768   4.646
  794   1HG1  VAL 111          1HG1      VAL 111  -8.318   6.496   2.683
  795   2HG1  VAL 111          2HG1      VAL 111  -6.860   6.370   1.699
  796   3HG1  VAL 111          3HG1      VAL 111  -6.950   7.566   2.992
  797   1HG2  VAL 111          1HG2      VAL 111  -6.676   3.911   2.309
  798   2HG2  VAL 111          2HG2      VAL 111  -8.166   4.097   3.235
  799   3HG2  VAL 111          3HG2      VAL 111  -6.721   3.450   4.011
  800    H    ASN 112           H        ASN 112  -4.094   7.587   2.458
  801    HA   ASN 112           HA       ASN 112  -3.522   9.749   2.805
  802   1HB   ASN 112          2HB       ASN 112  -5.980   9.689   3.704
  803   2HB   ASN 112          1HB       ASN 112  -5.214   9.854   5.279
  804   1HD2  ASN 112          1HD2      ASN 112  -6.983  11.683   3.948
  805   2HD2  ASN 112          2HD2      ASN 112  -6.097  13.159   3.746
  806    H    ILE 113           H        ILE 113  -1.949   7.664   3.924
  807    HA   ILE 113           HA       ILE 113  -0.924   8.795   6.409
  808    HB   ILE 113           HB       ILE 113  -0.738   6.151   5.102
  809   1HG1  ILE 113          2HG1      ILE 113  -0.677   5.418   7.490
  810   2HG1  ILE 113          1HG1      ILE 113  -0.672   7.110   7.968
  811   1HG2  ILE 113          1HG2      ILE 113   1.356   5.528   6.236
  812   2HG2  ILE 113          2HG2      ILE 113   1.603   7.219   6.674
  813   3HG2  ILE 113          3HG2      ILE 113   1.605   6.737   4.978
  814   1HD1  ILE 113          1HD1      ILE 113  -2.855   7.409   6.936
  815   2HD1  ILE 113          2HD1      ILE 113  -2.884   6.131   8.152
  816   3HD1  ILE 113          3HD1      ILE 113  -2.855   5.719   6.436
  817    H    SER 114           H        SER 114   1.027   9.786   6.581
  818    HA   SER 114           HA       SER 114   2.691   9.959   4.159
  819   1HB   SER 114          2HB       SER 114   1.748  12.152   4.745
  820   2HB   SER 114          1HB       SER 114   2.382  12.003   6.383
  821    HG   SER 114           HG       SER 114   4.155  12.827   5.645
  822    H    GLY 115           H        GLY 115   4.967   9.839   4.488
  823   1HA   GLY 115          2HA       GLY 115   6.871   8.980   5.469
  824   2HA   GLY 115          1HA       GLY 115   6.116   9.277   7.031
  825    H    GLU 116           H        GLU 116   5.425   7.178   4.258
  826    HA   GLU 116           HA       GLU 116   4.189   5.141   5.655
  827   1HB   GLU 116          2HB       GLU 116   3.987   5.319   3.270
  828   2HB   GLU 116          1HB       GLU 116   5.714   5.082   3.053
  829   1HG   GLU 116          2HG       GLU 116   5.561   2.804   3.721
  830   2HG   GLU 116          1HG       GLU 116   3.882   3.006   4.218
  831    H    ASN 117           H        ASN 117   7.610   5.665   5.073
  832    HA   ASN 117           HA       ASN 117   8.736   3.246   5.678
  833   1HB   ASN 117          2HB       ASN 117  10.059   5.176   5.005
  834   2HB   ASN 117          1HB       ASN 117   9.698   5.988   6.525
  835   1HD2  ASN 117          1HD2      ASN 117  11.458   3.379   5.014
  836   2HD2  ASN 117          2HD2      ASN 117  12.568   3.118   6.312
  837    H    ASN 118           H        ASN 118   7.343   5.569   7.929
  838    HA   ASN 118           HA       ASN 118   7.448   3.478   9.992
  839   1HB   ASN 118          2HB       ASN 118   9.111   5.281  10.495
  840   2HB   ASN 118          1HB       ASN 118   7.786   6.439  10.540
  841   1HD2  ASN 118          1HD2      ASN 118   8.103   6.979  12.665
  842   2HD2  ASN 118          2HD2      ASN 118   7.765   5.902  13.981
  843    H    ILE 119           H        ILE 119   5.371   3.460   8.481
  844    HA   ILE 119           HA       ILE 119   3.267   5.236   8.982
  845    HB   ILE 119           HB       ILE 119   3.236   3.703   7.097
  846   1HG1  ILE 119          2HG1      ILE 119   0.932   3.085   8.958
  847   2HG1  ILE 119          1HG1      ILE 119   1.079   4.554   8.002
  848   1HG2  ILE 119          1HG2      ILE 119   4.314   1.785   8.097
  849   2HG2  ILE 119          2HG2      ILE 119   2.771   1.313   7.389
  850   3HG2  ILE 119          3HG2      ILE 119   2.916   1.511   9.134
  851   1HD1  ILE 119          1HD1      ILE 119   1.034   3.198   5.953
  852   2HD1  ILE 119          2HD1      ILE 119  -0.422   2.999   6.931
  853   3HD1  ILE 119          3HD1      ILE 119   0.825   1.751   6.938
  854    H    THR 120           H        THR 120   1.448   5.093  10.320
  855    HA   THR 120           HA       THR 120   2.052   4.250  12.974
  856    HB   THR 120           HB       THR 120   0.828   6.334  12.495
  857    HG1  THR 120           1HG      THR 120   0.046   6.062  14.428
  858   1HG2  THR 120          1HG2      THR 120  -1.546   6.251  11.872
  859   2HG2  THR 120          2HG2      THR 120  -1.426   4.505  11.658
  860   3HG2  THR 120          3HG2      THR 120  -0.516   5.588  10.605
  861    H    SER 121           H        SER 121   0.094   3.223  14.243
  862    HA   SER 121           HA       SER 121   0.067   0.512  13.447
  863   1HB   SER 121          2HB       SER 121  -1.560   1.896  15.590
  864   2HB   SER 121          1HB       SER 121  -1.302   0.158  15.447
  865    HG   SER 121           HG       SER 121   1.072   1.342  15.380
  866    H    PHE 122           H        PHE 122  -1.897  -0.824  13.256
  867    HA   PHE 122           HA       PHE 122  -3.695   0.497  11.333
  868   1HB   PHE 122          2HB       PHE 122  -2.916  -2.422  11.464
  869   2HB   PHE 122          1HB       PHE 122  -3.805  -1.620  10.173
  870    HD1  PHE 122           1HD      PHE 122  -2.645  -0.065   8.663
  871    HD2  PHE 122           2HD      PHE 122  -0.548  -2.332  11.585
  872    HE1  PHE 122           1HE      PHE 122  -0.532   0.379   7.487
  873    HE2  PHE 122           2HE      PHE 122   1.569  -1.891  10.417
  874    HZ   PHE 122           HZ       PHE 122   1.580  -0.531   8.364
  875    H    GLY 123           H        GLY 123  -5.796   0.561  11.794
  876   1HA   GLY 123          2HA       GLY 123  -6.892  -1.456  13.665
  877   2HA   GLY 123          1HA       GLY 123  -7.527   0.176  13.496
  878    H    ASN 124           H        ASN 124  -9.275   0.394  12.255
  879    HA   ASN 124           HA       ASN 124  -9.514  -1.287   9.866
  880   1HB   ASN 124          2HB       ASN 124 -11.926  -1.680  10.301
  881   2HB   ASN 124          1HB       ASN 124 -10.878  -2.458  11.483
  882   1HD2  ASN 124          1HD2      ASN 124 -10.950  -1.836  13.582
  883   2HD2  ASN 124          2HD2      ASN 124 -12.113  -0.716  14.209
  884    H    SER 125           H        SER 125  -9.623   1.730  11.263
  885    HA   SER 125           HA       SER 125 -11.629   2.884   9.490
  886   1HB   SER 125          2HB       SER 125 -10.862   5.030  10.640
  887   2HB   SER 125          1HB       SER 125 -11.557   3.806  11.703
  888    HG   SER 125           HG       SER 125  -9.712   4.379  12.712
  889    H    ALA 126           H        ALA 126 -10.821   5.102   8.476
  890    HA   ALA 126           HA       ALA 126  -8.255   4.634   7.128
  891   1HB   ALA 126          1HB       ALA 126  -9.975   3.669   5.704
  892   2HB   ALA 126          2HB       ALA 126  -9.266   5.097   4.951
  893   3HB   ALA 126          3HB       ALA 126 -10.855   5.195   5.708
  894    H    ASP 127           H        ASP 127  -8.007   6.600   5.468
  895    HA   ASP 127           HA       ASP 127  -7.561   8.782   5.135
  896   1HB   ASP 127          2HB       ASP 127 -10.029   8.916   4.981
  897   2HB   ASP 127          1HB       ASP 127 -10.097   9.287   6.700
  898    H    GLN 128           H        GLN 128  -5.717   9.052   6.179
  899    HA   GLN 128           HA       GLN 128  -4.189   9.741   7.680
  900   1HB   GLN 128          2HB       GLN 128  -6.579  11.135   8.874
  901   2HB   GLN 128          1HB       GLN 128  -4.973  11.251   9.584
  902   1HG   GLN 128          2HG       GLN 128  -4.153  12.088   7.374
  903   2HG   GLN 128          1HG       GLN 128  -5.833  12.160   6.849
  904   1HE2  GLN 128          1HE2      GLN 128  -4.864  12.874  10.115
  905   2HE2  GLN 128          2HE2      GLN 128  -5.165  14.577  10.049
  906    H    ALA 129           H        ALA 129  -6.054   7.383   7.995
  907    HA   ALA 129           HA       ALA 129  -4.923   6.493  10.532
  908   1HB   ALA 129          1HB       ALA 129  -7.221   7.174  11.058
  909   2HB   ALA 129          2HB       ALA 129  -7.030   5.426  11.188
  910   3HB   ALA 129          3HB       ALA 129  -7.829   6.122   9.778
  911    H    ALA 130           H        ALA 130  -4.410   4.318  10.534
  912    HA   ALA 130           HA       ALA 130  -4.534   3.037   7.893
  913   1HB   ALA 130          1HB       ALA 130  -2.296   3.455   8.817
  914   2HB   ALA 130          2HB       ALA 130  -2.616   1.735   8.607
  915   3HB   ALA 130          3HB       ALA 130  -2.699   2.456  10.213
  916    H    LYS 131           H        LYS 131  -4.898   0.710   7.819
  917    HA   LYS 131           HA       LYS 131  -6.301  -0.359  10.149
  918   1HB   LYS 131          2HB       LYS 131  -8.279  -0.884   9.038
  919   2HB   LYS 131          1HB       LYS 131  -7.905   0.730   8.443
  920   1HG   LYS 131          2HG       LYS 131  -7.173  -1.770   6.942
  921   2HG   LYS 131          1HG       LYS 131  -8.721  -0.949   6.743
  922   1HD   LYS 131          2HD       LYS 131  -5.980   0.185   6.219
  923   2HD   LYS 131          1HD       LYS 131  -7.204  -0.229   5.019
  924   1HE   LYS 131          2HE       LYS 131  -7.324   1.964   7.080
  925   2HE   LYS 131          1HE       LYS 131  -7.240   2.139   5.327
  926   1HZ   LYS 131          1HZ       LYS 131  -9.404   1.115   5.149
  927   2HZ   LYS 131          2HZ       LYS 131  -9.471   2.494   6.124
  928   3HZ   LYS 131          3HZ       LYS 131  -9.501   0.961   6.836
  929    H    SER 132           H        SER 132  -6.556  -2.658  10.116
  930    HA   SER 132           HA       SER 132  -4.178  -3.921   9.181
  931   1HB   SER 132          2HB       SER 132  -5.172  -4.509  11.334
  932   2HB   SER 132          1HB       SER 132  -6.636  -5.071  10.531
  933    HG   SER 132           HG       SER 132  -4.183  -6.300  10.830
  934    H    THR 133           H        THR 133  -7.589  -4.078   8.260
  935    HA   THR 133           HA       THR 133  -6.755  -5.494   5.822
  936    HB   THR 133           HB       THR 133  -8.944  -6.691   5.867
  937    HG1  THR 133           1HG      THR 133  -9.870  -5.193   7.489
  938   1HG2  THR 133          1HG2      THR 133  -8.267  -8.372   7.548
  939   2HG2  THR 133          2HG2      THR 133  -7.083  -7.233   8.188
  940   3HG2  THR 133          3HG2      THR 133  -6.913  -7.851   6.546
  941    H    ALA 134           H        ALA 134  -7.624  -4.776   3.953
  942    HA   ALA 134           HA       ALA 134  -9.334  -2.414   4.115
  943   1HB   ALA 134          1HB       ALA 134  -8.713  -2.021   1.782
  944   2HB   ALA 134          2HB       ALA 134  -7.808  -3.534   1.768
  945   3HB   ALA 134          3HB       ALA 134  -7.287  -2.205   2.803
  946    H    ILE 135           H        ILE 135 -10.095  -5.309   4.380
  947    HA   ILE 135           HA       ILE 135 -11.810  -5.787   2.085
  948    HB   ILE 135           HB       ILE 135 -10.448  -7.578   3.297
  949   1HG1  ILE 135          2HG1      ILE 135 -12.210  -9.284   3.023
  950   2HG1  ILE 135          1HG1      ILE 135 -13.421  -8.005   2.948
  951   1HG2  ILE 135          1HG2      ILE 135 -12.680  -7.299   5.309
  952   2HG2  ILE 135          2HG2      ILE 135 -10.971  -6.949   5.582
  953   3HG2  ILE 135          3HG2      ILE 135 -11.493  -8.604   5.267
  954   1HD1  ILE 135          1HD1      ILE 135 -12.371  -7.133   0.930
  955   2HD1  ILE 135          2HD1      ILE 135 -12.865  -8.815   0.737
  956   3HD1  ILE 135          3HD1      ILE 135 -11.165  -8.419   1.002
  957    H    THR 136           H        THR 136 -12.110  -3.653   4.268
  958    HA   THR 136           HA       THR 136 -14.483  -4.542   5.704
  959    HB   THR 136           HB       THR 136 -13.026  -1.950   6.167
  960    HG1  THR 136           1HG      THR 136 -11.333  -3.054   6.792
  961   1HG2  THR 136          1HG2      THR 136 -13.771  -2.329   8.484
  962   2HG2  THR 136          2HG2      THR 136 -14.541  -3.833   7.979
  963   3HG2  THR 136          3HG2      THR 136 -15.128  -2.291   7.358
  964    HA   PRO 137           HA       PRO 137 -17.262  -2.167   3.011
  965   1HB   PRO 137          2HB       PRO 137 -18.734  -2.389   5.609
  966   2HB   PRO 137          1HB       PRO 137 -19.329  -2.610   3.960
  967   1HG   PRO 137          2HG       PRO 137 -18.800  -4.716   5.504
  968   2HG   PRO 137          1HG       PRO 137 -18.416  -4.734   3.773
  969   1HD   PRO 137          2HD       PRO 137 -16.598  -4.500   6.109
  970   2HD   PRO 137          1HD       PRO 137 -16.295  -5.196   4.501
  971    H    ALA 138           H        ALA 138 -16.325  -1.419   6.341
  972    HA   ALA 138           HA       ALA 138 -17.190   1.279   6.356
  973   1HB   ALA 138          1HB       ALA 138 -16.743   0.025   8.404
  974   2HB   ALA 138          2HB       ALA 138 -15.804   1.518   8.344
  975   3HB   ALA 138          3HB       ALA 138 -15.025  -0.025   7.998
  976    H    GLU 139           H        GLU 139 -14.332  -0.282   5.121
  977    HA   GLU 139           HA       GLU 139 -12.616   1.926   4.884
  978   1HB   GLU 139          2HB       GLU 139 -11.773  -0.292   4.488
  979   2HB   GLU 139          1HB       GLU 139 -12.918  -0.557   3.191
  980   1HG   GLU 139          2HG       GLU 139 -10.883  -0.172   2.129
  981   2HG   GLU 139          1HG       GLU 139 -11.760   1.352   1.987
  982    H    ALA 140           H        ALA 140 -14.956   0.553   2.600
  983    HA   ALA 140           HA       ALA 140 -14.635   2.409   0.546
  984   1HB   ALA 140          1HB       ALA 140 -17.147   0.930   1.316
  985   2HB   ALA 140          2HB       ALA 140 -15.861   0.309   0.281
  986   3HB   ALA 140          3HB       ALA 140 -16.828   1.689  -0.243
  987    H    ALA 141           H        ALA 141 -16.434   2.619   3.526
  988    HA   ALA 141           HA       ALA 141 -18.000   4.880   2.765
  989   1HB   ALA 141          1HB       ALA 141 -17.385   3.858   5.534
  990   2HB   ALA 141          2HB       ALA 141 -18.703   3.289   4.507
  991   3HB   ALA 141          3HB       ALA 141 -18.689   4.958   5.079
  992    H    THR 142           H        THR 142 -14.953   4.448   4.555
  993    HA   THR 142           HA       THR 142 -14.821   7.284   5.111
  994    HB   THR 142           HB       THR 142 -12.655   5.258   5.643
  995    HG1  THR 142           1HG      THR 142 -14.464   4.434   6.658
  996   1HG2  THR 142          1HG2      THR 142 -12.080   6.780   7.467
  997   2HG2  THR 142          2HG2      THR 142 -13.420   7.835   7.019
  998   3HG2  THR 142          3HG2      THR 142 -12.055   7.627   5.919
  999    H    ALA 143           H        ALA 143 -13.165   4.957   3.000
 1000    HA   ALA 143           HA       ALA 143 -11.189   6.899   2.190
 1001   1HB   ALA 143          1HB       ALA 143 -10.298   5.136   0.791
 1002   2HB   ALA 143          2HB       ALA 143 -11.735   4.152   1.073
 1003   3HB   ALA 143          3HB       ALA 143 -10.639   4.515   2.408
 1004    H    CYS 144           H        CYS 144 -13.948   5.289   0.601
 1005    HA   CYS 144           HA       CYS 144 -13.435   6.688  -1.870
 1006   1HB   CYS 144          2HB       CYS 144 -15.682   4.841  -1.054
 1007   2HB   CYS 144          1HB       CYS 144 -15.480   5.507  -2.670
 1008    H    LYS 145           H        LYS 145 -14.359   8.049   0.730
 1009    HA   LYS 145           HA       LYS 145 -16.251   9.825  -0.621
 1010   1HB   LYS 145          2HB       LYS 145 -16.624   8.548   2.076
 1011   2HB   LYS 145          1HB       LYS 145 -17.358  10.102   1.708
 1012   1HG   LYS 145          2HG       LYS 145 -17.808   7.574   0.135
 1013   2HG   LYS 145          1HG       LYS 145 -18.896   8.210   1.374
 1014   1HD   LYS 145          2HD       LYS 145 -19.229  10.232   0.081
 1015   2HD   LYS 145          1HD       LYS 145 -18.075   9.676  -1.132
 1016   1HE   LYS 145          2HE       LYS 145 -19.538   7.783  -1.646
 1017   2HE   LYS 145          1HE       LYS 145 -20.686   8.342  -0.429
 1018   1HZ   LYS 145          1HZ       LYS 145 -21.343   9.018  -2.651
 1019   2HZ   LYS 145          2HZ       LYS 145 -19.877   9.845  -2.859
 1020   3HZ   LYS 145          3HZ       LYS 145 -20.989  10.374  -1.694
 1021    H    ASN 146           H        ASN 146 -15.750  11.909  -0.411
 1022    HA   ASN 146           HA       ASN 146 -14.903  13.867   0.370
 1023   1HB   ASN 146          2HB       ASN 146 -14.308  12.204   2.805
 1024   2HB   ASN 146          1HB       ASN 146 -13.757  13.868   2.672
 1025   1HD2  ASN 146          1HD2      ASN 146 -16.779  12.794   1.286
 1026   2HD2  ASN 146          2HD2      ASN 146 -17.805  13.645   2.388
 1027    H    THR 147           H        THR 147 -12.801  11.065   0.788
 1028    HA   THR 147           HA       THR 147 -10.352  12.431   0.561
 1029    HB   THR 147           HB       THR 147 -10.858   9.577  -0.291
 1030    HG1  THR 147           1HG      THR 147 -11.403   9.215   1.718
 1031   1HG2  THR 147          1HG2      THR 147  -8.580   9.227   0.522
 1032   2HG2  THR 147          2HG2      THR 147  -8.465  10.929   0.966
 1033   3HG2  THR 147          3HG2      THR 147  -8.609  10.468  -0.730
 1034    H    ASP 148           H        ASP 148 -10.446  13.877  -1.142
 1035    HA   ASP 148           HA       ASP 148 -10.537  12.695  -3.839
 1036   1HB   ASP 148          2HB       ASP 148 -12.376  14.292  -3.372
 1037   2HB   ASP 148          1HB       ASP 148 -11.181  15.541  -3.033
 1038    H    SER 149           H        SER 149  -9.403  15.868  -2.723
 1039    HA   SER 149           HA       SER 149  -7.019  15.778  -4.233
 1040   1HB   SER 149          2HB       SER 149  -7.576  17.454  -1.767
 1041   2HB   SER 149          1HB       SER 149  -6.415  17.809  -3.048
 1042    HG   SER 149           HG       SER 149  -8.449  17.681  -4.442
 1043    H    THR 150           H        THR 150  -7.910  14.564  -1.162
 1044    HA   THR 150           HA       THR 150  -5.165  14.122  -0.312
 1045    HB   THR 150           HB       THR 150  -6.425  13.116   1.718
 1046    HG1  THR 150           1HG      THR 150  -8.571  13.633   1.881
 1047   1HG2  THR 150          1HG2      THR 150  -6.790  15.355   2.676
 1048   2HG2  THR 150          2HG2      THR 150  -6.666  16.058   1.064
 1049   3HG2  THR 150          3HG2      THR 150  -5.267  15.268   1.786
 1050    H    ASN 151           H        ASN 151  -6.709  12.648  -2.569
 1051    HA   ASN 151           HA       ASN 151  -7.033   9.984  -1.570
 1052   1HB   ASN 151          2HB       ASN 151  -8.337  10.932  -3.508
 1053   2HB   ASN 151          1HB       ASN 151  -6.867  10.806  -4.471
 1054   1HD2  ASN 151          1HD2      ASN 151  -7.613   9.276  -5.895
 1055   2HD2  ASN 151          2HD2      ASN 151  -7.990   7.655  -5.423
 1056    H    LYS 152           H        LYS 152  -4.901   9.798  -0.640
 1057    HA   LYS 152           HA       LYS 152  -3.315   8.247  -2.523
 1058   1HB   LYS 152          2HB       LYS 152  -1.170   9.062  -1.704
 1059   2HB   LYS 152          1HB       LYS 152  -2.086  10.384  -2.406
 1060   1HG   LYS 152          2HG       LYS 152  -2.074   9.871   0.553
 1061   2HG   LYS 152          1HG       LYS 152  -0.800  10.805  -0.229
 1062   1HD   LYS 152          2HD       LYS 152  -2.277  12.505  -0.860
 1063   2HD   LYS 152          1HD       LYS 152  -3.698  11.488  -0.611
 1064   1HE   LYS 152          2HE       LYS 152  -3.512  13.125   1.170
 1065   2HE   LYS 152          1HE       LYS 152  -3.273  11.498   1.803
 1066   1HZ   LYS 152          1HZ       LYS 152  -1.203  13.562   1.293
 1067   2HZ   LYS 152          2HZ       LYS 152  -0.838  11.945   1.649
 1068   3HZ   LYS 152          3HZ       LYS 152  -1.655  12.896   2.787
 1069    H    VAL 153           H        VAL 153  -2.852   6.326  -1.709
 1070    HA   VAL 153           HA       VAL 153  -2.826   6.009   1.192
 1071    HB   VAL 153           HB       VAL 153  -5.028   5.327   0.797
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.722   3.822  -1.006
 1073   2HG1  VAL 153          2HG1      VAL 153  -4.067   3.801  -1.616
 1074   3HG1  VAL 153          3HG1      VAL 153  -4.991   5.303  -1.626
 1075   1HG2  VAL 153          1HG2      VAL 153  -3.306   2.857   0.692
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.023   2.871   1.100
 1077   3HG2  VAL 153          3HG2      VAL 153  -3.863   3.704   2.137
 1078    H    THR 154           H        THR 154  -0.725   5.628   1.346
 1079    HA   THR 154           HA       THR 154   0.598   3.601  -0.234
 1080    HB   THR 154           HB       THR 154   2.504   4.077   1.311
 1081    HG1  THR 154           1HG      THR 154   1.081   4.685   3.102
 1082   1HG2  THR 154          1HG2      THR 154   2.915   6.359   0.546
 1083   2HG2  THR 154          2HG2      THR 154   1.208   6.540   0.138
 1084   3HG2  THR 154          3HG2      THR 154   2.210   5.388  -0.749
 1085    H    TYR 155           H        TYR 155   0.567   1.414   0.270
 1086    HA   TYR 155           HA       TYR 155   0.276   0.775   3.108
 1087   1HB   TYR 155          2HB       TYR 155  -1.385  -1.028   2.533
 1088   2HB   TYR 155          1HB       TYR 155  -1.964   0.627   2.453
 1089    HD1  TYR 155           1HD      TYR 155  -1.594  -2.470   0.701
 1090    HD2  TYR 155           2HD      TYR 155  -2.145   1.711   0.152
 1091    HE1  TYR 155           1HE      TYR 155  -2.348  -2.880  -1.601
 1092    HE2  TYR 155           2HE      TYR 155  -2.907   1.312  -2.151
 1093    HH   TYR 155           HH       TYR 155  -3.706  -1.775  -3.317
 1094    H    PHE 156           H        PHE 156   1.661  -0.611   3.794
 1095    HA   PHE 156           HA       PHE 156   3.448  -2.058   2.157
 1096   1HB   PHE 156          2HB       PHE 156   2.738  -2.247   5.081
 1097   2HB   PHE 156          1HB       PHE 156   3.892  -3.344   4.337
 1098    HD1  PHE 156           1HD      PHE 156   6.016  -2.477   3.431
 1099    HD2  PHE 156           2HD      PHE 156   3.308  -0.021   5.610
 1100    HE1  PHE 156           1HE      PHE 156   7.792  -0.810   3.764
 1101    HE2  PHE 156           2HE      PHE 156   5.084   1.647   5.949
 1102    HZ   PHE 156           HZ       PHE 156   7.371   1.192   5.094
 1103    H    MET 157           H        MET 157   3.263  -4.001   1.226
 1104    HA   MET 157           HA       MET 157   1.019  -5.683   2.086
 1105   1HB   MET 157          2HB       MET 157   1.257  -6.431  -0.491
 1106   2HB   MET 157          1HB       MET 157   0.157  -5.172   0.080
 1107   1HG   MET 157          2HG       MET 157   1.325  -4.394  -1.871
 1108   2HG   MET 157          1HG       MET 157   1.852  -3.473  -0.466
 1109   1HE   MET 157          1HE       MET 157   2.853  -7.043  -1.849
 1110   2HE   MET 157          2HE       MET 157   4.337  -6.636  -2.708
 1111   3HE   MET 157          3HE       MET 157   2.790  -5.987  -3.260
 1112    H    LYS 158           H        LYS 158   1.289  -7.935   1.975
 1113    HA   LYS 158           HA       LYS 158   3.799  -8.733   2.954
 1114   1HB   LYS 158          2HB       LYS 158   1.636  -9.769   3.609
 1115   2HB   LYS 158          1HB       LYS 158   1.542 -10.516   2.020
 1116   1HG   LYS 158          2HG       LYS 158   3.600 -11.752   2.478
 1117   2HG   LYS 158          1HG       LYS 158   3.698 -11.001   4.070
 1118   1HD   LYS 158          2HD       LYS 158   2.764 -13.224   4.265
 1119   2HD   LYS 158          1HD       LYS 158   1.531 -12.024   4.657
 1120   1HE   LYS 158          2HE       LYS 158   0.568 -12.261   2.443
 1121   2HE   LYS 158          1HE       LYS 158   1.834 -13.402   1.991
 1122   1HZ   LYS 158          1HZ       LYS 158   1.018 -14.941   3.632
 1123   2HZ   LYS 158          2HZ       LYS 158  -0.254 -14.493   2.612
 1124   3HZ   LYS 158          3HZ       LYS 158  -0.146 -13.830   4.171
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1 -23.637   0.237  -5.327
    2   2H    MET   1          2HT       MET   1 -22.218   0.392  -4.417
    3   3H    MET   1          3HT       MET   1 -23.478   1.503  -4.209
    4    HA   MET   1           HA       MET   1 -23.479   0.012  -2.385
    5   1HB   MET   1          2HB       MET   1 -25.761  -0.959  -2.620
    6   2HB   MET   1          1HB       MET   1 -25.665   0.731  -3.087
    7   1HG   MET   1          2HG       MET   1 -25.694   0.131  -5.423
    8   2HG   MET   1          1HG       MET   1 -25.660  -1.583  -5.011
    9   1HE   MET   1          1HE       MET   1 -29.212   1.212  -4.065
   10   2HE   MET   1          2HE       MET   1 -27.748   1.740  -4.895
   11   3HE   MET   1          3HE       MET   1 -27.680   1.271  -3.197
   12    H    GLU   2           H        GLU   2 -22.085  -1.575  -1.983
   13    HA   GLU   2           HA       GLU   2 -22.813  -4.234  -2.851
   14   1HB   GLU   2          2HB       GLU   2 -21.232  -3.453  -4.630
   15   2HB   GLU   2          1HB       GLU   2 -20.006  -3.231  -3.387
   16   1HG   GLU   2          2HG       GLU   2 -20.199  -5.644  -2.844
   17   2HG   GLU   2          1HG       GLU   2 -21.299  -5.820  -4.209
   18    H    GLN   3           H        GLN   3 -22.794  -5.404  -1.055
   19    HA   GLN   3           HA       GLN   3 -21.335  -4.562   1.288
   20   1HB   GLN   3          2HB       GLN   3 -23.037  -6.989   0.708
   21   2HB   GLN   3          1HB       GLN   3 -22.267  -6.701   2.259
   22   1HG   GLN   3          2HG       GLN   3 -23.525  -4.599   2.463
   23   2HG   GLN   3          1HG       GLN   3 -24.336  -4.961   0.940
   24   1HE2  GLN   3          1HE2      GLN   3 -25.908  -6.543   0.878
   25   2HE2  GLN   3          2HE2      GLN   3 -26.568  -7.255   2.312
   26    H    SER   4           H        SER   4 -19.412  -4.793  -0.415
   27    HA   SER   4           HA       SER   4 -17.697  -5.919  -1.375
   28   1HB   SER   4          2HB       SER   4 -16.357  -7.294   0.313
   29   2HB   SER   4          1HB       SER   4 -16.643  -5.603   0.713
   30    HG   SER   4           HG       SER   4 -18.516  -7.461   1.620
   31    H    ALA   5           H        ALA   5 -19.353  -6.995  -2.709
   32    HA   ALA   5           HA       ALA   5 -19.871  -9.789  -2.178
   33   1HB   ALA   5          1HB       ALA   5 -21.036  -9.775  -4.313
   34   2HB   ALA   5          2HB       ALA   5 -20.400  -8.171  -4.672
   35   3HB   ALA   5          3HB       ALA   5 -21.536  -8.393  -3.339
   36    H    SER   6           H        SER   6 -17.359  -7.985  -3.352
   37    HA   SER   6           HA       SER   6 -16.286 -10.079  -5.082
   38   1HB   SER   6          2HB       SER   6 -14.995  -7.443  -4.358
   39   2HB   SER   6          1HB       SER   6 -14.676  -8.457  -5.767
   40    HG   SER   6           HG       SER   6 -16.968  -6.874  -5.211
   41    H    ASP   7           H        ASP   7 -16.634 -10.066  -2.036
   42    HA   ASP   7           HA       ASP   7 -14.079  -9.750  -0.839
   43   1HB   ASP   7          2HB       ASP   7 -15.128 -10.234   1.169
   44   2HB   ASP   7          1HB       ASP   7 -16.486  -9.667   0.205
   45    H    SER   8           H        SER   8 -15.497 -12.320  -2.581
   46    HA   SER   8           HA       SER   8 -13.539 -14.206  -1.452
   47   1HB   SER   8          2HB       SER   8 -16.059 -14.837  -3.003
   48   2HB   SER   8          1HB       SER   8 -14.996 -15.993  -2.202
   49    HG   SER   8           HG       SER   8 -16.273 -13.892  -0.788
   50    H    ASN   9           H        ASN   9 -14.807 -12.797  -4.402
   51    HA   ASN   9           HA       ASN   9 -13.395 -14.543  -6.172
   52   1HB   ASN   9          2HB       ASN   9 -15.529 -13.306  -6.705
   53   2HB   ASN   9          1HB       ASN   9 -14.575 -11.832  -6.806
   54   1HD2  ASN   9          1HD2      ASN   9 -16.137 -12.896  -8.887
   55   2HD2  ASN   9          2HD2      ASN   9 -15.075 -13.332 -10.189
   56    H    LYS  10           H        LYS  10 -12.991 -11.048  -5.471
   57    HA   LYS  10           HA       LYS  10 -10.623 -11.028  -7.117
   58   1HB   LYS  10          2HB       LYS  10 -12.285  -9.145  -7.074
   59   2HB   LYS  10          1HB       LYS  10 -11.725  -8.762  -5.451
   60   1HG   LYS  10          2HG       LYS  10  -9.538  -8.230  -6.255
   61   2HG   LYS  10          1HG       LYS  10  -9.930  -8.826  -7.867
   62   1HD   LYS  10          2HD       LYS  10 -11.672  -7.039  -8.018
   63   2HD   LYS  10          1HD       LYS  10 -11.065  -6.395  -6.488
   64   1HE   LYS  10          2HE       LYS  10  -8.918  -5.956  -7.447
   65   2HE   LYS  10          1HE       LYS  10  -9.350  -6.806  -8.931
   66   1HZ   LYS  10          1HZ       LYS  10 -10.578  -4.283  -7.951
   67   2HZ   LYS  10          2HZ       LYS  10 -11.020  -5.107  -9.365
   68   3HZ   LYS  10          3HZ       LYS  10  -9.472  -4.424  -9.234
   69    H    SER  11           H        SER  11 -11.351 -11.232  -3.750
   70    HA   SER  11           HA       SER  11  -8.966 -10.231  -2.665
   71   1HB   SER  11          2HB       SER  11  -9.597 -11.717  -0.701
   72   2HB   SER  11          1HB       SER  11 -10.839 -10.576  -1.228
   73    HG   SER  11           HG       SER  11 -11.855 -12.520  -1.028
   74    H    GLN  12           H        GLN  12  -9.913 -13.626  -3.152
   75    HA   GLN  12           HA       GLN  12  -7.439 -14.721  -2.452
   76   1HB   GLN  12          2HB       GLN  12  -9.573 -15.869  -4.252
   77   2HB   GLN  12          1HB       GLN  12  -8.260 -16.782  -3.522
   78   1HG   GLN  12          2HG       GLN  12  -9.126 -16.204  -1.295
   79   2HG   GLN  12          1HG       GLN  12 -10.469 -15.355  -2.059
   80   1HE2  GLN  12          1HE2      GLN  12 -12.055 -16.537  -3.132
   81   2HE2  GLN  12          2HE2      GLN  12 -12.263 -18.237  -2.868
   82    H    ASN  13           H        ASN  13  -8.705 -13.725  -5.605
   83    HA   ASN  13           HA       ASN  13  -6.533 -14.805  -7.087
   84   1HB   ASN  13          2HB       ASN  13  -8.703 -12.833  -7.740
   85   2HB   ASN  13          1HB       ASN  13  -7.370 -13.095  -8.863
   86   1HD2  ASN  13          1HD2      ASN  13 -10.268 -14.384  -7.507
   87   2HD2  ASN  13          2HD2      ASN  13 -10.352 -15.797  -8.505
   88    H    ALA  14           H        ALA  14  -7.075 -11.746  -5.477
   89    HA   ALA  14           HA       ALA  14  -4.849 -10.413  -6.672
   90   1HB   ALA  14          1HB       ALA  14  -5.159  -8.724  -4.953
   91   2HB   ALA  14          2HB       ALA  14  -6.253  -9.795  -4.076
   92   3HB   ALA  14          3HB       ALA  14  -6.709  -9.175  -5.663
   93    H    ILE  15           H        ILE  15  -5.356 -11.834  -3.439
   94    HA   ILE  15           HA       ILE  15  -2.807 -11.407  -2.428
   95    HB   ILE  15           HB       ILE  15  -4.961 -13.375  -1.785
   96   1HG1  ILE  15          2HG1      ILE  15  -4.756 -12.293   0.455
   97   2HG1  ILE  15          1HG1      ILE  15  -3.482 -11.268  -0.190
   98   1HG2  ILE  15          1HG2      ILE  15  -2.197 -13.499  -0.584
   99   2HG2  ILE  15          2HG2      ILE  15  -2.970 -14.739  -1.571
  100   3HG2  ILE  15          3HG2      ILE  15  -3.615 -14.352   0.024
  101   1HD1  ILE  15          1HD1      ILE  15  -5.600 -10.096  -0.088
  102   2HD1  ILE  15          2HD1      ILE  15  -6.347 -11.322  -1.112
  103   3HD1  ILE  15          3HD1      ILE  15  -5.073 -10.289  -1.759
  104    H    SER  16           H        SER  16  -4.026 -14.249  -4.191
  105    HA   SER  16           HA       SER  16  -1.730 -15.817  -3.988
  106   1HB   SER  16          2HB       SER  16  -2.639 -16.949  -6.068
  107   2HB   SER  16          1HB       SER  16  -3.758 -16.837  -4.711
  108    HG   SER  16           HG       SER  16  -4.996 -15.528  -5.814
  109    H    GLU  17           H        GLU  17  -2.577 -13.320  -6.322
  110    HA   GLU  17           HA       GLU  17  -0.378 -13.918  -8.062
  111   1HB   GLU  17          2HB       GLU  17  -2.561 -12.925  -8.799
  112   2HB   GLU  17          1HB       GLU  17  -2.087 -11.432  -8.000
  113   1HG   GLU  17          2HG       GLU  17  -0.131 -11.282  -9.463
  114   2HG   GLU  17          1HG       GLU  17  -0.639 -12.761 -10.276
  115    H    VAL  18           H        VAL  18  -1.090 -11.434  -5.634
  116    HA   VAL  18           HA       VAL  18   1.245  -9.904  -6.152
  117    HB   VAL  18           HB       VAL  18  -0.456  -9.935  -3.652
  118   1HG1  VAL  18          1HG1      VAL  18   1.505  -7.877  -4.664
  119   2HG1  VAL  18          2HG1      VAL  18   1.746  -8.940  -3.278
  120   3HG1  VAL  18          3HG1      VAL  18   0.478  -7.713  -3.239
  121   1HG2  VAL  18          1HG2      VAL  18  -1.539  -7.962  -4.626
  122   2HG2  VAL  18          2HG2      VAL  18  -1.762  -9.390  -5.637
  123   3HG2  VAL  18          3HG2      VAL  18  -0.579  -8.163  -6.093
  124    H    MET  19           H        MET  19   0.481 -12.365  -3.686
  125    HA   MET  19           HA       MET  19   2.882 -12.112  -2.250
  126   1HB   MET  19          2HB       MET  19   2.352 -14.193  -1.199
  127   2HB   MET  19          1HB       MET  19   0.851 -13.313  -1.441
  128   1HG   MET  19          2HG       MET  19   0.324 -14.694  -3.364
  129   2HG   MET  19          1HG       MET  19   1.854 -15.553  -3.185
  130   1HE   MET  19          1HE       MET  19  -0.944 -17.072  -3.370
  131   2HE   MET  19          2HE       MET  19  -0.735 -18.278  -2.098
  132   3HE   MET  19          3HE       MET  19   0.608 -17.885  -3.171
  133    H    SER  20           H        SER  20   2.195 -13.640  -5.257
  134    HA   SER  20           HA       SER  20   4.476 -15.333  -5.353
  135   1HB   SER  20          2HB       SER  20   2.787 -14.144  -7.568
  136   2HB   SER  20          1HB       SER  20   4.030 -15.371  -7.811
  137    HG   SER  20           HG       SER  20   1.525 -15.584  -6.556
  138    H    ALA  21           H        ALA  21   3.848 -11.981  -6.189
  139    HA   ALA  21           HA       ALA  21   6.424 -11.644  -7.473
  140   1HB   ALA  21          1HB       ALA  21   4.312  -9.593  -6.813
  141   2HB   ALA  21          2HB       ALA  21   4.457 -10.470  -8.336
  142   3HB   ALA  21          3HB       ALA  21   5.722  -9.346  -7.844
  143    H    THR  22           H        THR  22   4.910 -10.883  -4.391
  144    HA   THR  22           HA       THR  22   7.007  -9.188  -3.466
  145    HB   THR  22           HB       THR  22   5.970  -9.609  -1.199
  146    HG1  THR  22           1HG      THR  22   3.666 -10.582  -1.774
  147   1HG2  THR  22          1HG2      THR  22   5.326  -7.699  -2.576
  148   2HG2  THR  22          2HG2      THR  22   3.924  -8.345  -1.721
  149   3HG2  THR  22          3HG2      THR  22   4.153  -8.697  -3.434
  150    H    SER  23           H        SER  23   6.336 -12.644  -3.207
  151    HA   SER  23           HA       SER  23   8.510 -13.178  -1.445
  152   1HB   SER  23          2HB       SER  23   6.555 -14.705  -1.760
  153   2HB   SER  23          1HB       SER  23   7.159 -15.089  -3.369
  154    HG   SER  23           HG       SER  23   9.022 -15.369  -1.348
  155    H    ALA  24           H        ALA  24   8.179 -12.806  -4.885
  156    HA   ALA  24           HA       ALA  24  10.600 -14.047  -5.667
  157   1HB   ALA  24          1HB       ALA  24   9.012 -11.888  -7.049
  158   2HB   ALA  24          2HB       ALA  24   8.807 -13.627  -7.255
  159   3HB   ALA  24          3HB       ALA  24  10.298 -12.846  -7.781
  160    H    ILE  25           H        ILE  25   9.742 -10.687  -4.918
  161    HA   ILE  25           HA       ILE  25  12.268  -9.601  -5.563
  162    HB   ILE  25           HB       ILE  25  10.115  -8.299  -5.323
  163   1HG1  ILE  25          2HG1      ILE  25  11.241  -6.281  -4.411
  164   2HG1  ILE  25          1HG1      ILE  25  12.565  -7.302  -3.856
  165   1HG2  ILE  25          1HG2      ILE  25   9.377  -9.178  -3.184
  166   2HG2  ILE  25          2HG2      ILE  25   9.555  -7.425  -3.109
  167   3HG2  ILE  25          3HG2      ILE  25  10.783  -8.467  -2.392
  168   1HD1  ILE  25          1HD1      ILE  25  11.714  -6.956  -6.723
  169   2HD1  ILE  25          2HD1      ILE  25  13.078  -7.916  -6.145
  170   3HD1  ILE  25          3HD1      ILE  25  13.086  -6.162  -5.954
  171    H    ASN  26           H        ASN  26  11.062 -11.254  -2.763
  172    HA   ASN  26           HA       ASN  26  12.977 -10.401  -0.874
  173   1HB   ASN  26          2HB       ASN  26  11.574 -13.080  -1.074
  174   2HB   ASN  26          1HB       ASN  26  12.462 -12.504   0.330
  175   1HD2  ASN  26          1HD2      ASN  26   9.735 -13.326   0.172
  176   2HD2  ASN  26          2HD2      ASN  26   8.768 -11.968   0.641
  177    H    GLY  27           H        GLY  27  12.923 -13.064  -3.197
  178   1HA   GLY  27          2HA       GLY  27  15.500 -14.065  -2.403
  179   2HA   GLY  27          1HA       GLY  27  14.543 -14.605  -3.774
  180    H    LEU  28           H        LEU  28  14.504 -11.503  -4.365
  181    HA   LEU  28           HA       LEU  28  16.763 -11.625  -6.168
  182   1HB   LEU  28          2HB       LEU  28  14.651  -9.506  -5.747
  183   2HB   LEU  28          1HB       LEU  28  15.902  -9.428  -6.973
  184    HG   LEU  28           HG       LEU  28  13.753 -11.546  -6.815
  185   1HD1  LEU  28          1HD1      LEU  28  14.053  -9.216  -8.704
  186   2HD1  LEU  28          2HD1      LEU  28  12.862  -9.347  -7.411
  187   3HD1  LEU  28          3HD1      LEU  28  12.807 -10.463  -8.775
  188   1HD2  LEU  28          1HD2      LEU  28  15.804 -12.390  -7.812
  189   2HD2  LEU  28          2HD2      LEU  28  15.859 -11.008  -8.906
  190   3HD2  LEU  28          3HD2      LEU  28  14.554 -12.186  -9.041
  191    H    TYR  29           H        TYR  29  16.169 -10.505  -3.041
  192    HA   TYR  29           HA       TYR  29  18.496  -8.704  -3.171
  193   1HB   TYR  29          2HB       TYR  29  16.082  -8.708  -1.380
  194   2HB   TYR  29          1HB       TYR  29  17.572  -7.920  -0.875
  195    HD1  TYR  29           1HD      TYR  29  15.575  -8.039  -4.055
  196    HD2  TYR  29           2HD      TYR  29  17.499  -5.640  -1.113
  197    HE1  TYR  29           1HE      TYR  29  14.933  -6.013  -5.289
  198    HE2  TYR  29           2HE      TYR  29  16.855  -3.607  -2.337
  199    HH   TYR  29           HH       TYR  29  14.579  -3.622  -4.873
  200    H    ILE  30           H        ILE  30  17.046 -10.259  -0.353
  201    HA   ILE  30           HA       ILE  30  17.859 -11.608   1.271
  202    HB   ILE  30           HB       ILE  30  19.498 -12.754  -0.993
  203   1HG1  ILE  30          2HG1      ILE  30  16.881 -13.625   0.258
  204   2HG1  ILE  30          1HG1      ILE  30  17.077 -12.913  -1.340
  205   1HG2  ILE  30          1HG2      ILE  30  19.773 -14.729   0.424
  206   2HG2  ILE  30          2HG2      ILE  30  18.943 -13.905   1.743
  207   3HG2  ILE  30          3HG2      ILE  30  20.498 -13.302   1.167
  208   1HD1  ILE  30          1HD1      ILE  30  18.167 -15.571  -0.441
  209   2HD1  ILE  30          2HD1      ILE  30  18.376 -14.859  -2.042
  210   3HD1  ILE  30          3HD1      ILE  30  16.766 -15.312  -1.481
  211    H    GLY  31           H        GLY  31  18.945 -10.481   2.782
  212   1HA   GLY  31          2HA       GLY  31  21.134 -10.708   3.900
  213   2HA   GLY  31          1HA       GLY  31  21.864 -10.275   2.364
  214    H    GLN  32           H        GLN  32  19.025  -8.541   3.206
  215    HA   GLN  32           HA       GLN  32  20.701  -6.306   4.163
  216   1HB   GLN  32          2HB       GLN  32  18.190  -6.120   2.492
  217   2HB   GLN  32          1HB       GLN  32  19.122  -4.761   3.100
  218   1HG   GLN  32          2HG       GLN  32  21.062  -5.689   1.779
  219   2HG   GLN  32          1HG       GLN  32  19.889  -6.762   1.021
  220   1HE2  GLN  32          1HE2      GLN  32  20.271  -5.830  -0.996
  221   2HE2  GLN  32          2HE2      GLN  32  19.659  -4.266  -1.415
  222    H    THR  33           H        THR  33  18.647  -8.509   5.191
  223    HA   THR  33           HA       THR  33  17.272  -8.762   6.968
  224    HB   THR  33           HB       THR  33  17.810  -5.863   7.646
  225    HG1  THR  33           1HG      THR  33  19.662  -6.498   8.510
  226   1HG2  THR  33          1HG2      THR  33  17.256  -6.566   9.932
  227   2HG2  THR  33          2HG2      THR  33  16.919  -8.197   9.349
  228   3HG2  THR  33          3HG2      THR  33  15.904  -6.849   8.833
  229    H    SER  34           H        SER  34  16.752  -5.451   5.722
  230    HA   SER  34           HA       SER  34  14.039  -6.240   4.977
  231   1HB   SER  34          2HB       SER  34  13.173  -4.095   5.967
  232   2HB   SER  34          1HB       SER  34  13.721  -5.278   7.155
  233    HG   SER  34           HG       SER  34  14.499  -2.794   6.928
  234    H    TYR  35           H        TYR  35  16.608  -5.555   3.552
  235    HA   TYR  35           HA       TYR  35  17.161  -4.594   1.565
  236   1HB   TYR  35          2HB       TYR  35  14.357  -3.503   1.328
  237   2HB   TYR  35          1HB       TYR  35  15.454  -3.999   0.041
  238    HD1  TYR  35           1HD      TYR  35  16.287  -6.627   0.562
  239    HD2  TYR  35           2HD      TYR  35  12.529  -4.864   1.485
  240    HE1  TYR  35           1HE      TYR  35  15.224  -8.847   0.464
  241    HE2  TYR  35           2HE      TYR  35  11.465  -7.072   1.399
  242    HH   TYR  35           HH       TYR  35  13.202  -9.967   1.346
  243    H    SER  36           H        SER  36  17.586  -3.219   3.965
  244    HA   SER  36           HA       SER  36  16.630  -0.578   4.002
  245   1HB   SER  36          2HB       SER  36  17.541  -1.848   5.964
  246   2HB   SER  36          1HB       SER  36  19.156  -1.618   5.301
  247    HG   SER  36           HG       SER  36  18.048  -0.023   6.921
  248    H    GLY  37           H        GLY  37  18.900  -1.958   1.918
  249   1HA   GLY  37          2HA       GLY  37  20.726   0.175   1.579
  250   2HA   GLY  37          1HA       GLY  37  20.333  -1.043   0.373
  251    H    LEU  38           H        LEU  38  17.426  -0.171   0.711
  252    HA   LEU  38           HA       LEU  38  17.503   1.893  -1.330
  253   1HB   LEU  38          2HB       LEU  38  15.111   0.572  -0.039
  254   2HB   LEU  38          1HB       LEU  38  15.115   1.510  -1.519
  255    HG   LEU  38           HG       LEU  38  16.539  -1.132  -1.174
  256   1HD1  LEU  38          1HD1      LEU  38  14.122  -1.419  -1.028
  257   2HD1  LEU  38          2HD1      LEU  38  14.742  -2.062  -2.548
  258   3HD1  LEU  38          3HD1      LEU  38  13.916  -0.505  -2.524
  259   1HD2  LEU  38          1HD2      LEU  38  15.967   0.522  -3.631
  260   2HD2  LEU  38          2HD2      LEU  38  16.749  -1.059  -3.604
  261   3HD2  LEU  38          3HD2      LEU  38  17.540   0.329  -2.861
  262    H    ASP  39           H        ASP  39  17.189   1.695   2.052
  263    HA   ASP  39           HA       ASP  39  15.314   3.734   2.567
  264   1HB   ASP  39          2HB       ASP  39  15.856   2.139   4.287
  265   2HB   ASP  39          1HB       ASP  39  17.549   2.617   4.258
  266    H    SER  40           H        SER  40  18.826   3.881   3.140
  267    HA   SER  40           HA       SER  40  18.924   6.612   3.614
  268   1HB   SER  40          2HB       SER  40  21.391   6.339   3.021
  269   2HB   SER  40          1HB       SER  40  20.770   5.278   4.286
  270    HG   SER  40           HG       SER  40  21.474   4.670   1.628
  271    H    THR  41           H        THR  41  19.240   4.832   0.596
  272    HA   THR  41           HA       THR  41  20.217   6.919  -0.998
  273    HB   THR  41           HB       THR  41  18.519   4.610  -1.943
  274    HG1  THR  41           1HG      THR  41  20.116   3.310  -1.408
  275   1HG2  THR  41          1HG2      THR  41  20.796   6.124  -3.229
  276   2HG2  THR  41          2HG2      THR  41  19.088   6.273  -3.647
  277   3HG2  THR  41          3HG2      THR  41  19.936   4.756  -3.935
  278    H    ILE  42           H        ILE  42  16.885   5.810  -0.400
  279    HA   ILE  42           HA       ILE  42  15.823   7.797  -2.220
  280    HB   ILE  42           HB       ILE  42  14.419   5.821  -0.415
  281   1HG1  ILE  42          2HG1      ILE  42  15.688   4.760  -2.210
  282   2HG1  ILE  42          1HG1      ILE  42  13.961   4.619  -2.519
  283   1HG2  ILE  42          1HG2      ILE  42  12.394   6.332  -1.693
  284   2HG2  ILE  42          2HG2      ILE  42  13.263   7.596  -2.565
  285   3HG2  ILE  42          3HG2      ILE  42  12.990   7.748  -0.829
  286   1HD1  ILE  42          1HD1      ILE  42  15.834   6.589  -3.812
  287   2HD1  ILE  42          2HD1      ILE  42  14.102   6.458  -4.121
  288   3HD1  ILE  42          3HD1      ILE  42  15.178   5.128  -4.551
  289    H    LEU  43           H        LEU  43  16.258   7.393   1.216
  290    HA   LEU  43           HA       LEU  43  14.438   9.266   2.193
  291   1HB   LEU  43          2HB       LEU  43  15.757   7.665   3.565
  292   2HB   LEU  43          1HB       LEU  43  17.184   8.645   3.284
  293    HG   LEU  43           HG       LEU  43  16.016  10.551   4.413
  294   1HD1  LEU  43          1HD1      LEU  43  14.081  10.022   5.819
  295   2HD1  LEU  43          2HD1      LEU  43  14.018   8.407   5.112
  296   3HD1  LEU  43          3HD1      LEU  43  13.728   9.825   4.103
  297   1HD2  LEU  43          1HD2      LEU  43  16.433   8.024   6.001
  298   2HD2  LEU  43          2HD2      LEU  43  16.327   9.648   6.683
  299   3HD2  LEU  43          3HD2      LEU  43  17.655   9.231   5.599
  300    H    LEU  44           H        LEU  44  17.906   9.751   1.501
  301    HA   LEU  44           HA       LEU  44  17.695  12.584   1.892
  302   1HB   LEU  44          2HB       LEU  44  20.075  12.595   1.081
  303   2HB   LEU  44          1HB       LEU  44  19.758  11.641   2.512
  304    HG   LEU  44           HG       LEU  44  19.663   9.621   0.930
  305   1HD1  LEU  44          1HD1      LEU  44  19.496  10.846  -1.169
  306   2HD1  LEU  44          2HD1      LEU  44  20.937   9.829  -1.135
  307   3HD1  LEU  44          3HD1      LEU  44  21.079  11.570  -0.879
  308   1HD2  LEU  44          1HD2      LEU  44  22.097   9.381   0.982
  309   2HD2  LEU  44          2HD2      LEU  44  21.469  10.020   2.503
  310   3HD2  LEU  44          3HD2      LEU  44  22.256  11.100   1.349
  311    H    ASN  45           H        ASN  45  16.912  10.596  -0.648
  312    HA   ASN  45           HA       ASN  45  17.841  12.011  -2.890
  313   1HB   ASN  45          2HB       ASN  45  16.997   9.724  -3.054
  314   2HB   ASN  45          1HB       ASN  45  15.389  10.267  -2.589
  315   1HD2  ASN  45          1HD2      ASN  45  17.787  10.222  -5.102
  316   2HD2  ASN  45          2HD2      ASN  45  16.730  10.694  -6.394
  317    H    THR  46           H        THR  46  14.823  12.266  -1.042
  318    HA   THR  46           HA       THR  46  14.332  14.803  -2.448
  319    HB   THR  46           HB       THR  46  12.161  12.858  -1.650
  320    HG1  THR  46           1HG      THR  46  13.778  12.626  -3.672
  321   1HG2  THR  46          1HG2      THR  46  12.076  15.372  -3.323
  322   2HG2  THR  46          2HG2      THR  46  11.472  15.211  -1.674
  323   3HG2  THR  46          3HG2      THR  46  10.712  14.306  -2.985
  324    H    SER  47           H        SER  47  15.109  16.041  -0.745
  325    HA   SER  47           HA       SER  47  14.743  17.486   0.964
  326   1HB   SER  47          2HB       SER  47  12.503  17.627  -0.069
  327   2HB   SER  47          1HB       SER  47  11.956  16.312   0.965
  328    HG   SER  47           HG       SER  47  12.703  17.789   2.745
  329    H    ALA  48           H        ALA  48  15.276  14.431   1.467
  330    HA   ALA  48           HA       ALA  48  15.760  13.095   3.238
  331   1HB   ALA  48          1HB       ALA  48  15.211  15.519   4.952
  332   2HB   ALA  48          2HB       ALA  48  16.771  15.084   4.255
  333   3HB   ALA  48          3HB       ALA  48  16.026  14.040   5.465
  334    H    ILE  49           H        ILE  49  12.868  14.265   2.509
  335    HA   ILE  49           HA       ILE  49  11.482  12.274   4.144
  336    HB   ILE  49           HB       ILE  49  10.355  15.042   3.622
  337   1HG1  ILE  49          2HG1      ILE  49  11.296  13.842   6.239
  338   2HG1  ILE  49          1HG1      ILE  49  12.141  15.095   5.335
  339   1HG2  ILE  49          1HG2      ILE  49   8.528  14.317   5.093
  340   2HG2  ILE  49          2HG2      ILE  49   9.270  12.722   5.215
  341   3HG2  ILE  49          3HG2      ILE  49   8.666  13.296   3.661
  342   1HD1  ILE  49          1HD1      ILE  49   9.397  15.357   6.543
  343   2HD1  ILE  49          2HD1      ILE  49  10.278  16.615   5.674
  344   3HD1  ILE  49          3HD1      ILE  49  10.890  16.011   7.214
  345    HA   PRO  50           HA       PRO  50  10.853  11.516  -0.267
  346   1HB   PRO  50          2HB       PRO  50   9.426   9.134   0.777
  347   2HB   PRO  50          1HB       PRO  50  10.750   9.245  -0.390
  348   1HG   PRO  50          2HG       PRO  50  11.172   8.359   2.099
  349   2HG   PRO  50          1HG       PRO  50  12.377   9.334   1.237
  350   1HD   PRO  50          2HD       PRO  50  10.474  10.146   3.393
  351   2HD   PRO  50          1HD       PRO  50  12.156  10.648   3.122
  352    H    ASP  51           H        ASP  51   9.422  13.081  -0.799
  353    HA   ASP  51           HA       ASP  51   6.834  13.393   0.266
  354   1HB   ASP  51          2HB       ASP  51   8.213  15.176  -0.834
  355   2HB   ASP  51          1HB       ASP  51   7.865  14.424  -2.385
  356    H    ASN  52           H        ASN  52   8.010  11.144  -1.901
  357    HA   ASN  52           HA       ASN  52   5.872  10.905  -3.734
  358   1HB   ASN  52          2HB       ASN  52   6.824   8.591  -4.125
  359   2HB   ASN  52          1HB       ASN  52   7.945   9.926  -4.362
  360   1HD2  ASN  52          1HD2      ASN  52   9.770  10.020  -3.183
  361   2HD2  ASN  52          2HD2      ASN  52  10.202   8.856  -1.972
  362    H    TYR  53           H        TYR  53   6.217  10.036  -0.463
  363    HA   TYR  53           HA       TYR  53   4.526   7.821  -0.180
  364   1HB   TYR  53          2HB       TYR  53   4.994  10.152   1.683
  365   2HB   TYR  53          1HB       TYR  53   4.143   8.677   2.122
  366    HD1  TYR  53           1HD      TYR  53   6.120   6.931   0.383
  367    HD2  TYR  53           2HD      TYR  53   6.643   9.829   3.454
  368    HE1  TYR  53           1HE      TYR  53   8.276   5.913   0.971
  369    HE2  TYR  53           2HE      TYR  53   8.797   8.817   4.048
  370    HH   TYR  53           HH       TYR  53  10.052   6.877   3.807
  371    H    LYS  54           H        LYS  54   3.712  10.930  -1.263
  372    HA   LYS  54           HA       LYS  54   0.899  10.244  -1.121
  373   1HB   LYS  54          2HB       LYS  54   0.347  12.467  -0.065
  374   2HB   LYS  54          1HB       LYS  54   1.103  11.289   0.996
  375   1HG   LYS  54          2HG       LYS  54   3.265  12.417   0.680
  376   2HG   LYS  54          1HG       LYS  54   2.468  13.619  -0.334
  377   1HD   LYS  54          2HD       LYS  54   1.086  14.312   1.544
  378   2HD   LYS  54          1HD       LYS  54   1.822  13.072   2.562
  379   1HE   LYS  54          2HE       LYS  54   2.841  15.222   3.018
  380   2HE   LYS  54          1HE       LYS  54   4.015  14.151   2.255
  381   1HZ   LYS  54          1HZ       LYS  54   3.561  15.271   0.135
  382   2HZ   LYS  54          2HZ       LYS  54   4.140  16.347   1.306
  383   3HZ   LYS  54          3HZ       LYS  54   2.491  16.328   0.918
  384    H    ASP  55           H        ASP  55  -0.059  10.882  -2.964
  385    HA   ASP  55           HA       ASP  55   1.250  12.785  -4.720
  386   1HB   ASP  55          2HB       ASP  55   0.297  10.800  -5.744
  387   2HB   ASP  55          1HB       ASP  55  -1.277  11.154  -5.040
  388    H    THR  56           H        THR  56   0.063  14.658  -5.590
  389    HA   THR  56           HA       THR  56  -1.706  15.788  -3.525
  390    HB   THR  56           HB       THR  56  -1.040  18.010  -4.583
  391    HG1  THR  56           1HG      THR  56   0.180  17.872  -6.298
  392   1HG2  THR  56          1HG2      THR  56   1.133  16.359  -3.282
  393   2HG2  THR  56          2HG2      THR  56  -0.154  17.215  -2.431
  394   3HG2  THR  56          3HG2      THR  56   1.060  18.120  -3.338
  395    H    THR  57           H        THR  57  -1.889  14.401  -6.517
  396    HA   THR  57           HA       THR  57  -3.874  16.289  -7.553
  397    HB   THR  57           HB       THR  57  -2.794  13.828  -8.932
  398    HG1  THR  57           1HG      THR  57  -1.029  15.137  -8.534
  399   1HG2  THR  57          1HG2      THR  57  -4.098  16.346  -9.976
  400   2HG2  THR  57          2HG2      THR  57  -4.839  14.748  -9.898
  401   3HG2  THR  57          3HG2      THR  57  -3.468  15.031 -10.969
  402    H    ASN  58           H        ASN  58  -3.523  12.748  -7.136
  403    HA   ASN  58           HA       ASN  58  -5.772  12.108  -5.760
  404   1HB   ASN  58          2HB       ASN  58  -7.547  11.606  -7.332
  405   2HB   ASN  58          1HB       ASN  58  -7.100  13.298  -7.512
  406   1HD2  ASN  58          1HD2      ASN  58  -7.098  10.158  -8.977
  407   2HD2  ASN  58          2HD2      ASN  58  -6.661  10.675 -10.568
  408    H    LYS  59           H        LYS  59  -3.072  11.157  -7.164
  409    HA   LYS  59           HA       LYS  59  -3.896   8.388  -7.401
  410   1HB   LYS  59          2HB       LYS  59  -2.477   8.510  -9.718
  411   2HB   LYS  59          1HB       LYS  59  -4.228   8.515  -9.606
  412   1HG   LYS  59          2HG       LYS  59  -3.720  10.257 -11.070
  413   2HG   LYS  59          1HG       LYS  59  -4.063  11.053  -9.537
  414   1HD   LYS  59          2HD       LYS  59  -2.143  12.105 -10.474
  415   2HD   LYS  59          1HD       LYS  59  -1.591  11.120  -9.119
  416   1HE   LYS  59          2HE       LYS  59  -0.762   9.434 -10.579
  417   2HE   LYS  59          1HE       LYS  59  -1.543  10.172 -11.976
  418   1HZ   LYS  59          1HZ       LYS  59   0.770  10.697 -12.024
  419   2HZ   LYS  59          2HZ       LYS  59   0.743  11.277 -10.430
  420   3HZ   LYS  59          3HZ       LYS  59  -0.076  12.119 -11.652
  421    H    LYS  60           H        LYS  60  -2.494   8.107  -5.599
  422    HA   LYS  60           HA       LYS  60  -0.001   7.088  -6.655
  423   1HB   LYS  60          2HB       LYS  60   0.529   9.377  -5.714
  424   2HB   LYS  60          1HB       LYS  60   0.094   8.749  -4.134
  425   1HG   LYS  60          2HG       LYS  60   2.270   7.513  -5.823
  426   2HG   LYS  60          1HG       LYS  60   2.565   8.830  -4.684
  427   1HD   LYS  60          2HD       LYS  60   1.408   6.134  -4.002
  428   2HD   LYS  60          1HD       LYS  60   3.071   6.656  -3.707
  429   1HE   LYS  60          2HE       LYS  60   2.153   8.524  -2.335
  430   2HE   LYS  60          1HE       LYS  60   0.557   7.799  -2.513
  431   1HZ   LYS  60          1HZ       LYS  60   1.730   7.206  -0.434
  432   2HZ   LYS  60          2HZ       LYS  60   2.890   6.390  -1.355
  433   3HZ   LYS  60          3HZ       LYS  60   1.285   5.867  -1.370
  434    H    ILE  61           H        ILE  61   0.185   5.053  -6.039
  435    HA   ILE  61           HA       ILE  61  -0.888   4.239  -3.417
  436    HB   ILE  61           HB       ILE  61  -1.200   1.942  -4.460
  437   1HG1  ILE  61          2HG1      ILE  61  -1.026   3.558  -7.029
  438   2HG1  ILE  61          1HG1      ILE  61  -0.041   2.159  -6.595
  439   1HG2  ILE  61          1HG2      ILE  61  -2.966   4.226  -5.297
  440   2HG2  ILE  61          2HG2      ILE  61  -3.042   3.315  -3.788
  441   3HG2  ILE  61          3HG2      ILE  61  -3.428   2.524  -5.315
  442   1HD1  ILE  61          1HD1      ILE  61  -2.020   0.743  -6.669
  443   2HD1  ILE  61          2HD1      ILE  61  -1.749   1.571  -8.203
  444   3HD1  ILE  61          3HD1      ILE  61  -3.007   2.137  -7.106
  445    H    THR  62           H        THR  62   0.559   3.387  -2.077
  446    HA   THR  62           HA       THR  62   3.178   2.628  -3.122
  447    HB   THR  62           HB       THR  62   2.284   2.566  -0.235
  448    HG1  THR  62           1HG      THR  62   3.535   4.669  -0.263
  449   1HG2  THR  62          1HG2      THR  62   4.348   1.355  -0.780
  450   2HG2  THR  62          2HG2      THR  62   4.661   2.764   0.235
  451   3HG2  THR  62          3HG2      THR  62   5.012   2.826  -1.493
  452    H    ASN  63           H        ASN  63   3.323   0.631  -3.876
  453    HA   ASN  63           HA       ASN  63   3.234  -1.710  -2.524
  454   1HB   ASN  63          2HB       ASN  63   0.834  -1.356  -2.050
  455   2HB   ASN  63          1HB       ASN  63   0.506  -1.283  -3.779
  456   1HD2  ASN  63          1HD2      ASN  63  -0.862  -3.032  -3.783
  457   2HD2  ASN  63          2HD2      ASN  63  -0.318  -4.650  -3.529
  458    HA   PRO  64           HA       PRO  64   2.740  -2.889  -7.062
  459   1HB   PRO  64          2HB       PRO  64   1.520  -1.191  -8.815
  460   2HB   PRO  64          1HB       PRO  64   0.646  -2.287  -7.742
  461   1HG   PRO  64          2HG       PRO  64   0.822   0.609  -7.664
  462   2HG   PRO  64          1HG       PRO  64  -0.256  -0.456  -6.760
  463   1HD   PRO  64          2HD       PRO  64   2.213   0.826  -5.908
  464   2HD   PRO  64          1HD       PRO  64   0.983   0.004  -4.921
  465    H    PHE  65           H        PHE  65   3.479  -2.432  -9.388
  466    HA   PHE  65           HA       PHE  65   5.571  -0.362  -9.439
  467   1HB   PHE  65          2HB       PHE  65   7.026  -2.120 -10.606
  468   2HB   PHE  65          1HB       PHE  65   6.816  -2.287  -8.866
  469    HD1  PHE  65           1HD      PHE  65   5.861  -4.218  -7.937
  470    HD2  PHE  65           2HD      PHE  65   5.695  -3.598 -12.144
  471    HE1  PHE  65           1HE      PHE  65   5.070  -6.529  -8.242
  472    HE2  PHE  65           2HE      PHE  65   4.903  -5.906 -12.455
  473    HZ   PHE  65           HZ       PHE  65   4.589  -7.374 -10.506
  474    H    GLY  66           H        GLY  66   2.846  -0.898 -10.716
  475   1HA   GLY  66          2HA       GLY  66   3.305  -1.474 -13.466
  476   2HA   GLY  66          1HA       GLY  66   1.829  -0.819 -12.773
  477    H    GLY  67           H        GLY  67   2.949   1.549 -11.652
  478   1HA   GLY  67          2HA       GLY  67   3.338   3.037 -14.163
  479   2HA   GLY  67          1HA       GLY  67   2.703   3.707 -12.666
  480    H    GLU  68           H        GLU  68   4.060   5.170 -11.899
  481    HA   GLU  68           HA       GLU  68   6.922   4.864 -12.258
  482   1HB   GLU  68          2HB       GLU  68   5.783   7.088 -12.448
  483   2HB   GLU  68          1HB       GLU  68   5.393   6.972 -10.730
  484   1HG   GLU  68          2HG       GLU  68   7.744   6.975 -10.164
  485   2HG   GLU  68          1HG       GLU  68   8.185   6.970 -11.869
  486    H    LEU  69           H        LEU  69   7.673   3.280 -10.985
  487    HA   LEU  69           HA       LEU  69   6.780   3.098  -8.231
  488   1HB   LEU  69          2HB       LEU  69   7.825   0.995  -8.089
  489   2HB   LEU  69          1HB       LEU  69   7.051   1.051  -9.656
  490    HG   LEU  69           HG       LEU  69   9.996   1.615  -9.323
  491   1HD1  LEU  69          1HD1      LEU  69  10.397  -0.728  -9.898
  492   2HD1  LEU  69          2HD1      LEU  69   8.665  -1.048  -9.802
  493   3HD1  LEU  69          3HD1      LEU  69   9.557  -0.572  -8.356
  494   1HD2  LEU  69          1HD2      LEU  69   9.284   2.285 -11.455
  495   2HD2  LEU  69          2HD2      LEU  69   8.197   0.906 -11.623
  496   3HD2  LEU  69          3HD2      LEU  69   9.943   0.669 -11.698
  497    H    ASN  70           H        ASN  70   7.760   3.987  -6.605
  498    HA   ASN  70           HA       ASN  70  10.622   4.625  -6.801
  499   1HB   ASN  70          2HB       ASN  70   9.363   6.569  -6.174
  500   2HB   ASN  70          1HB       ASN  70   8.441   5.665  -4.977
  501   1HD2  ASN  70          1HD2      ASN  70   9.227   5.438  -2.963
  502   2HD2  ASN  70          2HD2      ASN  70  10.745   6.077  -2.428
  503    H    VAL  71           H        VAL  71  12.023   3.384  -5.722
  504    HA   VAL  71           HA       VAL  71  10.992   1.089  -4.328
  505    HB   VAL  71           HB       VAL  71  13.371   0.406  -4.114
  506   1HG1  VAL  71          1HG1      VAL  71  12.551   1.245  -6.891
  507   2HG1  VAL  71          2HG1      VAL  71  12.047  -0.231  -6.070
  508   3HG1  VAL  71          3HG1      VAL  71  13.743   0.009  -6.488
  509   1HG2  VAL  71          1HG2      VAL  71  15.087   1.705  -5.312
  510   2HG2  VAL  71          2HG2      VAL  71  14.415   2.590  -3.944
  511   3HG2  VAL  71          3HG2      VAL  71  13.907   2.986  -5.587
  512    H    GLY  72           H        GLY  72  11.356   0.495  -2.196
  513   1HA   GLY  72          2HA       GLY  72  12.893   2.089  -0.399
  514   2HA   GLY  72          1HA       GLY  72  11.170   2.391  -0.223
  515    HA   PRO  73           HA       PRO  73  12.271  -1.676   1.880
  516   1HB   PRO  73          2HB       PRO  73  13.985  -1.226   3.831
  517   2HB   PRO  73          1HB       PRO  73  14.553  -1.278   2.156
  518   1HG   PRO  73          2HG       PRO  73  14.083   1.073   3.927
  519   2HG   PRO  73          1HG       PRO  73  15.346   0.817   2.712
  520   1HD   PRO  73          2HD       PRO  73  12.930   2.243   2.365
  521   2HD   PRO  73          1HD       PRO  73  14.070   1.761   1.093
  522    H    ALA  74           H        ALA  74  11.866  -2.428   4.135
  523    HA   ALA  74           HA       ALA  74  10.086  -0.584   5.579
  524   1HB   ALA  74          1HB       ALA  74   9.105  -2.567   6.601
  525   2HB   ALA  74          2HB       ALA  74  10.253  -3.590   5.736
  526   3HB   ALA  74          3HB       ALA  74   9.044  -2.669   4.842
  527    H    ASN  75           H        ASN  75  10.061  -1.069   8.030
  528    HA   ASN  75           HA       ASN  75  12.602  -0.464   9.071
  529   1HB   ASN  75          2HB       ASN  75  10.482   0.216  10.146
  530   2HB   ASN  75          1HB       ASN  75  10.168  -1.466  10.559
  531   1HD2  ASN  75          1HD2      ASN  75  11.221  -2.389  12.273
  532   2HD2  ASN  75          2HD2      ASN  75  12.244  -1.501  13.350
  533    H    ASN  76           H        ASN  76  10.748  -3.495   9.046
  534    HA   ASN  76           HA       ASN  76  13.187  -5.006   9.327
  535   1HB   ASN  76          2HB       ASN  76  12.645  -4.462  11.680
  536   2HB   ASN  76          1HB       ASN  76  11.068  -5.215  11.480
  537   1HD2  ASN  76          1HD2      ASN  76  14.477  -5.744  11.807
  538   2HD2  ASN  76          2HD2      ASN  76  14.388  -7.453  12.080
  539    H    ASN  77           H        ASN  77  12.911  -7.250   8.898
  540    HA   ASN  77           HA       ASN  77  10.993  -7.749   6.870
  541   1HB   ASN  77          2HB       ASN  77  13.227  -8.730   6.807
  542   2HB   ASN  77          1HB       ASN  77  12.896  -9.627   8.285
  543   1HD2  ASN  77          1HD2      ASN  77  12.404  -9.447   4.873
  544   2HD2  ASN  77          2HD2      ASN  77  11.662 -10.999   4.686
  545    H    THR  78           H        THR  78  11.174  -8.648  10.270
  546    HA   THR  78           HA       THR  78   9.179 -10.681  10.128
  547    HB   THR  78           HB       THR  78  10.111  -9.207  12.597
  548    HG1  THR  78           1HG      THR  78  11.350 -11.253  11.048
  549   1HG2  THR  78          1HG2      THR  78   9.167 -12.044  12.165
  550   2HG2  THR  78          2HG2      THR  78   8.230 -10.752  12.914
  551   3HG2  THR  78          3HG2      THR  78   9.690 -11.351  13.701
  552    H    ALA  79           H        ALA  79   8.900  -7.462   9.727
  553    HA   ALA  79           HA       ALA  79   6.164  -7.429  10.807
  554   1HB   ALA  79          1HB       ALA  79   7.594  -5.850  12.015
  555   2HB   ALA  79          2HB       ALA  79   6.360  -5.009  11.075
  556   3HB   ALA  79          3HB       ALA  79   8.022  -5.073  10.492
  557    H    PHE  80           H        PHE  80   8.234  -5.848   8.375
  558    HA   PHE  80           HA       PHE  80   6.037  -6.112   6.446
  559   1HB   PHE  80          2HB       PHE  80   7.778  -3.650   6.684
  560   2HB   PHE  80          1HB       PHE  80   6.398  -3.873   5.618
  561    HD1  PHE  80           1HD      PHE  80   7.512  -2.891   8.890
  562    HD2  PHE  80           2HD      PHE  80   4.112  -4.018   6.599
  563    HE1  PHE  80           1HE      PHE  80   6.041  -1.899  10.592
  564    HE2  PHE  80           2HE      PHE  80   2.633  -3.030   8.295
  565    HZ   PHE  80           HZ       PHE  80   3.601  -2.020  10.332
  566    H    GLY  81           H        GLY  81   7.248  -5.118   4.211
  567   1HA   GLY  81          2HA       GLY  81   9.771  -6.648   4.039
  568   2HA   GLY  81          1HA       GLY  81   8.531  -6.776   2.799
  569    H    TYR  82           H        TYR  82   7.969  -4.789   1.654
  570    HA   TYR  82           HA       TYR  82   9.968  -2.683   1.662
  571   1HB   TYR  82          2HB       TYR  82  10.521  -2.913  -0.679
  572   2HB   TYR  82          1HB       TYR  82  10.831  -4.459   0.103
  573    HD1  TYR  82           1HD      TYR  82   8.571  -6.012   0.093
  574    HD2  TYR  82           2HD      TYR  82   9.601  -3.062  -2.795
  575    HE1  TYR  82           1HE      TYR  82   7.159  -7.149  -1.567
  576    HE2  TYR  82           2HE      TYR  82   8.190  -4.190  -4.462
  577    HH   TYR  82           HH       TYR  82   7.318  -6.569  -4.836
  578    H    TYR  83           H        TYR  83   9.286  -0.931   0.072
  579    HA   TYR  83           HA       TYR  83   6.427  -1.063  -0.540
  580   1HB   TYR  83          2HB       TYR  83   5.963   1.113   0.327
  581   2HB   TYR  83          1HB       TYR  83   6.774   0.219   1.602
  582    HD1  TYR  83           1HD      TYR  83   8.926   0.924   2.433
  583    HD2  TYR  83           2HD      TYR  83   7.124   2.939  -0.853
  584    HE1  TYR  83           1HE      TYR  83  10.553   2.755   2.667
  585    HE2  TYR  83           2HE      TYR  83   8.754   4.766  -0.635
  586    HH   TYR  83           HH       TYR  83  11.560   4.520   1.189
  587    H    LEU  84           H        LEU  84   5.871  -0.193  -2.454
  588    HA   LEU  84           HA       LEU  84   7.939   1.302  -3.917
  589   1HB   LEU  84          2HB       LEU  84   5.808  -0.534  -5.013
  590   2HB   LEU  84          1HB       LEU  84   6.875   0.451  -5.992
  591    HG   LEU  84           HG       LEU  84   7.744  -1.801  -4.178
  592   1HD1  LEU  84          1HD1      LEU  84   7.606  -1.632  -7.186
  593   2HD1  LEU  84          2HD1      LEU  84   6.529  -2.576  -6.154
  594   3HD1  LEU  84          3HD1      LEU  84   8.244  -2.983  -6.249
  595   1HD2  LEU  84          1HD2      LEU  84   9.936  -1.494  -5.216
  596   2HD2  LEU  84          2HD2      LEU  84   9.428  -0.041  -4.355
  597   3HD2  LEU  84          3HD2      LEU  84   9.319  -0.106  -6.113
  598    H    THR  85           H        THR  85   7.373   3.397  -3.921
  599    HA   THR  85           HA       THR  85   4.614   4.134  -3.571
  600    HB   THR  85           HB       THR  85   6.386   6.358  -4.072
  601    HG1  THR  85           1HG      THR  85   7.646   5.847  -2.063
  602   1HG2  THR  85          1HG2      THR  85   5.684   6.976  -1.813
  603   2HG2  THR  85          2HG2      THR  85   5.028   5.358  -1.568
  604   3HG2  THR  85          3HG2      THR  85   4.305   6.429  -2.768
  605    H    LEU  86           H        LEU  86   3.458   3.873  -5.333
  606    HA   LEU  86           HA       LEU  86   4.606   4.507  -7.963
  607   1HB   LEU  86          2HB       LEU  86   3.712   2.182  -7.257
  608   2HB   LEU  86          1HB       LEU  86   2.134   2.924  -7.399
  609    HG   LEU  86           HG       LEU  86   2.946   3.543  -9.799
  610   1HD1  LEU  86          1HD1      LEU  86   4.641   1.146  -9.133
  611   2HD1  LEU  86          2HD1      LEU  86   5.237   2.773  -9.454
  612   3HD1  LEU  86          3HD1      LEU  86   4.436   1.861 -10.731
  613   1HD2  LEU  86          1HD2      LEU  86   1.969   1.472 -10.609
  614   2HD2  LEU  86          2HD2      LEU  86   1.060   2.093  -9.230
  615   3HD2  LEU  86          3HD2      LEU  86   2.172   0.741  -9.017
  616    H    THR  87           H        THR  87   3.657   6.137  -9.174
  617    HA   THR  87           HA       THR  87   1.344   7.475  -8.120
  618    HB   THR  87           HB       THR  87   1.435   8.755 -10.300
  619    HG1  THR  87           1HG      THR  87   3.413   8.428 -11.516
  620   1HG2  THR  87          1HG2      THR  87   2.559   9.564  -8.277
  621   2HG2  THR  87          2HG2      THR  87   3.484   9.966  -9.722
  622   3HG2  THR  87          3HG2      THR  87   3.992   8.626  -8.696
  623    H    ARG  88           H        ARG  88  -0.718   7.022  -8.524
  624    HA   ARG  88           HA       ARG  88  -2.099   6.023 -10.607
  625   1HB   ARG  88          2HB       ARG  88  -0.520   4.150 -10.796
  626   2HB   ARG  88          1HB       ARG  88  -0.819   3.717  -9.120
  627   1HG   ARG  88          2HG       ARG  88  -3.205   3.291  -9.752
  628   2HG   ARG  88          1HG       ARG  88  -2.719   3.506 -11.437
  629   1HD   ARG  88          2HD       ARG  88  -1.074   1.660  -9.831
  630   2HD   ARG  88          1HD       ARG  88  -2.717   1.129 -10.164
  631    HE   ARG  88           HE       ARG  88  -2.069   0.653 -12.275
  632   1HH1  ARG  88          1HH1      ARG  88   0.188   3.110 -11.103
  633   2HH1  ARG  88          2HH1      ARG  88   1.210   2.987 -12.496
  634   1HH2  ARG  88          1HH2      ARG  88  -0.683   0.482 -14.034
  635   2HH2  ARG  88          2HH2      ARG  88   0.723   1.499 -14.127
  636    H    LEU  89           H        LEU  89  -4.205   5.963  -9.981
  637    HA   LEU  89           HA       LEU  89  -5.256   4.430  -7.939
  638   1HB   LEU  89          2HB       LEU  89  -4.035   6.233  -6.544
  639   2HB   LEU  89          1HB       LEU  89  -5.307   7.316  -7.072
  640    HG   LEU  89           HG       LEU  89  -5.552   6.218  -4.768
  641   1HD1  LEU  89          1HD1      LEU  89  -7.374   7.398  -5.870
  642   2HD1  LEU  89          2HD1      LEU  89  -7.961   5.985  -4.994
  643   3HD1  LEU  89          3HD1      LEU  89  -7.800   5.928  -6.749
  644   1HD2  LEU  89          1HD2      LEU  89  -4.944   3.957  -5.392
  645   2HD2  LEU  89          2HD2      LEU  89  -6.308   3.878  -6.504
  646   3HD2  LEU  89          3HD2      LEU  89  -6.593   3.999  -4.768
  647    H    ASP  90           H        ASP  90  -7.430   4.293  -8.174
  648    HA   ASP  90           HA       ASP  90  -8.745   6.326  -9.840
  649   1HB   ASP  90          2HB       ASP  90  -8.348   4.383 -11.232
  650   2HB   ASP  90          1HB       ASP  90  -9.041   3.318 -10.009
  651    H    LYS  91           H        LYS  91 -11.028   6.578  -9.476
  652    HA   LYS  91           HA       LYS  91 -11.689   6.620  -6.739
  653   1HB   LYS  91          2HB       LYS  91 -12.616   7.871  -8.987
  654   2HB   LYS  91          1HB       LYS  91 -13.942   6.777  -8.628
  655   1HG   LYS  91          2HG       LYS  91 -12.764   8.725  -6.658
  656   2HG   LYS  91          1HG       LYS  91 -14.196   9.033  -7.637
  657   1HD   LYS  91          2HD       LYS  91 -15.348   7.175  -6.589
  658   2HD   LYS  91          1HD       LYS  91 -13.901   6.767  -5.665
  659   1HE   LYS  91          2HE       LYS  91 -15.547   8.000  -4.321
  660   2HE   LYS  91          1HE       LYS  91 -14.026   8.877  -4.482
  661   1HZ   LYS  91          1HZ       LYS  91 -14.992  10.330  -6.073
  662   2HZ   LYS  91          2HZ       LYS  91 -16.071  10.250  -4.769
  663   3HZ   LYS  91          3HZ       LYS  91 -16.399   9.390  -6.193
  664    H    ALA  92           H        ALA  92 -12.791   4.507  -9.389
  665    HA   ALA  92           HA       ALA  92 -14.498   2.925  -7.759
  666   1HB   ALA  92          1HB       ALA  92 -14.490   1.339  -9.618
  667   2HB   ALA  92          2HB       ALA  92 -13.149   2.209 -10.360
  668   3HB   ALA  92          3HB       ALA  92 -14.720   2.990 -10.195
  669    H    ALA  93           H        ALA  93 -11.090   2.867  -8.512
  670    HA   ALA  93           HA       ALA  93 -10.469   0.314  -7.490
  671   1HB   ALA  93          1HB       ALA  93  -8.169   1.107  -7.361
  672   2HB   ALA  93          2HB       ALA  93  -8.715   2.769  -7.575
  673   3HB   ALA  93          3HB       ALA  93  -8.914   1.601  -8.882
  674    H    CYS  94           H        CYS  94 -10.884   3.456  -5.973
  675    HA   CYS  94           HA       CYS  94  -9.929   2.898  -3.414
  676   1HB   CYS  94          2HB       CYS  94 -10.644   5.144  -4.150
  677   2HB   CYS  94          1HB       CYS  94 -12.319   4.605  -4.185
  678    H    VAL  95           H        VAL  95 -13.155   2.369  -4.805
  679    HA   VAL  95           HA       VAL  95 -14.204   1.147  -2.451
  680    HB   VAL  95           HB       VAL  95 -15.250   0.942  -5.278
  681   1HG1  VAL  95          1HG1      VAL  95 -16.652   0.549  -2.636
  682   2HG1  VAL  95          2HG1      VAL  95 -16.181  -0.731  -3.754
  683   3HG1  VAL  95          3HG1      VAL  95 -17.398   0.453  -4.231
  684   1HG2  VAL  95          1HG2      VAL  95 -16.728   2.808  -4.685
  685   2HG2  VAL  95          2HG2      VAL  95 -15.028   3.274  -4.612
  686   3HG2  VAL  95          3HG2      VAL  95 -15.918   2.948  -3.125
  687    H    SER  96           H        SER  96 -12.676  -0.004  -5.363
  688    HA   SER  96           HA       SER  96 -13.281  -2.731  -5.110
  689   1HB   SER  96          2HB       SER  96 -12.328  -1.471  -7.116
  690   2HB   SER  96          1HB       SER  96 -10.758  -1.610  -6.325
  691    HG   SER  96           HG       SER  96 -12.453  -3.683  -7.271
  692    H    LEU  97           H        LEU  97 -10.507  -0.830  -3.962
  693    HA   LEU  97           HA       LEU  97  -9.176  -3.082  -2.822
  694   1HB   LEU  97          2HB       LEU  97  -8.809  -0.114  -2.447
  695   2HB   LEU  97          1HB       LEU  97  -7.770  -1.323  -1.711
  696    HG   LEU  97           HG       LEU  97  -8.170  -1.064  -4.692
  697   1HD1  LEU  97          1HD1      LEU  97  -5.954  -0.006  -4.713
  698   2HD1  LEU  97          2HD1      LEU  97  -5.954   0.010  -2.949
  699   3HD1  LEU  97          3HD1      LEU  97  -7.139   0.964  -3.840
  700   1HD2  LEU  97          1HD2      LEU  97  -7.460  -3.267  -3.956
  701   2HD2  LEU  97          2HD2      LEU  97  -6.147  -2.553  -3.022
  702   3HD2  LEU  97          3HD2      LEU  97  -6.138  -2.439  -4.783
  703    H    ALA  98           H        ALA  98 -11.714  -1.033  -1.792
  704    HA   ALA  98           HA       ALA  98 -11.439  -1.756   1.012
  705   1HB   ALA  98          1HB       ALA  98 -13.384  -0.347   1.375
  706   2HB   ALA  98          2HB       ALA  98 -13.605  -0.177  -0.366
  707   3HB   ALA  98          3HB       ALA  98 -12.177   0.506   0.412
  708    H    THR  99           H        THR  99 -12.637  -3.168  -1.727
  709    HA   THR  99           HA       THR  99 -14.395  -4.891  -0.118
  710    HB   THR  99           HB       THR  99 -15.253  -5.662  -2.431
  711    HG1  THR  99           1HG      THR  99 -14.115  -3.137  -3.126
  712   1HG2  THR  99          1HG2      THR  99 -15.879  -2.875  -1.459
  713   2HG2  THR  99          2HG2      THR  99 -16.599  -4.368  -0.854
  714   3HG2  THR  99          3HG2      THR  99 -16.897  -3.852  -2.516
  715    H    LEU 100           H        LEU 100 -11.385  -4.643  -1.035
  716    HA   LEU 100           HA       LEU 100 -11.016  -7.491  -1.690
  717   1HB   LEU 100          2HB       LEU 100 -10.033  -5.488  -3.111
  718   2HB   LEU 100          1HB       LEU 100  -8.825  -5.441  -1.841
  719    HG   LEU 100           HG       LEU 100  -9.412  -7.888  -3.515
  720   1HD1  LEU 100          1HD1      LEU 100  -7.314  -7.345  -4.670
  721   2HD1  LEU 100          2HD1      LEU 100  -7.235  -5.819  -3.789
  722   3HD1  LEU 100          3HD1      LEU 100  -8.553  -6.116  -4.926
  723   1HD2  LEU 100          1HD2      LEU 100  -8.423  -8.383  -1.337
  724   2HD2  LEU 100          2HD2      LEU 100  -7.130  -7.227  -1.655
  725   3HD2  LEU 100          3HD2      LEU 100  -7.274  -8.683  -2.640
  726    H    ASN 101           H        ASN 101 -10.421  -8.718   0.022
  727    HA   ASN 101           HA       ASN 101  -9.803  -7.432   2.502
  728   1HB   ASN 101          2HB       ASN 101 -11.165  -9.486   2.434
  729   2HB   ASN 101          1HB       ASN 101  -9.766 -10.385   1.853
  730   1HD2  ASN 101          1HD2      ASN 101 -11.152  -8.676   4.558
  731   2HD2  ASN 101          2HD2      ASN 101 -10.137  -9.371   5.773
  732    H    LEU 102           H        LEU 102  -7.869  -6.354   2.140
  733    HA   LEU 102           HA       LEU 102  -5.459  -7.865   1.702
  734   1HB   LEU 102          2HB       LEU 102  -6.002  -5.009   2.463
  735   2HB   LEU 102          1HB       LEU 102  -4.381  -5.670   2.534
  736    HG   LEU 102           HG       LEU 102  -4.728  -6.298   0.067
  737   1HD1  LEU 102          1HD1      LEU 102  -6.890  -4.223   0.346
  738   2HD1  LEU 102          2HD1      LEU 102  -7.143  -5.935   0.003
  739   3HD1  LEU 102          3HD1      LEU 102  -6.299  -4.916  -1.164
  740   1HD2  LEU 102          1HD2      LEU 102  -4.038  -4.066  -0.653
  741   2HD2  LEU 102          2HD2      LEU 102  -3.206  -4.572   0.817
  742   3HD2  LEU 102          3HD2      LEU 102  -4.534  -3.416   0.910
  743    H    GLY 103           H        GLY 103  -6.283  -9.361   3.461
  744   1HA   GLY 103          2HA       GLY 103  -4.974  -8.534   5.970
  745   2HA   GLY 103          1HA       GLY 103  -6.542  -9.328   6.001
  746    H    THR 104           H        THR 104  -5.798 -11.078   3.724
  747    HA   THR 104           HA       THR 104  -5.066 -13.351   5.074
  748    HB   THR 104           HB       THR 104  -4.387 -12.867   2.175
  749    HG1  THR 104           1HG      THR 104  -6.609 -13.681   1.873
  750   1HG2  THR 104          1HG2      THR 104  -3.604 -14.991   3.114
  751   2HG2  THR 104          2HG2      THR 104  -4.903 -15.253   1.950
  752   3HG2  THR 104          3HG2      THR 104  -5.238 -15.344   3.679
  753    H    SER 105           H        SER 105  -2.873 -11.743   2.752
  754    HA   SER 105           HA       SER 105  -0.631 -12.596   4.454
  755   1HB   SER 105          2HB       SER 105   0.679 -12.480   2.260
  756   2HB   SER 105          1HB       SER 105  -0.492 -13.793   2.410
  757    HG   SER 105           HG       SER 105  -0.438 -11.661   0.679
  758    H    ALA 106           H        ALA 106  -2.255  -9.979   3.012
  759    HA   ALA 106           HA       ALA 106  -0.288  -8.076   2.607
  760   1HB   ALA 106          1HB       ALA 106  -2.637  -7.806   1.951
  761   2HB   ALA 106          2HB       ALA 106  -2.026  -6.414   2.845
  762   3HB   ALA 106          3HB       ALA 106  -3.072  -7.588   3.645
  763    H    LYS 107           H        LYS 107   0.482  -6.346   3.848
  764    HA   LYS 107           HA       LYS 107   0.824  -7.020   6.631
  765   1HB   LYS 107          2HB       LYS 107   2.169  -5.241   4.712
  766   2HB   LYS 107          1HB       LYS 107   2.112  -4.639   6.361
  767   1HG   LYS 107          2HG       LYS 107   4.163  -5.822   6.002
  768   2HG   LYS 107          1HG       LYS 107   3.158  -6.721   7.138
  769   1HD   LYS 107          2HD       LYS 107   2.446  -8.190   5.289
  770   2HD   LYS 107          1HD       LYS 107   3.526  -7.311   4.205
  771   1HE   LYS 107          2HE       LYS 107   4.620  -9.325   4.945
  772   2HE   LYS 107          1HE       LYS 107   5.426  -7.925   5.651
  773   1HZ   LYS 107          1HZ       LYS 107   3.391  -9.561   7.074
  774   2HZ   LYS 107          2HZ       LYS 107   4.350  -8.331   7.736
  775   3HZ   LYS 107          3HZ       LYS 107   5.065  -9.782   7.228
  776    H    GLY 108           H        GLY 108  -0.633  -4.454   4.688
  777   1HA   GLY 108          2HA       GLY 108  -2.782  -3.989   6.343
  778   2HA   GLY 108          1HA       GLY 108  -1.526  -2.902   6.905
  779    H    TYR 109           H        TYR 109  -3.693  -1.704   6.082
  780    HA   TYR 109           HA       TYR 109  -2.957  -0.626   3.451
  781   1HB   TYR 109          2HB       TYR 109  -4.830  -2.258   3.228
  782   2HB   TYR 109          1HB       TYR 109  -5.774  -1.279   4.343
  783    HD1  TYR 109           1HD      TYR 109  -4.715  -1.739   0.952
  784    HD2  TYR 109           2HD      TYR 109  -6.447   1.039   3.651
  785    HE1  TYR 109           1HE      TYR 109  -5.582  -0.441  -0.955
  786    HE2  TYR 109           2HE      TYR 109  -7.321   2.349   1.761
  787    HH   TYR 109           HH       TYR 109  -7.404   1.174  -1.405
  788    H    GLY 110           H        GLY 110  -2.737   1.532   3.539
  789   1HA   GLY 110          2HA       GLY 110  -4.167   2.976   5.684
  790   2HA   GLY 110          1HA       GLY 110  -2.467   3.269   5.349
  791    H    VAL 111           H        VAL 111  -4.342   5.312   5.307
  792    HA   VAL 111           HA       VAL 111  -4.207   6.042   2.468
  793    HB   VAL 111           HB       VAL 111  -6.521   5.428   2.860
  794   1HG1  VAL 111          1HG1      VAL 111  -6.507   7.465   5.080
  795   2HG1  VAL 111          2HG1      VAL 111  -6.599   5.715   5.276
  796   3HG1  VAL 111          3HG1      VAL 111  -7.918   6.585   4.492
  797   1HG2  VAL 111          1HG2      VAL 111  -6.106   7.303   1.365
  798   2HG2  VAL 111          2HG2      VAL 111  -6.200   8.424   2.725
  799   3HG2  VAL 111          3HG2      VAL 111  -7.628   7.514   2.231
  800    H    ASN 112           H        ASN 112  -3.244   7.904   2.126
  801    HA   ASN 112           HA       ASN 112  -2.305   9.945   2.409
  802   1HB   ASN 112          2HB       ASN 112  -4.790  10.371   3.101
  803   2HB   ASN 112          1HB       ASN 112  -4.123  10.517   4.725
  804   1HD2  ASN 112          1HD2      ASN 112  -5.409  12.515   3.061
  805   2HD2  ASN 112          2HD2      ASN 112  -4.268  13.803   2.900
  806    H    ILE 113           H        ILE 113  -1.038   7.833   3.642
  807    HA   ILE 113           HA       ILE 113  -0.037   8.899   6.167
  808    HB   ILE 113           HB       ILE 113   0.145   6.255   4.799
  809   1HG1  ILE 113          2HG1      ILE 113  -0.091   5.468   7.177
  810   2HG1  ILE 113          1HG1      ILE 113  -0.198   7.155   7.662
  811   1HG2  ILE 113          1HG2      ILE 113   2.047   5.556   6.206
  812   2HG2  ILE 113          2HG2      ILE 113   2.268   7.233   6.707
  813   3HG2  ILE 113          3HG2      ILE 113   2.492   6.779   5.018
  814   1HD1  ILE 113          1HD1      ILE 113  -2.104   5.711   5.842
  815   2HD1  ILE 113          2HD1      ILE 113  -2.209   7.412   6.297
  816   3HD1  ILE 113          3HD1      ILE 113  -2.392   6.157   7.523
  817    H    SER 114           H        SER 114   1.796  10.047   6.281
  818    HA   SER 114           HA       SER 114   3.569  10.053   3.939
  819   1HB   SER 114          2HB       SER 114   2.657  12.263   4.654
  820   2HB   SER 114          1HB       SER 114   3.440  12.051   6.219
  821    HG   SER 114           HG       SER 114   5.386  12.326   5.310
  822    H    GLY 115           H        GLY 115   4.686   8.143   4.431
  823   1HA   GLY 115          2HA       GLY 115   6.996   7.862   5.449
  824   2HA   GLY 115          1HA       GLY 115   6.188   8.188   6.974
  825    H    GLU 116           H        GLU 116   5.978   6.009   4.172
  826    HA   GLU 116           HA       GLU 116   4.677   3.913   5.474
  827   1HB   GLU 116          2HB       GLU 116   6.479   4.046   3.069
  828   2HB   GLU 116          1HB       GLU 116   5.810   2.525   3.627
  829   1HG   GLU 116          2HG       GLU 116   4.298   3.134   2.025
  830   2HG   GLU 116          1HG       GLU 116   3.541   3.785   3.477
  831    H    ASN 117           H        ASN 117   8.024   4.854   5.355
  832    HA   ASN 117           HA       ASN 117   9.233   2.490   6.253
  833   1HB   ASN 117          2HB       ASN 117  10.391   4.513   5.310
  834   2HB   ASN 117          1HB       ASN 117  10.131   5.318   6.851
  835   1HD2  ASN 117          1HD2      ASN 117  11.879   2.837   5.169
  836   2HD2  ASN 117          2HD2      ASN 117  13.081   2.577   6.384
  837    H    ASN 118           H        ASN 118   7.509   5.005   7.928
  838    HA   ASN 118           HA       ASN 118   7.791   3.493  10.433
  839   1HB   ASN 118          2HB       ASN 118   7.667   5.631  11.678
  840   2HB   ASN 118          1HB       ASN 118   9.093   5.544  10.654
  841   1HD2  ASN 118          1HD2      ASN 118   7.661   7.842  11.782
  842   2HD2  ASN 118          2HD2      ASN 118   7.256   8.850  10.439
  843    H    ILE 119           H        ILE 119   5.824   2.967   8.638
  844    HA   ILE 119           HA       ILE 119   3.451   4.321   8.627
  845    HB   ILE 119           HB       ILE 119   3.886   2.356   7.261
  846   1HG1  ILE 119          2HG1      ILE 119   1.696   1.164   7.564
  847   2HG1  ILE 119          1HG1      ILE 119   1.461   2.088   9.045
  848   1HG2  ILE 119          1HG2      ILE 119   3.598   0.756   9.795
  849   2HG2  ILE 119          2HG2      ILE 119   5.088   1.012   8.891
  850   3HG2  ILE 119          3HG2      ILE 119   3.765   0.097   8.168
  851   1HD1  ILE 119          1HD1      ILE 119   1.741   3.237   6.279
  852   2HD1  ILE 119          2HD1      ILE 119   1.498   4.157   7.761
  853   3HD1  ILE 119          3HD1      ILE 119   0.241   3.062   7.189
  854    H    THR 120           H        THR 120   1.583   4.340   9.827
  855    HA   THR 120           HA       THR 120   1.952   4.214  12.655
  856    HB   THR 120           HB       THR 120  -0.470   4.964  12.685
  857    HG1  THR 120           1HG      THR 120  -1.538   4.811  10.872
  858   1HG2  THR 120          1HG2      THR 120   1.471   6.572  11.017
  859   2HG2  THR 120          2HG2      THR 120   1.375   6.563  12.779
  860   3HG2  THR 120          3HG2      THR 120   0.037   7.206  11.826
  861    H    SER 121           H        SER 121   0.045   3.315  13.996
  862    HA   SER 121           HA       SER 121   0.013   0.518  13.785
  863   1HB   SER 121          2HB       SER 121  -1.886   2.292  15.339
  864   2HB   SER 121          1HB       SER 121  -1.542   0.591  15.655
  865    HG   SER 121           HG       SER 121  -0.288   1.775  17.045
  866    H    PHE 122           H        PHE 122  -1.823  -0.888  13.468
  867    HA   PHE 122           HA       PHE 122  -3.529   0.120  11.299
  868   1HB   PHE 122          2HB       PHE 122  -2.673  -2.707  11.963
  869   2HB   PHE 122          1HB       PHE 122  -3.697  -2.243  10.610
  870    HD1  PHE 122           1HD      PHE 122  -2.748  -0.831   8.783
  871    HD2  PHE 122           2HD      PHE 122  -0.330  -2.545  11.834
  872    HE1  PHE 122           1HE      PHE 122  -0.754  -0.503   7.381
  873    HE2  PHE 122           2HE      PHE 122   1.669  -2.217  10.440
  874    HZ   PHE 122           HZ       PHE 122   1.464  -1.139   8.232
  875    H    GLY 123           H        GLY 123  -5.667   0.052  11.438
  876   1HA   GLY 123          2HA       GLY 123  -6.866  -1.260  13.796
  877   2HA   GLY 123          1HA       GLY 123  -7.333   0.360  13.295
  878    H    ASN 124           H        ASN 124  -9.260   0.368  12.339
  879    HA   ASN 124           HA       ASN 124  -9.889  -1.695  10.366
  880   1HB   ASN 124          2HB       ASN 124 -11.998  -2.292  11.384
  881   2HB   ASN 124          1HB       ASN 124 -10.716  -2.544  12.561
  882   1HD2  ASN 124          1HD2      ASN 124 -13.538  -2.184  13.012
  883   2HD2  ASN 124          2HD2      ASN 124 -13.708  -0.786  14.025
  884    H    SER 125           H        SER 125  -9.412   1.290  10.490
  885    HA   SER 125           HA       SER 125 -11.643   1.943   8.724
  886   1HB   SER 125          2HB       SER 125 -10.874   3.723  11.059
  887   2HB   SER 125          1HB       SER 125 -12.069   4.099   9.816
  888    HG   SER 125           HG       SER 125 -12.536   1.680  10.962
  889    H    ALA 126           H        ALA 126 -11.086   3.349   7.088
  890    HA   ALA 126           HA       ALA 126  -8.352   4.446   7.195
  891   1HB   ALA 126          1HB       ALA 126 -10.139   4.010   4.803
  892   2HB   ALA 126          2HB       ALA 126  -8.775   3.000   5.279
  893   3HB   ALA 126          3HB       ALA 126  -8.501   4.663   4.763
  894    H    ASP 127           H        ASP 127  -8.500   6.368   8.121
  895    HA   ASP 127           HA       ASP 127  -9.924   8.434   6.660
  896   1HB   ASP 127          2HB       ASP 127 -11.480   7.777   8.467
  897   2HB   ASP 127          1HB       ASP 127 -10.219   8.077   9.661
  898    H    GLN 128           H        GLN 128  -7.693   8.595   6.030
  899    HA   GLN 128           HA       GLN 128  -5.554   9.311   6.092
  900   1HB   GLN 128          2HB       GLN 128  -6.811  11.068   8.175
  901   2HB   GLN 128          1HB       GLN 128  -5.079  11.139   7.890
  902   1HG   GLN 128          2HG       GLN 128  -6.347  12.858   6.663
  903   2HG   GLN 128          1HG       GLN 128  -5.417  11.798   5.610
  904   1HE2  GLN 128          1HE2      GLN 128  -6.497  10.399   4.228
  905   2HE2  GLN 128          2HE2      GLN 128  -8.187  10.538   3.905
  906    H    ALA 129           H        ALA 129  -6.368   6.991   7.513
  907    HA   ALA 129           HA       ALA 129  -4.105   6.680   9.332
  908   1HB   ALA 129          1HB       ALA 129  -6.050   7.149  10.757
  909   2HB   ALA 129          2HB       ALA 129  -5.478   5.494  10.968
  910   3HB   ALA 129          3HB       ALA 129  -6.923   5.813  10.005
  911    H    ALA 130           H        ALA 130  -4.006   4.211   9.939
  912    HA   ALA 130           HA       ALA 130  -4.401   2.711   7.431
  913   1HB   ALA 130          1HB       ALA 130  -2.350   2.252   9.596
  914   2HB   ALA 130          2HB       ALA 130  -2.055   3.065   8.059
  915   3HB   ALA 130          3HB       ALA 130  -2.490   1.357   8.084
  916    H    LYS 131           H        LYS 131  -5.067   0.522   7.544
  917    HA   LYS 131           HA       LYS 131  -6.118  -0.354  10.141
  918   1HB   LYS 131          2HB       LYS 131  -8.239  -0.720   9.404
  919   2HB   LYS 131          1HB       LYS 131  -7.831   0.584   8.298
  920   1HG   LYS 131          2HG       LYS 131  -7.553  -2.339   7.626
  921   2HG   LYS 131          1HG       LYS 131  -8.982  -1.376   7.266
  922   1HD   LYS 131          2HD       LYS 131  -6.316  -0.415   6.342
  923   2HD   LYS 131          1HD       LYS 131  -7.102  -1.732   5.474
  924   1HE   LYS 131          2HE       LYS 131  -7.554   0.562   4.571
  925   2HE   LYS 131          1HE       LYS 131  -8.989  -0.384   4.966
  926   1HZ   LYS 131          1HZ       LYS 131  -7.807   1.602   6.818
  927   2HZ   LYS 131          2HZ       LYS 131  -9.329   0.847   6.923
  928   3HZ   LYS 131          3HZ       LYS 131  -9.025   1.976   5.705
  929    H    SER 132           H        SER 132  -6.620  -2.747  10.122
  930    HA   SER 132           HA       SER 132  -4.301  -4.055   8.988
  931   1HB   SER 132          2HB       SER 132  -5.077  -5.960  10.445
  932   2HB   SER 132          1HB       SER 132  -4.696  -4.472  11.299
  933    HG   SER 132           HG       SER 132  -6.648  -5.283  12.060
  934    H    THR 133           H        THR 133  -7.773  -4.043   8.497
  935    HA   THR 133           HA       THR 133  -7.362  -5.936   6.284
  936    HB   THR 133           HB       THR 133  -9.680  -6.814   6.726
  937    HG1  THR 133           1HG      THR 133 -10.256  -5.090   8.213
  938   1HG2  THR 133          1HG2      THR 133  -8.953  -8.386   8.471
  939   2HG2  THR 133          2HG2      THR 133  -7.584  -7.337   8.841
  940   3HG2  THR 133          3HG2      THR 133  -7.691  -8.124   7.267
  941    H    ALA 134           H        ALA 134  -8.332  -5.412   4.410
  942    HA   ALA 134           HA       ALA 134  -9.663  -2.792   4.363
  943   1HB   ALA 134          1HB       ALA 134  -8.184  -4.220   2.160
  944   2HB   ALA 134          2HB       ALA 134  -7.545  -2.915   3.161
  945   3HB   ALA 134          3HB       ALA 134  -8.888  -2.606   2.060
  946    H    ILE 135           H        ILE 135 -11.246  -4.951   5.011
  947    HA   ILE 135           HA       ILE 135 -12.812  -5.415   2.561
  948    HB   ILE 135           HB       ILE 135 -11.786  -7.451   3.681
  949   1HG1  ILE 135          2HG1      ILE 135 -14.811  -7.377   3.513
  950   2HG1  ILE 135          1HG1      ILE 135 -13.720  -7.609   2.151
  951   1HG2  ILE 135          1HG2      ILE 135 -13.823  -6.794   5.806
  952   2HG2  ILE 135          2HG2      ILE 135 -12.067  -6.792   5.994
  953   3HG2  ILE 135          3HG2      ILE 135 -12.921  -8.306   5.693
  954   1HD1  ILE 135          1HD1      ILE 135 -13.966  -9.459   4.511
  955   2HD1  ILE 135          2HD1      ILE 135 -12.957  -9.703   3.084
  956   3HD1  ILE 135          3HD1      ILE 135 -14.715  -9.702   2.935
  957    H    THR 136           H        THR 136 -15.222  -5.849   3.179
  958    HA   THR 136           HA       THR 136 -17.167  -5.307   4.224
  959    HB   THR 136           HB       THR 136 -15.441  -3.931   6.295
  960    HG1  THR 136           1HG      THR 136 -15.133  -5.943   6.872
  961   1HG2  THR 136          1HG2      THR 136 -18.382  -4.625   6.370
  962   2HG2  THR 136          2HG2      THR 136 -17.705  -3.001   6.268
  963   3HG2  THR 136          3HG2      THR 136 -17.443  -3.977   7.714
  964    HA   PRO 137           HA       PRO 137 -17.725  -1.611   1.819
  965   1HB   PRO 137          2HB       PRO 137 -20.404  -1.333   2.509
  966   2HB   PRO 137          1HB       PRO 137 -19.781  -2.294   1.165
  967   1HG   PRO 137          2HG       PRO 137 -20.600  -3.161   3.900
  968   2HG   PRO 137          1HG       PRO 137 -20.831  -3.978   2.342
  969   1HD   PRO 137          2HD       PRO 137 -18.939  -4.769   4.062
  970   2HD   PRO 137          1HD       PRO 137 -18.661  -4.796   2.308
  971    H    ALA 138           H        ALA 138 -18.422  -1.873   5.231
  972    HA   ALA 138           HA       ALA 138 -18.983   0.823   5.789
  973   1HB   ALA 138          1HB       ALA 138 -18.281   0.333   8.077
  974   2HB   ALA 138          2HB       ALA 138 -17.547  -1.178   7.538
  975   3HB   ALA 138          3HB       ALA 138 -19.295  -0.960   7.438
  976    H    GLU 139           H        GLU 139 -15.922  -0.929   5.503
  977    HA   GLU 139           HA       GLU 139 -14.224   1.234   6.127
  978   1HB   GLU 139          2HB       GLU 139 -13.504  -1.131   6.105
  979   2HB   GLU 139          1HB       GLU 139 -13.697  -1.164   4.358
  980   1HG   GLU 139          2HG       GLU 139 -11.370  -0.913   4.981
  981   2HG   GLU 139          1HG       GLU 139 -11.950   0.515   4.124
  982    H    ALA 140           H        ALA 140 -15.614   0.044   3.113
  983    HA   ALA 140           HA       ALA 140 -14.333   1.751   1.315
  984   1HB   ALA 140          1HB       ALA 140 -15.692  -0.153   0.604
  985   2HB   ALA 140          2HB       ALA 140 -16.222   1.334  -0.185
  986   3HB   ALA 140          3HB       ALA 140 -17.149   0.671   1.162
  987    H    ALA 141           H        ALA 141 -17.231   2.226   3.267
  988    HA   ALA 141           HA       ALA 141 -17.864   4.788   2.203
  989   1HB   ALA 141          1HB       ALA 141 -19.445   4.951   4.051
  990   2HB   ALA 141          2HB       ALA 141 -18.705   3.547   4.821
  991   3HB   ALA 141          3HB       ALA 141 -19.542   3.367   3.279
  992    H    THR 142           H        THR 142 -15.597   3.685   4.529
  993    HA   THR 142           HA       THR 142 -15.375   6.248   5.871
  994    HB   THR 142           HB       THR 142 -13.619   3.804   6.194
  995    HG1  THR 142           1HG      THR 142 -15.821   3.316   6.670
  996   1HG2  THR 142          1HG2      THR 142 -14.134   6.183   7.985
  997   2HG2  THR 142          2HG2      THR 142 -12.644   5.846   7.102
  998   3HG2  THR 142          3HG2      THR 142 -13.155   4.780   8.411
  999    H    ALA 143           H        ALA 143 -13.263   4.137   3.938
 1000    HA   ALA 143           HA       ALA 143 -11.132   5.941   3.672
 1001   1HB   ALA 143          1HB       ALA 143 -10.954   3.534   3.243
 1002   2HB   ALA 143          2HB       ALA 143 -10.356   4.492   1.886
 1003   3HB   ALA 143          3HB       ALA 143 -11.942   3.727   1.796
 1004    H    CYS 144           H        CYS 144 -13.691   5.134   1.315
 1005    HA   CYS 144           HA       CYS 144 -12.806   7.221  -0.470
 1006   1HB   CYS 144          2HB       CYS 144 -15.319   5.559  -0.685
 1007   2HB   CYS 144          1HB       CYS 144 -14.478   6.399  -1.981
 1008    H    LYS 145           H        LYS 145 -14.149   7.659   2.301
 1009    HA   LYS 145           HA       LYS 145 -16.610   8.953   1.919
 1010   1HB   LYS 145          2HB       LYS 145 -15.813   8.257   4.116
 1011   2HB   LYS 145          1HB       LYS 145 -14.481   9.398   4.019
 1012   1HG   LYS 145          2HG       LYS 145 -16.072  11.253   4.040
 1013   2HG   LYS 145          1HG       LYS 145 -17.408  10.103   4.155
 1014   1HD   LYS 145          2HD       LYS 145 -16.815  11.022   6.350
 1015   2HD   LYS 145          1HD       LYS 145 -16.533   9.281   6.281
 1016   1HE   LYS 145          2HE       LYS 145 -14.138   9.779   5.764
 1017   2HE   LYS 145          1HE       LYS 145 -14.479  11.481   6.069
 1018   1HZ   LYS 145          1HZ       LYS 145 -15.082  10.945   8.323
 1019   2HZ   LYS 145          2HZ       LYS 145 -13.529  10.339   7.997
 1020   3HZ   LYS 145          3HZ       LYS 145 -14.863   9.289   8.035
 1021    H    ASN 146           H        ASN 146 -13.313  10.278   2.106
 1022    HA   ASN 146           HA       ASN 146 -13.959  12.318   0.221
 1023   1HB   ASN 146          2HB       ASN 146 -13.570  14.280   1.571
 1024   2HB   ASN 146          1HB       ASN 146 -14.874  13.355   2.295
 1025   1HD2  ASN 146          1HD2      ASN 146 -13.280  11.422   3.628
 1026   2HD2  ASN 146          2HD2      ASN 146 -12.416  12.217   4.901
 1027    H    THR 147           H        THR 147 -12.244  12.319  -1.032
 1028    HA   THR 147           HA       THR 147  -9.598  12.396   0.211
 1029    HB   THR 147           HB       THR 147  -8.812  10.827  -1.668
 1030    HG1  THR 147           1HG      THR 147 -10.516   9.301  -2.252
 1031   1HG2  THR 147          1HG2      THR 147  -8.796  10.172   0.678
 1032   2HG2  THR 147          2HG2      THR 147  -9.297   8.821  -0.337
 1033   3HG2  THR 147          3HG2      THR 147 -10.500   9.726   0.582
 1034    H    ASP 148           H        ASP 148 -10.534  11.956  -3.166
 1035    HA   ASP 148           HA       ASP 148 -10.141  13.150  -5.044
 1036   1HB   ASP 148          2HB       ASP 148 -10.639  15.468  -3.171
 1037   2HB   ASP 148          1HB       ASP 148 -10.501  15.627  -4.918
 1038    H    SER 149           H        SER 149  -8.746  15.830  -3.285
 1039    HA   SER 149           HA       SER 149  -6.256  15.426  -4.693
 1040   1HB   SER 149          2HB       SER 149  -7.017  17.538  -2.660
 1041   2HB   SER 149          1HB       SER 149  -5.592  17.565  -3.701
 1042    HG   SER 149           HG       SER 149  -7.192  17.409  -5.483
 1043    H    THR 150           H        THR 150  -7.574  14.640  -1.642
 1044    HA   THR 150           HA       THR 150  -4.921  14.011  -0.561
 1045    HB   THR 150           HB       THR 150  -6.138  13.467   1.553
 1046    HG1  THR 150           1HG      THR 150  -8.393  14.489   0.120
 1047   1HG2  THR 150          1HG2      THR 150  -5.176  15.682   1.236
 1048   2HG2  THR 150          2HG2      THR 150  -6.681  15.786   2.151
 1049   3HG2  THR 150          3HG2      THR 150  -6.653  16.224   0.443
 1050    H    ASN 151           H        ASN 151  -6.398  12.651  -2.782
 1051    HA   ASN 151           HA       ASN 151  -7.077  10.049  -1.689
 1052   1HB   ASN 151          2HB       ASN 151  -8.352  11.287  -3.550
 1053   2HB   ASN 151          1HB       ASN 151  -7.027  10.821  -4.605
 1054   1HD2  ASN 151          1HD2      ASN 151  -8.597   9.697  -5.839
 1055   2HD2  ASN 151          2HD2      ASN 151  -9.130   8.131  -5.346
 1056    H    LYS 152           H        LYS 152  -4.869   9.651  -0.933
 1057    HA   LYS 152           HA       LYS 152  -3.436   8.145  -2.966
 1058   1HB   LYS 152          2HB       LYS 152  -1.217   8.986  -2.147
 1059   2HB   LYS 152          1HB       LYS 152  -2.144  10.149  -3.074
 1060   1HG   LYS 152          2HG       LYS 152  -2.116  10.131  -0.065
 1061   2HG   LYS 152          1HG       LYS 152  -0.924  11.010  -1.023
 1062   1HD   LYS 152          2HD       LYS 152  -2.773  12.249  -2.103
 1063   2HD   LYS 152          1HD       LYS 152  -3.914  11.412  -1.054
 1064   1HE   LYS 152          2HE       LYS 152  -3.546  13.513  -0.056
 1065   2HE   LYS 152          1HE       LYS 152  -2.617  12.359   0.896
 1066   1HZ   LYS 152          1HZ       LYS 152  -0.621  13.080  -0.113
 1067   2HZ   LYS 152          2HZ       LYS 152  -1.453  14.483   0.349
 1068   3HZ   LYS 152          3HZ       LYS 152  -1.440  13.995  -1.279
 1069    H    VAL 153           H        VAL 153  -3.140   6.170  -2.217
 1070    HA   VAL 153           HA       VAL 153  -3.180   5.797   0.688
 1071    HB   VAL 153           HB       VAL 153  -4.091   3.501   0.120
 1072   1HG1  VAL 153          1HG1      VAL 153  -6.381   4.308  -0.107
 1073   2HG1  VAL 153          2HG1      VAL 153  -5.773   5.897  -0.578
 1074   3HG1  VAL 153          3HG1      VAL 153  -5.473   5.283   1.049
 1075   1HG2  VAL 153          1HG2      VAL 153  -5.260   3.267  -2.014
 1076   2HG2  VAL 153          2HG2      VAL 153  -3.521   3.449  -2.243
 1077   3HG2  VAL 153          3HG2      VAL 153  -4.597   4.814  -2.539
 1078    H    THR 154           H        THR 154  -1.046   5.558   1.238
 1079    HA   THR 154           HA       THR 154   0.637   3.612  -0.006
 1080    HB   THR 154           HB       THR 154   2.168   4.102   1.674
 1081    HG1  THR 154           1HG      THR 154   0.113   3.776   3.303
 1082   1HG2  THR 154          1HG2      THR 154   1.512   6.173   0.488
 1083   2HG2  THR 154          2HG2      THR 154   2.084   6.477   2.130
 1084   3HG2  THR 154          3HG2      THR 154   0.356   6.513   1.777
 1085    H    TYR 155           H        TYR 155   0.423   1.363   0.187
 1086    HA   TYR 155           HA       TYR 155  -0.482   0.374   2.781
 1087   1HB   TYR 155          2HB       TYR 155  -2.148  -1.144   1.807
 1088   2HB   TYR 155          1HB       TYR 155  -2.554   0.546   1.564
 1089    HD1  TYR 155           1HD      TYR 155  -2.344  -2.608   0.012
 1090    HD2  TYR 155           2HD      TYR 155  -1.782   1.540  -0.749
 1091    HE1  TYR 155           1HE      TYR 155  -2.586  -3.019  -2.400
 1092    HE2  TYR 155           2HE      TYR 155  -2.019   1.142  -3.162
 1093    HH   TYR 155           HH       TYR 155  -3.125  -1.875  -4.411
 1094    H    PHE 156           H        PHE 156   0.683  -1.231   3.482
 1095    HA   PHE 156           HA       PHE 156   2.610  -2.512   1.762
 1096   1HB   PHE 156          2HB       PHE 156   2.019  -2.687   4.710
 1097   2HB   PHE 156          1HB       PHE 156   3.156  -3.780   3.931
 1098    HD1  PHE 156           1HD      PHE 156   5.283  -2.972   3.098
 1099    HD2  PHE 156           2HD      PHE 156   2.528  -0.356   5.013
 1100    HE1  PHE 156           1HE      PHE 156   7.059  -1.290   3.350
 1101    HE2  PHE 156           2HE      PHE 156   4.300   1.331   5.268
 1102    HZ   PHE 156           HZ       PHE 156   6.593   0.836   4.453
 1103    H    MET 157           H        MET 157   2.356  -4.384   0.763
 1104    HA   MET 157           HA       MET 157   0.240  -6.201   1.650
 1105   1HB   MET 157          2HB       MET 157  -0.879  -4.971  -0.024
 1106   2HB   MET 157          1HB       MET 157   0.539  -4.922  -1.058
 1107   1HG   MET 157          2HG       MET 157  -0.973  -6.406  -2.064
 1108   2HG   MET 157          1HG       MET 157   0.293  -7.399  -1.345
 1109   1HE   MET 157          1HE       MET 157  -1.041  -9.610  -1.410
 1110   2HE   MET 157          2HE       MET 157  -2.314  -8.762  -2.289
 1111   3HE   MET 157          3HE       MET 157  -2.721  -9.770  -0.900
 1112    H    LYS 158           H        LYS 158   1.280  -8.061   2.066
 1113    HA   LYS 158           HA       LYS 158   3.468  -8.937   0.386
 1114   1HB   LYS 158          2HB       LYS 158   3.527  -9.553   2.740
 1115   2HB   LYS 158          1HB       LYS 158   1.978 -10.375   2.592
 1116   1HG   LYS 158          2HG       LYS 158   3.050 -11.900   0.923
 1117   2HG   LYS 158          1HG       LYS 158   4.593 -11.155   1.336
 1118   1HD   LYS 158          2HD       LYS 158   2.767 -12.518   3.309
 1119   2HD   LYS 158          1HD       LYS 158   4.156 -13.285   2.535
 1120   1HE   LYS 158          2HE       LYS 158   5.638 -11.630   3.540
 1121   2HE   LYS 158          1HE       LYS 158   4.254 -10.829   4.283
 1122   1HZ   LYS 158          1HZ       LYS 158   5.346 -12.257   5.872
 1123   2HZ   LYS 158          2HZ       LYS 158   5.180 -13.596   4.842
 1124   3HZ   LYS 158          3HZ       LYS 158   3.806 -12.877   5.520
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1 -23.869   0.501  -5.449
    2   2H    MET   1          2HT       MET   1 -23.227  -0.486  -6.669
    3   3H    MET   1          3HT       MET   1 -22.206   0.534  -5.776
    4    HA   MET   1           HA       MET   1 -23.719  -1.787  -4.745
    5   1HB   MET   1          2HB       MET   1 -21.552  -2.842  -4.426
    6   2HB   MET   1          1HB       MET   1 -21.758  -2.397  -6.113
    7   1HG   MET   1          2HG       MET   1 -20.358  -0.416  -5.747
    8   2HG   MET   1          1HG       MET   1 -20.131  -0.902  -4.068
    9   1HE   MET   1          1HE       MET   1 -18.509  -3.218  -7.717
   10   2HE   MET   1          2HE       MET   1 -19.376  -1.685  -7.813
   11   3HE   MET   1          3HE       MET   1 -20.229  -3.151  -7.331
   12    H    GLU   2           H        GLU   2 -23.673  -2.115  -2.566
   13    HA   GLU   2           HA       GLU   2 -22.409  -0.011  -0.936
   14   1HB   GLU   2          2HB       GLU   2 -24.274  -0.303   0.680
   15   2HB   GLU   2          1HB       GLU   2 -24.798   0.327  -0.876
   16   1HG   GLU   2          2HG       GLU   2 -25.480  -1.989  -1.500
   17   2HG   GLU   2          1HG       GLU   2 -25.108  -2.484   0.150
   18    H    GLN   3           H        GLN   3 -23.063  -3.354  -1.465
   19    HA   GLN   3           HA       GLN   3 -21.536  -4.119   0.919
   20   1HB   GLN   3          2HB       GLN   3 -23.027  -5.799  -1.113
   21   2HB   GLN   3          1HB       GLN   3 -22.173  -6.433   0.287
   22   1HG   GLN   3          2HG       GLN   3 -23.699  -5.244   1.768
   23   2HG   GLN   3          1HG       GLN   3 -24.538  -4.572   0.372
   24   1HE2  GLN   3          1HE2      GLN   3 -25.876  -5.891  -0.850
   25   2HE2  GLN   3          2HE2      GLN   3 -26.414  -7.435  -0.290
   26    H    SER   4           H        SER   4 -19.710  -5.573   0.654
   27    HA   SER   4           HA       SER   4 -17.925  -4.668  -1.329
   28   1HB   SER   4          2HB       SER   4 -17.449  -7.241   0.129
   29   2HB   SER   4          1HB       SER   4 -16.320  -5.928  -0.227
   30    HG   SER   4           HG       SER   4 -16.710  -5.522   1.824
   31    H    ALA   5           H        ALA   5 -18.587  -5.071  -3.401
   32    HA   ALA   5           HA       ALA   5 -19.415  -7.721  -4.220
   33   1HB   ALA   5          1HB       ALA   5 -18.895  -5.244  -5.863
   34   2HB   ALA   5          2HB       ALA   5 -20.458  -5.752  -5.223
   35   3HB   ALA   5          3HB       ALA   5 -19.644  -6.731  -6.442
   36    H    SER   6           H        SER   6 -18.311  -8.999  -5.749
   37    HA   SER   6           HA       SER   6 -16.510 -10.224  -6.338
   38   1HB   SER   6          2HB       SER   6 -14.684  -8.922  -7.532
   39   2HB   SER   6          1HB       SER   6 -16.317  -8.741  -8.169
   40    HG   SER   6           HG       SER   6 -15.695  -6.882  -6.250
   41    H    ASP   7           H        ASP   7 -16.625  -9.446  -3.602
   42    HA   ASP   7           HA       ASP   7 -14.161  -8.577  -2.565
   43   1HB   ASP   7          2HB       ASP   7 -14.960  -9.350  -0.425
   44   2HB   ASP   7          1HB       ASP   7 -16.323  -8.653  -1.297
   45    H    SER   8           H        SER   8 -15.314 -11.722  -3.570
   46    HA   SER   8           HA       SER   8 -12.812 -12.936  -2.628
   47   1HB   SER   8          2HB       SER   8 -15.324 -14.281  -3.658
   48   2HB   SER   8          1HB       SER   8 -13.929 -15.087  -2.937
   49    HG   SER   8           HG       SER   8 -15.208 -13.064  -1.466
   50    H    ASN   9           H        ASN   9 -14.176 -11.568  -5.333
   51    HA   ASN   9           HA       ASN   9 -13.000 -13.375  -7.274
   52   1HB   ASN   9          2HB       ASN   9 -15.148 -12.423  -7.824
   53   2HB   ASN   9          1HB       ASN   9 -14.536 -10.789  -7.583
   54   1HD2  ASN   9          1HD2      ASN   9 -14.554 -13.571  -9.668
   55   2HD2  ASN   9          2HD2      ASN   9 -13.891 -12.773 -11.066
   56    H    LYS  10           H        LYS  10 -12.682  -9.862  -6.595
   57    HA   LYS  10           HA       LYS  10 -10.349  -9.715  -8.258
   58   1HB   LYS  10          2HB       LYS  10 -11.933  -7.812  -8.003
   59   2HB   LYS  10          1HB       LYS  10 -11.411  -7.634  -6.332
   60   1HG   LYS  10          2HG       LYS  10  -9.184  -7.056  -7.028
   61   2HG   LYS  10          1HG       LYS  10  -9.574  -7.413  -8.709
   62   1HD   LYS  10          2HD       LYS  10 -11.282  -5.577  -8.611
   63   2HD   LYS  10          1HD       LYS  10 -10.655  -5.161  -7.013
   64   1HE   LYS  10          2HE       LYS  10  -8.514  -4.627  -7.906
   65   2HE   LYS  10          1HE       LYS  10  -8.934  -5.297  -9.481
   66   1HZ   LYS  10          1HZ       LYS  10 -10.374  -3.515  -9.926
   67   2HZ   LYS  10          2HZ       LYS  10  -8.991  -2.793  -9.258
   68   3HZ   LYS  10          3HZ       LYS  10 -10.385  -2.993  -8.316
   69    H    SER  11           H        SER  11 -11.010 -10.002  -4.858
   70    HA   SER  11           HA       SER  11  -8.424  -9.423  -3.895
   71   1HB   SER  11          2HB       SER  11 -10.451  -9.496  -2.474
   72   2HB   SER  11          1HB       SER  11 -10.530 -11.241  -2.699
   73    HG   SER  11           HG       SER  11  -8.811 -11.509  -1.427
   74    H    GLN  12           H        GLN  12  -9.904 -12.340  -5.184
   75    HA   GLN  12           HA       GLN  12  -7.999 -14.185  -4.241
   76   1HB   GLN  12          2HB       GLN  12 -10.348 -14.331  -5.715
   77   2HB   GLN  12          1HB       GLN  12  -9.113 -14.904  -6.829
   78   1HG   GLN  12          2HG       GLN  12  -9.789 -16.009  -4.116
   79   2HG   GLN  12          1HG       GLN  12 -10.004 -16.786  -5.682
   80   1HE2  GLN  12          1HE2      GLN  12  -8.201 -17.605  -6.770
   81   2HE2  GLN  12          2HE2      GLN  12  -6.704 -17.909  -5.947
   82    H    ASN  13           H        ASN  13  -8.268 -12.558  -7.421
   83    HA   ASN  13           HA       ASN  13  -5.865 -13.743  -8.378
   84   1HB   ASN  13          2HB       ASN  13  -5.995 -12.158 -10.257
   85   2HB   ASN  13          1HB       ASN  13  -7.528 -12.974  -9.983
   86   1HD2  ASN  13          1HD2      ASN  13  -9.306 -11.794  -9.455
   87   2HD2  ASN  13          2HD2      ASN  13  -9.327 -10.065  -9.427
   88    H    ALA  14           H        ALA  14  -6.584 -10.785  -6.654
   89    HA   ALA  14           HA       ALA  14  -4.097  -9.507  -7.006
   90   1HB   ALA  14          1HB       ALA  14  -5.973  -9.325  -4.651
   91   2HB   ALA  14          2HB       ALA  14  -6.089  -8.370  -6.129
   92   3HB   ALA  14          3HB       ALA  14  -4.699  -8.176  -5.062
   93    H    ILE  15           H        ILE  15  -5.291 -11.541  -4.322
   94    HA   ILE  15           HA       ILE  15  -2.883 -11.601  -2.892
   95    HB   ILE  15           HB       ILE  15  -5.373 -13.219  -2.864
   96   1HG1  ILE  15          2HG1      ILE  15  -5.231 -12.676  -0.436
   97   2HG1  ILE  15          1HG1      ILE  15  -3.704 -11.858  -0.739
   98   1HG2  ILE  15          1HG2      ILE  15  -3.681 -14.979  -2.821
   99   2HG2  ILE  15          2HG2      ILE  15  -4.491 -14.833  -1.261
  100   3HG2  ILE  15          3HG2      ILE  15  -2.869 -14.171  -1.480
  101   1HD1  ILE  15          1HD1      ILE  15  -5.534 -10.282  -0.545
  102   2HD1  ILE  15          2HD1      ILE  15  -6.379 -11.078  -1.872
  103   3HD1  ILE  15          3HD1      ILE  15  -4.848 -10.252  -2.169
  104    H    SER  16           H        SER  16  -4.057 -13.633  -5.520
  105    HA   SER  16           HA       SER  16  -2.070 -15.614  -5.371
  106   1HB   SER  16          2HB       SER  16  -3.578 -14.627  -7.803
  107   2HB   SER  16          1HB       SER  16  -2.691 -16.148  -7.691
  108    HG   SER  16           HG       SER  16  -5.070 -15.371  -6.373
  109    H    GLU  17           H        GLU  17  -2.160 -12.506  -7.054
  110    HA   GLU  17           HA       GLU  17   0.318 -12.875  -8.410
  111   1HB   GLU  17          2HB       GLU  17  -1.313 -11.328  -9.294
  112   2HB   GLU  17          1HB       GLU  17  -1.293 -10.388  -7.807
  113   1HG   GLU  17          2HG       GLU  17   0.978  -9.700  -8.228
  114   2HG   GLU  17          1HG       GLU  17   1.052 -10.717  -9.665
  115    H    VAL  18           H        VAL  18  -0.606 -10.958  -5.541
  116    HA   VAL  18           HA       VAL  18   1.987  -9.945  -5.085
  117    HB   VAL  18           HB       VAL  18   1.192  -9.178  -2.935
  118   1HG1  VAL  18          1HG1      VAL  18  -0.812  -7.927  -3.670
  119   2HG1  VAL  18          2HG1      VAL  18  -0.885  -8.950  -5.106
  120   3HG1  VAL  18          3HG1      VAL  18   0.505  -7.895  -4.845
  121   1HG2  VAL  18          1HG2      VAL  18  -0.995  -9.768  -2.052
  122   2HG2  VAL  18          2HG2      VAL  18   0.005 -11.211  -2.235
  123   3HG2  VAL  18          3HG2      VAL  18  -1.266 -10.863  -3.408
  124    H    MET  19           H        MET  19   0.446 -12.914  -4.143
  125    HA   MET  19           HA       MET  19   2.094 -13.706  -2.023
  126   1HB   MET  19          2HB       MET  19   0.006 -14.850  -2.651
  127   2HB   MET  19          1HB       MET  19   0.757 -15.410  -4.136
  128   1HG   MET  19          2HG       MET  19   2.300 -16.778  -2.884
  129   2HG   MET  19          1HG       MET  19   1.653 -16.158  -1.363
  130   1HE   MET  19          1HE       MET  19   0.396 -19.903  -1.513
  131   2HE   MET  19          2HE       MET  19   1.335 -18.729  -0.594
  132   3HE   MET  19          3HE       MET  19   1.917 -19.289  -2.160
  133    H    SER  20           H        SER  20   2.463 -14.128  -5.523
  134    HA   SER  20           HA       SER  20   4.982 -15.495  -5.235
  135   1HB   SER  20          2HB       SER  20   3.413 -15.925  -7.143
  136   2HB   SER  20          1HB       SER  20   3.766 -14.304  -7.739
  137    HG   SER  20           HG       SER  20   5.123 -15.725  -8.795
  138    H    ALA  21           H        ALA  21   3.858 -12.241  -5.752
  139    HA   ALA  21           HA       ALA  21   6.213 -11.049  -6.684
  140   1HB   ALA  21          1HB       ALA  21   4.025  -9.937  -6.721
  141   2HB   ALA  21          2HB       ALA  21   5.258  -8.940  -5.952
  142   3HB   ALA  21          3HB       ALA  21   4.077  -9.796  -4.963
  143    H    THR  22           H        THR  22   5.021 -11.429  -3.341
  144    HA   THR  22           HA       THR  22   7.222 -10.130  -2.150
  145    HB   THR  22           HB       THR  22   5.074 -10.475  -0.980
  146    HG1  THR  22           1HG      THR  22   6.058 -10.511   0.927
  147   1HG2  THR  22          1HG2      THR  22   4.607 -12.644   0.090
  148   2HG2  THR  22          2HG2      THR  22   5.967 -13.354  -0.779
  149   3HG2  THR  22          3HG2      THR  22   4.567 -12.756  -1.670
  150    H    SER  23           H        SER  23   6.663 -13.514  -3.036
  151    HA   SER  23           HA       SER  23   9.012 -14.525  -1.805
  152   1HB   SER  23          2HB       SER  23   7.492 -15.613  -4.189
  153   2HB   SER  23          1HB       SER  23   8.636 -16.513  -3.190
  154    HG   SER  23           HG       SER  23   7.244 -16.301  -1.444
  155    H    ALA  24           H        ALA  24   8.319 -13.192  -4.990
  156    HA   ALA  24           HA       ALA  24  10.794 -13.839  -6.190
  157   1HB   ALA  24          1HB       ALA  24   8.898 -11.600  -6.889
  158   2HB   ALA  24          2HB       ALA  24   8.793 -13.257  -7.484
  159   3HB   ALA  24          3HB       ALA  24  10.174 -12.249  -7.918
  160    H    ILE  25           H        ILE  25   9.634 -10.831  -4.652
  161    HA   ILE  25           HA       ILE  25  12.007  -9.391  -5.164
  162    HB   ILE  25           HB       ILE  25   9.888  -8.268  -4.635
  163   1HG1  ILE  25          2HG1      ILE  25  12.094  -7.618  -2.669
  164   2HG1  ILE  25          1HG1      ILE  25  12.062  -7.118  -4.355
  165   1HG2  ILE  25          1HG2      ILE  25  10.353  -9.253  -1.824
  166   2HG2  ILE  25          2HG2      ILE  25   9.059  -9.761  -2.907
  167   3HG2  ILE  25          3HG2      ILE  25   9.114  -8.099  -2.317
  168   1HD1  ILE  25          1HD1      ILE  25  10.066  -6.308  -2.254
  169   2HD1  ILE  25          2HD1      ILE  25  10.071  -5.785  -3.938
  170   3HD1  ILE  25          3HD1      ILE  25  11.391  -5.317  -2.863
  171    H    ASN  26           H        ASN  26  11.079 -11.550  -2.570
  172    HA   ASN  26           HA       ASN  26  13.088 -10.950  -0.719
  173   1HB   ASN  26          2HB       ASN  26  11.191 -12.478  -0.265
  174   2HB   ASN  26          1HB       ASN  26  11.902 -13.662  -1.355
  175   1HD2  ASN  26          1HD2      ASN  26  13.661 -14.861  -0.689
  176   2HD2  ASN  26          2HD2      ASN  26  14.216 -14.867   0.950
  177    H    GLY  27           H        GLY  27  13.082 -13.067  -3.545
  178   1HA   GLY  27          2HA       GLY  27  15.771 -13.991  -3.127
  179   2HA   GLY  27          1HA       GLY  27  14.769 -14.285  -4.538
  180    H    LEU  28           H        LEU  28  14.430 -11.178  -4.532
  181    HA   LEU  28           HA       LEU  28  16.490 -10.708  -6.458
  182   1HB   LEU  28          2HB       LEU  28  14.548  -8.791  -5.166
  183   2HB   LEU  28          1HB       LEU  28  15.596  -8.400  -6.517
  184    HG   LEU  28           HG       LEU  28  13.374 -10.443  -6.547
  185   1HD1  LEU  28          1HD1      LEU  28  13.600  -7.715  -7.810
  186   2HD1  LEU  28          2HD1      LEU  28  12.525  -8.175  -6.490
  187   3HD1  LEU  28          3HD1      LEU  28  12.296  -8.867  -8.095
  188   1HD2  LEU  28          1HD2      LEU  28  15.248  -9.515  -8.720
  189   2HD2  LEU  28          2HD2      LEU  28  13.825 -10.530  -8.972
  190   3HD2  LEU  28          3HD2      LEU  28  15.176 -11.126  -8.005
  191    H    TYR  29           H        TYR  29  16.112 -10.124  -3.071
  192    HA   TYR  29           HA       TYR  29  18.489  -8.406  -3.039
  193   1HB   TYR  29          2HB       TYR  29  16.339  -8.897  -0.975
  194   2HB   TYR  29          1HB       TYR  29  17.801  -7.968  -0.648
  195    HD1  TYR  29           1HD      TYR  29  14.828  -8.091  -2.892
  196    HD2  TYR  29           2HD      TYR  29  17.882  -5.681  -1.172
  197    HE1  TYR  29           1HE      TYR  29  13.730  -6.076  -3.773
  198    HE2  TYR  29           2HE      TYR  29  16.794  -3.663  -2.054
  199    HH   TYR  29           HH       TYR  29  15.246  -3.030  -3.830
  200    H    ILE  30           H        ILE  30  17.215 -10.771  -0.705
  201    HA   ILE  30           HA       ILE  30  18.139 -12.530   0.375
  202    HB   ILE  30           HB       ILE  30  20.100 -12.564  -1.923
  203   1HG1  ILE  30          2HG1      ILE  30  17.568 -14.147  -1.419
  204   2HG1  ILE  30          1HG1      ILE  30  17.768 -12.876  -2.623
  205   1HG2  ILE  30          1HG2      ILE  30  21.012 -13.738   0.000
  206   2HG2  ILE  30          2HG2      ILE  30  20.539 -14.892  -1.248
  207   3HG2  ILE  30          3HG2      ILE  30  19.518 -14.658   0.171
  208   1HD1  ILE  30          1HD1      ILE  30  19.213 -15.518  -2.577
  209   2HD1  ILE  30          2HD1      ILE  30  19.431 -14.248  -3.781
  210   3HD1  ILE  30          3HD1      ILE  30  17.880 -15.073  -3.642
  211    H    GLY  31           H        GLY  31  19.155 -12.344   2.254
  212   1HA   GLY  31          2HA       GLY  31  21.134 -12.322   3.543
  213   2HA   GLY  31          1HA       GLY  31  21.946 -11.451   2.252
  214    H    GLN  32           H        GLN  32  19.789  -9.503   1.988
  215    HA   GLN  32           HA       GLN  32  20.667  -7.618   3.927
  216   1HB   GLN  32          2HB       GLN  32  18.521  -7.576   1.820
  217   2HB   GLN  32          1HB       GLN  32  18.699  -6.250   2.954
  218   1HG   GLN  32          2HG       GLN  32  19.806  -5.742   0.873
  219   2HG   GLN  32          1HG       GLN  32  20.988  -5.890   2.173
  220   1HE2  GLN  32          1HE2      GLN  32  19.806  -7.204  -0.792
  221   2HE2  GLN  32          2HE2      GLN  32  21.064  -8.368  -1.026
  222    H    THR  33           H        THR  33  19.945  -7.275   5.906
  223    HA   THR  33           HA       THR  33  18.025  -8.958   7.089
  224    HB   THR  33           HB       THR  33  19.809  -7.990   8.422
  225    HG1  THR  33           1HG      THR  33  17.566  -8.396   9.319
  226   1HG2  THR  33          1HG2      THR  33  18.451  -5.331   7.985
  227   2HG2  THR  33          2HG2      THR  33  20.012  -5.816   7.326
  228   3HG2  THR  33          3HG2      THR  33  19.811  -5.626   9.068
  229    H    SER  34           H        SER  34  17.792  -5.709   5.755
  230    HA   SER  34           HA       SER  34  14.945  -6.041   5.463
  231   1HB   SER  34          2HB       SER  34  16.041  -3.811   7.198
  232   2HB   SER  34          1HB       SER  34  14.383  -3.888   6.600
  233    HG   SER  34           HG       SER  34  15.410  -6.095   7.983
  234    H    TYR  35           H        TYR  35  16.558  -6.012   3.415
  235    HA   TYR  35           HA       TYR  35  17.098  -5.008   1.436
  236   1HB   TYR  35          2HB       TYR  35  15.040  -2.943   2.230
  237   2HB   TYR  35          1HB       TYR  35  15.605  -3.298   0.602
  238    HD1  TYR  35           1HD      TYR  35  15.102  -5.630  -0.345
  239    HD2  TYR  35           2HD      TYR  35  13.191  -4.063   3.115
  240    HE1  TYR  35           1HE      TYR  35  13.283  -7.262  -0.619
  241    HE2  TYR  35           2HE      TYR  35  11.371  -5.690   2.852
  242    HH   TYR  35           HH       TYR  35  11.562  -8.372   0.890
  243    H    SER  36           H        SER  36  18.592  -4.390   3.748
  244    HA   SER  36           HA       SER  36  19.242  -1.758   4.191
  245   1HB   SER  36          2HB       SER  36  21.401  -3.828   4.085
  246   2HB   SER  36          1HB       SER  36  21.098  -2.583   5.301
  247    HG   SER  36           HG       SER  36  20.560  -4.896   5.810
  248    H    GLY  37           H        GLY  37  20.228  -0.229   3.070
  249   1HA   GLY  37          2HA       GLY  37  22.175   0.290   1.600
  250   2HA   GLY  37          1HA       GLY  37  21.600  -1.018   0.569
  251    H    LEU  38           H        LEU  38  18.881  -0.572   0.616
  252    HA   LEU  38           HA       LEU  38  18.754   1.841  -1.034
  253   1HB   LEU  38          2HB       LEU  38  16.692  -0.325  -0.594
  254   2HB   LEU  38          1HB       LEU  38  16.540   1.008  -1.718
  255    HG   LEU  38           HG       LEU  38  18.759   0.040  -2.698
  256   1HD1  LEU  38          1HD1      LEU  38  19.169  -1.656  -1.060
  257   2HD1  LEU  38          2HD1      LEU  38  18.794  -2.427  -2.601
  258   3HD1  LEU  38          3HD1      LEU  38  17.573  -2.357  -1.328
  259   1HD2  LEU  38          1HD2      LEU  38  16.065  -1.225  -3.161
  260   2HD2  LEU  38          2HD2      LEU  38  17.441  -1.313  -4.261
  261   3HD2  LEU  38          3HD2      LEU  38  16.677   0.242  -3.925
  262    H    ASP  39           H        ASP  39  17.961   0.717   2.040
  263    HA   ASP  39           HA       ASP  39  15.675   2.150   2.721
  264   1HB   ASP  39          2HB       ASP  39  16.403   1.926   5.049
  265   2HB   ASP  39          1HB       ASP  39  16.630   0.414   4.173
  266    H    SER  40           H        SER  40  19.062   3.079   3.124
  267    HA   SER  40           HA       SER  40  18.474   5.556   4.330
  268   1HB   SER  40          2HB       SER  40  21.024   4.677   2.963
  269   2HB   SER  40          1HB       SER  40  20.861   5.988   4.131
  270    HG   SER  40           HG       SER  40  19.855   3.588   5.040
  271    H    THR  41           H        THR  41  19.271   4.648   0.987
  272    HA   THR  41           HA       THR  41  19.707   7.307   0.127
  273    HB   THR  41           HB       THR  41  19.441   6.287  -2.193
  274    HG1  THR  41           1HG      THR  41  18.861   4.240  -2.335
  275   1HG2  THR  41          1HG2      THR  41  21.560   5.064  -2.041
  276   2HG2  THR  41          2HG2      THR  41  21.410   5.017  -0.285
  277   3HG2  THR  41          3HG2      THR  41  21.620   6.562  -1.110
  278    H    ILE  42           H        ILE  42  16.857   5.181  -0.090
  279    HA   ILE  42           HA       ILE  42  15.304   7.035  -1.604
  280    HB   ILE  42           HB       ILE  42  14.369   4.731   0.123
  281   1HG1  ILE  42          2HG1      ILE  42  15.913   3.996  -1.623
  282   2HG1  ILE  42          1HG1      ILE  42  14.277   3.470  -1.999
  283   1HG2  ILE  42          1HG2      ILE  42  12.933   6.207  -2.083
  284   2HG2  ILE  42          2HG2      ILE  42  12.567   6.310  -0.360
  285   3HG2  ILE  42          3HG2      ILE  42  12.330   4.790  -1.223
  286   1HD1  ILE  42          1HD1      ILE  42  14.063   5.312  -3.594
  287   2HD1  ILE  42          2HD1      ILE  42  15.424   4.260  -3.982
  288   3HD1  ILE  42          3HD1      ILE  42  15.709   5.821  -3.216
  289    H    LEU  43           H        LEU  43  15.972   6.630   1.767
  290    HA   LEU  43           HA       LEU  43  13.792   8.277   2.677
  291   1HB   LEU  43          2HB       LEU  43  14.843   6.449   4.016
  292   2HB   LEU  43          1HB       LEU  43  16.294   7.432   4.135
  293    HG   LEU  43           HG       LEU  43  14.933   9.175   5.308
  294   1HD1  LEU  43          1HD1      LEU  43  12.845   7.001   5.310
  295   2HD1  LEU  43          2HD1      LEU  43  12.738   8.550   4.471
  296   3HD1  LEU  43          3HD1      LEU  43  12.768   8.500   6.234
  297   1HD2  LEU  43          1HD2      LEU  43  14.864   7.983   7.433
  298   2HD2  LEU  43          2HD2      LEU  43  16.329   7.589   6.533
  299   3HD2  LEU  43          3HD2      LEU  43  14.987   6.444   6.581
  300    H    LEU  44           H        LEU  44  17.332   8.638   2.491
  301    HA   LEU  44           HA       LEU  44  17.400  11.375   3.224
  302   1HB   LEU  44          2HB       LEU  44  19.403   9.919   1.500
  303   2HB   LEU  44          1HB       LEU  44  19.683  11.370   2.439
  304    HG   LEU  44           HG       LEU  44  19.155   8.613   3.533
  305   1HD1  LEU  44          1HD1      LEU  44  21.369   8.831   2.601
  306   2HD1  LEU  44          2HD1      LEU  44  21.464   8.801   4.363
  307   3HD1  LEU  44          3HD1      LEU  44  21.631  10.329   3.497
  308   1HD2  LEU  44          1HD2      LEU  44  18.175  10.326   4.967
  309   2HD2  LEU  44          2HD2      LEU  44  19.703  11.208   4.978
  310   3HD2  LEU  44          3HD2      LEU  44  19.599   9.614   5.727
  311    H    ASN  45           H        ASN  45  16.378   9.831   0.445
  312    HA   ASN  45           HA       ASN  45  17.028  11.286  -1.754
  313   1HB   ASN  45          2HB       ASN  45  15.438   9.297  -1.514
  314   2HB   ASN  45          1HB       ASN  45  14.191  10.476  -1.113
  315   1HD2  ASN  45          1HD2      ASN  45  14.339   8.602  -3.308
  316   2HD2  ASN  45          2HD2      ASN  45  14.232   9.530  -4.765
  317    H    THR  46           H        THR  46  14.198  11.958   0.286
  318    HA   THR  46           HA       THR  46  14.359  14.772  -0.537
  319    HB   THR  46           HB       THR  46  11.821  13.140  -0.320
  320    HG1  THR  46           1HG      THR  46  13.441  13.940  -2.507
  321   1HG2  THR  46          1HG2      THR  46  12.284  15.984  -1.246
  322   2HG2  THR  46          2HG2      THR  46  11.467  15.493   0.237
  323   3HG2  THR  46          3HG2      THR  46  10.751  15.117  -1.329
  324    H    SER  47           H        SER  47  15.182  15.474   1.440
  325    HA   SER  47           HA       SER  47  14.934  16.498   3.463
  326   1HB   SER  47          2HB       SER  47  12.047  15.879   2.851
  327   2HB   SER  47          1HB       SER  47  12.555  16.866   4.228
  328    HG   SER  47           HG       SER  47  13.740  18.124   2.522
  329    H    ALA  48           H        ALA  48  14.997  13.384   3.232
  330    HA   ALA  48           HA       ALA  48  14.979  11.568   4.597
  331   1HB   ALA  48          1HB       ALA  48  15.153  11.862   7.002
  332   2HB   ALA  48          2HB       ALA  48  14.669  13.551   6.849
  333   3HB   ALA  48          3HB       ALA  48  16.203  13.008   6.167
  334    H    ILE  49           H        ILE  49  12.433  13.384   3.937
  335    HA   ILE  49           HA       ILE  49  10.553  11.402   4.990
  336    HB   ILE  49           HB       ILE  49   9.879  14.346   4.912
  337   1HG1  ILE  49          2HG1      ILE  49  10.542  12.666   7.345
  338   2HG1  ILE  49          1HG1      ILE  49  11.585  13.909   6.663
  339   1HG2  ILE  49          1HG2      ILE  49   7.917  13.640   6.220
  340   2HG2  ILE  49          2HG2      ILE  49   8.453  11.964   6.089
  341   3HG2  ILE  49          3HG2      ILE  49   7.987  12.859   4.643
  342   1HD1  ILE  49          1HD1      ILE  49   8.837  14.387   7.794
  343   2HD1  ILE  49          2HD1      ILE  49   9.961  15.610   7.202
  344   3HD1  ILE  49          3HD1      ILE  49  10.357  14.671   8.640
  345    HA   PRO  50           HA       PRO  50  10.632  11.839   0.418
  346   1HB   PRO  50          2HB       PRO  50   9.177   9.261   0.749
  347   2HB   PRO  50          1HB       PRO  50  10.523   9.674  -0.319
  348   1HG   PRO  50          2HG       PRO  50  10.952   8.217   1.849
  349   2HG   PRO  50          1HG       PRO  50  12.105   9.475   1.364
  350   1HD   PRO  50          2HD       PRO  50  10.036   9.529   3.523
  351   2HD   PRO  50          1HD       PRO  50  11.689  10.180   3.527
  352    H    ASP  51           H        ASP  51   9.254  13.249  -0.319
  353    HA   ASP  51           HA       ASP  51   6.578  13.566   0.576
  354   1HB   ASP  51          2HB       ASP  51   8.028  15.427  -0.177
  355   2HB   ASP  51          1HB       ASP  51   7.995  14.785  -1.811
  356    H    ASN  52           H        ASN  52   7.901  11.421  -1.569
  357    HA   ASN  52           HA       ASN  52   6.170  11.530  -3.797
  358   1HB   ASN  52          2HB       ASN  52   7.826   9.210  -2.772
  359   2HB   ASN  52          1HB       ASN  52   7.129   9.346  -4.382
  360   1HD2  ASN  52          1HD2      ASN  52   9.926   9.110  -3.451
  361   2HD2  ASN  52          2HD2      ASN  52  10.758  10.454  -4.162
  362    H    TYR  53           H        TYR  53   5.903  10.064  -0.687
  363    HA   TYR  53           HA       TYR  53   4.297   7.847  -1.072
  364   1HB   TYR  53          2HB       TYR  53   4.214   9.838   1.199
  365   2HB   TYR  53          1HB       TYR  53   3.557   8.208   1.241
  366    HD1  TYR  53           1HD      TYR  53   5.908   7.019  -0.412
  367    HD2  TYR  53           2HD      TYR  53   5.713   9.477   3.053
  368    HE1  TYR  53           1HE      TYR  53   8.080   6.144   0.318
  369    HE2  TYR  53           2HE      TYR  53   7.885   8.604   3.800
  370    HH   TYR  53           HH       TYR  53   9.307   6.678   3.466
  371    H    LYS  54           H        LYS  54   3.335  11.232  -0.859
  372    HA   LYS  54           HA       LYS  54   0.547  10.414  -1.287
  373   1HB   LYS  54          2HB       LYS  54  -0.018  12.727  -0.576
  374   2HB   LYS  54          1HB       LYS  54   0.869  11.838   0.658
  375   1HG   LYS  54          2HG       LYS  54   2.863  13.027   0.213
  376   2HG   LYS  54          1HG       LYS  54   2.199  13.729  -1.263
  377   1HD   LYS  54          2HD       LYS  54   0.619  15.030   0.031
  378   2HD   LYS  54          1HD       LYS  54   1.177  14.269   1.524
  379   1HE   LYS  54          2HE       LYS  54   2.159  16.490   1.234
  380   2HE   LYS  54          1HE       LYS  54   3.391  15.231   1.207
  381   1HZ   LYS  54          1HZ       LYS  54   3.096  15.364  -1.331
  382   2HZ   LYS  54          2HZ       LYS  54   3.976  16.580  -0.553
  383   3HZ   LYS  54          3HZ       LYS  54   2.374  16.869  -1.031
  384    H    ASP  55           H        ASP  55  -0.593  11.162  -3.050
  385    HA   ASP  55           HA       ASP  55   0.782  13.001  -4.886
  386   1HB   ASP  55          2HB       ASP  55   0.172  10.892  -5.969
  387   2HB   ASP  55          1HB       ASP  55  -1.495  11.082  -5.435
  388    H    THR  56           H        THR  56  -0.271  14.923  -5.435
  389    HA   THR  56           HA       THR  56  -2.533  15.534  -3.675
  390    HB   THR  56           HB       THR  56  -1.674  17.978  -4.523
  391    HG1  THR  56           1HG      THR  56   0.151  16.973  -5.577
  392   1HG2  THR  56          1HG2      THR  56  -0.613  18.154  -2.320
  393   2HG2  THR  56          2HG2      THR  56  -0.640  16.397  -2.168
  394   3HG2  THR  56          3HG2      THR  56  -2.155  17.300  -2.218
  395    H    THR  57           H        THR  57  -2.204  14.499  -6.634
  396    HA   THR  57           HA       THR  57  -4.120  16.356  -7.847
  397    HB   THR  57           HB       THR  57  -2.948  13.872  -9.106
  398    HG1  THR  57           1HG      THR  57  -1.244  15.052  -9.764
  399   1HG2  THR  57          1HG2      THR  57  -3.501  15.003 -11.202
  400   2HG2  THR  57          2HG2      THR  57  -4.137  16.379 -10.302
  401   3HG2  THR  57          3HG2      THR  57  -4.938  14.811 -10.197
  402    H    ASN  58           H        ASN  58  -3.749  12.845  -7.327
  403    HA   ASN  58           HA       ASN  58  -5.857  12.239  -5.801
  404   1HB   ASN  58          2HB       ASN  58  -7.744  11.575  -7.195
  405   2HB   ASN  58          1HB       ASN  58  -7.440  13.297  -7.353
  406   1HD2  ASN  58          1HD2      ASN  58  -8.796  11.297  -9.076
  407   2HD2  ASN  58          2HD2      ASN  58  -8.043  11.458 -10.630
  408    H    LYS  59           H        LYS  59  -3.291  11.211  -7.352
  409    HA   LYS  59           HA       LYS  59  -4.219   8.470  -7.325
  410   1HB   LYS  59          2HB       LYS  59  -3.771   7.884  -9.530
  411   2HB   LYS  59          1HB       LYS  59  -4.585   9.427  -9.655
  412   1HG   LYS  59          2HG       LYS  59  -1.638   8.916  -9.984
  413   2HG   LYS  59          1HG       LYS  59  -2.800   9.268 -11.258
  414   1HD   LYS  59          2HD       LYS  59  -2.139  11.157  -9.008
  415   2HD   LYS  59          1HD       LYS  59  -1.350  11.191 -10.584
  416   1HE   LYS  59          2HE       LYS  59  -4.294  11.545 -10.071
  417   2HE   LYS  59          1HE       LYS  59  -3.147  12.836 -10.416
  418   1HZ   LYS  59          1HZ       LYS  59  -4.263  12.321 -12.422
  419   2HZ   LYS  59          2HZ       LYS  59  -4.008  10.661 -12.234
  420   3HZ   LYS  59          3HZ       LYS  59  -2.696  11.682 -12.570
  421    H    LYS  60           H        LYS  60  -2.891   8.244  -5.523
  422    HA   LYS  60           HA       LYS  60  -0.378   7.122  -6.438
  423   1HB   LYS  60          2HB       LYS  60   0.170   9.417  -5.555
  424   2HB   LYS  60          1HB       LYS  60  -0.400   8.874  -3.981
  425   1HG   LYS  60          2HG       LYS  60   1.999   8.708  -4.050
  426   2HG   LYS  60          1HG       LYS  60   1.318   7.080  -4.020
  427   1HD   LYS  60          2HD       LYS  60   2.905   6.868  -5.658
  428   2HD   LYS  60          1HD       LYS  60   1.480   7.276  -6.613
  429   1HE   LYS  60          2HE       LYS  60   3.535   9.283  -5.694
  430   2HE   LYS  60          1HE       LYS  60   3.543   8.520  -7.281
  431   1HZ   LYS  60          1HZ       LYS  60   1.359  10.224  -6.209
  432   2HZ   LYS  60          2HZ       LYS  60   1.407   9.530  -7.748
  433   3HZ   LYS  60          3HZ       LYS  60   2.530  10.723  -7.325
  434    H    ILE  61           H        ILE  61  -0.352   5.103  -5.777
  435    HA   ILE  61           HA       ILE  61  -1.100   4.566  -2.991
  436    HB   ILE  61           HB       ILE  61  -1.852   2.285  -3.633
  437   1HG1  ILE  61          2HG1      ILE  61  -1.651   3.395  -6.433
  438   2HG1  ILE  61          1HG1      ILE  61  -0.786   2.017  -5.757
  439   1HG2  ILE  61          1HG2      ILE  61  -3.466   4.033  -3.178
  440   2HG2  ILE  61          2HG2      ILE  61  -4.057   2.939  -4.428
  441   3HG2  ILE  61          3HG2      ILE  61  -3.428   4.526  -4.870
  442   1HD1  ILE  61          1HD1      ILE  61  -3.752   2.160  -6.219
  443   2HD1  ILE  61          2HD1      ILE  61  -2.870   0.785  -5.556
  444   3HD1  ILE  61          3HD1      ILE  61  -2.586   1.296  -7.220
  445    H    THR  62           H        THR  62   0.187   3.038  -1.956
  446    HA   THR  62           HA       THR  62   2.694   2.506  -3.379
  447    HB   THR  62           HB       THR  62   2.078   3.065  -0.508
  448    HG1  THR  62           1HG      THR  62   2.905   4.859  -1.250
  449   1HG2  THR  62          1HG2      THR  62   3.398   1.006  -0.455
  450   2HG2  THR  62          2HG2      THR  62   4.329   2.388   0.128
  451   3HG2  THR  62          3HG2      THR  62   4.609   1.758  -1.497
  452    H    ASN  63           H        ASN  63   3.502   0.516  -3.538
  453    HA   ASN  63           HA       ASN  63   3.609  -1.732  -3.686
  454   1HB   ASN  63          2HB       ASN  63   1.808  -1.503  -1.338
  455   2HB   ASN  63          1HB       ASN  63   1.974  -3.071  -2.135
  456   1HD2  ASN  63          1HD2      ASN  63   2.926  -2.011   0.508
  457   2HD2  ASN  63          2HD2      ASN  63   4.621  -2.385   0.532
  458    HA   PRO  64           HA       PRO  64  -0.446  -1.790  -6.114
  459   1HB   PRO  64          2HB       PRO  64   0.458  -0.232  -8.306
  460   2HB   PRO  64          1HB       PRO  64  -0.798   0.187  -7.136
  461   1HG   PRO  64          2HG       PRO  64   1.675   1.437  -7.416
  462   2HG   PRO  64          1HG       PRO  64   0.588   1.590  -6.033
  463   1HD   PRO  64          2HD       PRO  64   3.046  -0.039  -6.330
  464   2HD   PRO  64          1HD       PRO  64   2.348   0.724  -4.881
  465    H    PHE  65           H        PHE  65   2.780  -1.506  -7.576
  466    HA   PHE  65           HA       PHE  65   3.937  -2.759  -9.045
  467   1HB   PHE  65          2HB       PHE  65   2.143  -4.852  -7.854
  468   2HB   PHE  65          1HB       PHE  65   3.282  -5.255  -9.135
  469    HD1  PHE  65           1HD      PHE  65   3.136  -3.607  -5.802
  470    HD2  PHE  65           2HD      PHE  65   5.446  -5.860  -8.579
  471    HE1  PHE  65           1HE      PHE  65   4.919  -3.837  -4.124
  472    HE2  PHE  65           2HE      PHE  65   7.232  -6.096  -6.903
  473    HZ   PHE  65           HZ       PHE  65   6.994  -5.090  -4.701
  474    H    GLY  66           H        GLY  66   3.335  -1.653 -10.899
  475   1HA   GLY  66          2HA       GLY  66   2.933  -2.942 -13.123
  476   2HA   GLY  66          1HA       GLY  66   1.276  -2.944 -12.549
  477    H    GLY  67           H        GLY  67   3.855  -0.447 -12.703
  478   1HA   GLY  67          2HA       GLY  67   2.632   1.040 -14.749
  479   2HA   GLY  67          1HA       GLY  67   2.086   1.671 -13.201
  480    H    GLU  68           H        GLU  68   3.199   3.417 -12.656
  481    HA   GLU  68           HA       GLU  68   6.070   3.519 -13.280
  482   1HB   GLU  68          2HB       GLU  68   4.618   5.395 -14.006
  483   2HB   GLU  68          1HB       GLU  68   4.184   5.671 -12.329
  484   1HG   GLU  68          2HG       GLU  68   5.856   7.264 -13.027
  485   2HG   GLU  68          1HG       GLU  68   6.527   6.177 -11.811
  486    H    LEU  69           H        LEU  69   7.118   2.478 -11.667
  487    HA   LEU  69           HA       LEU  69   6.099   2.754  -8.946
  488   1HB   LEU  69          2HB       LEU  69   7.361   0.748  -8.421
  489   2HB   LEU  69          1HB       LEU  69   6.277   0.498  -9.770
  490    HG   LEU  69           HG       LEU  69   8.395   0.953 -11.230
  491   1HD1  LEU  69          1HD1      LEU  69   9.882   1.647  -9.445
  492   2HD1  LEU  69          2HD1      LEU  69  10.469   0.162 -10.195
  493   3HD1  LEU  69          3HD1      LEU  69   9.657   0.098  -8.630
  494   1HD2  LEU  69          1HD2      LEU  69   8.946  -1.436 -11.161
  495   2HD2  LEU  69          2HD2      LEU  69   7.207  -1.149 -11.182
  496   3HD2  LEU  69          3HD2      LEU  69   8.005  -1.597  -9.676
  497    H    ASN  70           H        ASN  70   7.201   3.451  -7.266
  498    HA   ASN  70           HA       ASN  70  10.058   4.106  -7.569
  499   1HB   ASN  70          2HB       ASN  70   9.023   6.184  -7.176
  500   2HB   ASN  70          1HB       ASN  70   7.831   5.488  -6.084
  501   1HD2  ASN  70          1HD2      ASN  70   8.193   6.830  -4.408
  502   2HD2  ASN  70          2HD2      ASN  70   9.627   6.803  -3.466
  503    H    VAL  71           H        VAL  71  11.367   2.883  -6.281
  504    HA   VAL  71           HA       VAL  71  10.008   0.980  -4.526
  505    HB   VAL  71           HB       VAL  71  12.190  -0.257  -4.557
  506   1HG1  VAL  71          1HG1      VAL  71  10.342  -0.874  -6.018
  507   2HG1  VAL  71          2HG1      VAL  71  11.891  -1.124  -6.821
  508   3HG1  VAL  71          3HG1      VAL  71  10.905   0.278  -7.229
  509   1HG2  VAL  71          1HG2      VAL  71  12.897   1.785  -6.664
  510   2HG2  VAL  71          2HG2      VAL  71  13.811   0.318  -6.314
  511   3HG2  VAL  71          3HG2      VAL  71  13.681   1.588  -5.097
  512    H    GLY  72           H        GLY  72  10.276   0.870  -2.390
  513   1HA   GLY  72          2HA       GLY  72  12.614   2.096  -1.143
  514   2HA   GLY  72          1HA       GLY  72  11.042   2.729  -0.676
  515    HA   PRO  73           HA       PRO  73  11.846  -1.357   1.598
  516   1HB   PRO  73          2HB       PRO  73  14.126  -0.600   3.147
  517   2HB   PRO  73          1HB       PRO  73  14.022  -1.862   1.920
  518   1HG   PRO  73          2HG       PRO  73  15.517   0.435   1.663
  519   2HG   PRO  73          1HG       PRO  73  14.920  -0.533   0.304
  520   1HD   PRO  73          2HD       PRO  73  13.787   1.980   1.483
  521   2HD   PRO  73          1HD       PRO  73  13.959   1.511  -0.226
  522    H    ALA  74           H        ALA  74  10.975  -1.681   3.603
  523    HA   ALA  74           HA       ALA  74  10.272   0.715   5.115
  524   1HB   ALA  74          1HB       ALA  74   9.299  -2.128   5.376
  525   2HB   ALA  74          2HB       ALA  74   8.474  -0.813   4.541
  526   3HB   ALA  74          3HB       ALA  74   8.690  -0.747   6.290
  527    H    ASN  75           H        ASN  75   9.976  -0.036   7.609
  528    HA   ASN  75           HA       ASN  75  12.426   0.182   8.813
  529   1HB   ASN  75          2HB       ASN  75  10.295   0.597   9.961
  530   2HB   ASN  75          1HB       ASN  75   9.953  -1.129   9.962
  531   1HD2  ASN  75          1HD2      ASN  75   9.880  -1.351  12.168
  532   2HD2  ASN  75          2HD2      ASN  75  11.266  -1.171  13.189
  533    H    ASN  76           H        ASN  76  10.528  -2.848   8.717
  534    HA   ASN  76           HA       ASN  76  13.061  -4.313   8.796
  535   1HB   ASN  76          2HB       ASN  76  12.203  -4.196  11.106
  536   2HB   ASN  76          1HB       ASN  76  10.689  -4.923  10.575
  537   1HD2  ASN  76          1HD2      ASN  76  14.068  -5.469  11.219
  538   2HD2  ASN  76          2HD2      ASN  76  13.992  -7.200  11.182
  539    H    ASN  77           H        ASN  77  13.104  -6.226   7.750
  540    HA   ASN  77           HA       ASN  77  11.448  -6.514   5.518
  541   1HB   ASN  77          2HB       ASN  77  13.820  -7.326   5.776
  542   2HB   ASN  77          1HB       ASN  77  13.190  -8.668   6.725
  543   1HD2  ASN  77          1HD2      ASN  77  11.967 -10.276   5.687
  544   2HD2  ASN  77          2HD2      ASN  77  11.996 -10.465   3.969
  545    H    THR  78           H        THR  78  11.463  -8.355   8.582
  546    HA   THR  78           HA       THR  78   9.418 -10.141   7.629
  547    HB   THR  78           HB       THR  78   9.399 -11.078   9.908
  548    HG1  THR  78           1HG      THR  78  11.207  -8.933  10.434
  549   1HG2  THR  78          1HG2      THR  78  11.034 -11.916   8.313
  550   2HG2  THR  78          2HG2      THR  78  11.724 -11.890   9.936
  551   3HG2  THR  78          3HG2      THR  78  12.162 -10.641   8.771
  552    H    ALA  79           H        ALA  79   9.529  -7.282   9.671
  553    HA   ALA  79           HA       ALA  79   6.907  -7.398  10.683
  554   1HB   ALA  79          1HB       ALA  79   7.154  -5.026  11.147
  555   2HB   ALA  79          2HB       ALA  79   8.560  -4.947  10.084
  556   3HB   ALA  79          3HB       ALA  79   8.631  -5.892  11.572
  557    H    PHE  80           H        PHE  80   8.210  -5.611   7.905
  558    HA   PHE  80           HA       PHE  80   5.617  -5.893   6.567
  559   1HB   PHE  80          2HB       PHE  80   7.224  -3.328   6.626
  560   2HB   PHE  80          1HB       PHE  80   5.727  -3.586   5.738
  561    HD1  PHE  80           1HD      PHE  80   7.226  -2.837   8.936
  562    HD2  PHE  80           2HD      PHE  80   3.608  -3.866   6.958
  563    HE1  PHE  80           1HE      PHE  80   5.952  -2.124  10.918
  564    HE2  PHE  80           2HE      PHE  80   2.321  -3.153   8.931
  565    HZ   PHE  80           HZ       PHE  80   3.494  -2.282  10.916
  566    H    GLY  81           H        GLY  81   8.026  -3.877   5.184
  567   1HA   GLY  81          2HA       GLY  81  10.198  -5.239   4.659
  568   2HA   GLY  81          1HA       GLY  81   9.075  -6.113   3.625
  569    H    TYR  82           H        TYR  82   7.874  -4.787   2.057
  570    HA   TYR  82           HA       TYR  82   9.711  -2.766   0.970
  571   1HB   TYR  82          2HB       TYR  82   9.172  -3.670  -1.285
  572   2HB   TYR  82          1HB       TYR  82  10.005  -4.830  -0.257
  573    HD1  TYR  82           1HD      TYR  82   8.789  -6.768   0.669
  574    HD2  TYR  82           2HD      TYR  82   6.906  -4.064  -2.026
  575    HE1  TYR  82           1HE      TYR  82   7.009  -8.412   0.270
  576    HE2  TYR  82           2HE      TYR  82   5.122  -5.706  -2.431
  577    HH   TYR  82           HH       TYR  82   4.741  -8.097  -2.265
  578    H    TYR  83           H        TYR  83   8.827  -1.052  -0.137
  579    HA   TYR  83           HA       TYR  83   5.962  -1.069  -0.606
  580   1HB   TYR  83          2HB       TYR  83   5.589   1.093   0.387
  581   2HB   TYR  83          1HB       TYR  83   6.285   0.033   1.595
  582    HD1  TYR  83           1HD      TYR  83   8.374   0.553   2.626
  583    HD2  TYR  83           2HD      TYR  83   6.950   2.909  -0.612
  584    HE1  TYR  83           1HE      TYR  83  10.076   2.254   3.120
  585    HE2  TYR  83           2HE      TYR  83   8.652   4.610  -0.138
  586    HH   TYR  83           HH       TYR  83  10.031   5.369   1.740
  587    H    LEU  84           H        LEU  84   5.464  -0.269  -2.526
  588    HA   LEU  84           HA       LEU  84   7.526   1.282  -3.935
  589   1HB   LEU  84          2HB       LEU  84   5.611  -0.801  -4.923
  590   2HB   LEU  84          1HB       LEU  84   6.227   0.417  -6.019
  591    HG   LEU  84           HG       LEU  84   8.553  -0.350  -5.404
  592   1HD1  LEU  84          1HD1      LEU  84   8.022  -1.472  -3.312
  593   2HD1  LEU  84          2HD1      LEU  84   8.789  -2.579  -4.449
  594   3HD1  LEU  84          3HD1      LEU  84   7.048  -2.657  -4.182
  595   1HD2  LEU  84          1HD2      LEU  84   7.500  -0.963  -7.496
  596   2HD2  LEU  84          2HD2      LEU  84   6.693  -2.323  -6.717
  597   3HD2  LEU  84          3HD2      LEU  84   8.450  -2.310  -6.868
  598    H    THR  85           H        THR  85   6.946   3.362  -3.968
  599    HA   THR  85           HA       THR  85   4.174   4.112  -3.888
  600    HB   THR  85           HB       THR  85   6.645   5.834  -4.144
  601    HG1  THR  85           1HG      THR  85   5.199   4.822  -1.922
  602   1HG2  THR  85          1HG2      THR  85   5.191   7.627  -3.314
  603   2HG2  THR  85          2HG2      THR  85   3.818   6.521  -3.344
  604   3HG2  THR  85          3HG2      THR  85   4.610   6.985  -4.850
  605    H    LEU  86           H        LEU  86   3.126   3.740  -5.717
  606    HA   LEU  86           HA       LEU  86   4.409   4.418  -8.283
  607   1HB   LEU  86          2HB       LEU  86   4.459   1.985  -7.725
  608   2HB   LEU  86          1HB       LEU  86   2.720   1.990  -7.630
  609    HG   LEU  86           HG       LEU  86   4.255   2.581 -10.161
  610   1HD1  LEU  86          1HD1      LEU  86   4.751   0.329  -9.421
  611   2HD1  LEU  86          2HD1      LEU  86   3.673   0.286 -10.815
  612   3HD1  LEU  86          3HD1      LEU  86   3.033   0.001  -9.197
  613   1HD2  LEU  86          1HD2      LEU  86   1.362   1.864  -9.701
  614   2HD2  LEU  86          2HD2      LEU  86   2.137   2.086 -11.271
  615   3HD2  LEU  86          3HD2      LEU  86   1.978   3.453 -10.166
  616    H    THR  87           H        THR  87   3.200   5.725  -9.528
  617    HA   THR  87           HA       THR  87   0.541   6.407  -8.622
  618    HB   THR  87           HB       THR  87   1.932   8.233  -9.338
  619    HG1  THR  87           1HG      THR  87   0.344   9.219 -10.350
  620   1HG2  THR  87          1HG2      THR  87   3.397   7.053 -10.891
  621   2HG2  THR  87          2HG2      THR  87   2.704   8.483 -11.654
  622   3HG2  THR  87          3HG2      THR  87   2.067   6.885 -12.035
  623    H    ARG  88           H        ARG  88  -1.257   5.625  -9.354
  624    HA   ARG  88           HA       ARG  88  -2.092   5.006 -11.866
  625   1HB   ARG  88          2HB       ARG  88  -0.285   3.262 -11.868
  626   2HB   ARG  88          1HB       ARG  88  -1.089   2.474 -10.519
  627   1HG   ARG  88          2HG       ARG  88  -3.093   2.194 -11.964
  628   2HG   ARG  88          1HG       ARG  88  -2.150   2.836 -13.311
  629   1HD   ARG  88          2HD       ARG  88  -1.897   0.551 -13.572
  630   2HD   ARG  88          1HD       ARG  88  -0.447   1.002 -12.679
  631    HE   ARG  88           HE       ARG  88  -2.823  -0.283 -11.488
  632   1HH1  ARG  88          1HH1      ARG  88   0.593   0.455 -11.420
  633   2HH1  ARG  88          2HH1      ARG  88   0.963  -0.750 -10.232
  634   1HH2  ARG  88          1HH2      ARG  88  -2.365  -1.877  -9.923
  635   2HH2  ARG  88          2HH2      ARG  88  -0.729  -2.098  -9.378
  636    H    LEU  89           H        LEU  89  -3.813   5.999 -10.638
  637    HA   LEU  89           HA       LEU  89  -5.237   4.039  -8.965
  638   1HB   LEU  89          2HB       LEU  89  -4.346   6.702  -8.297
  639   2HB   LEU  89          1HB       LEU  89  -6.082   6.541  -8.102
  640    HG   LEU  89           HG       LEU  89  -3.939   4.915  -6.744
  641   1HD1  LEU  89          1HD1      LEU  89  -4.924   5.864  -4.718
  642   2HD1  LEU  89          2HD1      LEU  89  -6.059   6.783  -5.709
  643   3HD1  LEU  89          3HD1      LEU  89  -4.329   7.122  -5.804
  644   1HD2  LEU  89          1HD2      LEU  89  -6.936   4.570  -6.645
  645   2HD2  LEU  89          2HD2      LEU  89  -5.770   3.742  -5.613
  646   3HD2  LEU  89          3HD2      LEU  89  -5.780   3.440  -7.351
  647    H    ASP  90           H        ASP  90  -7.467   4.298  -8.765
  648    HA   ASP  90           HA       ASP  90  -8.868   5.971 -10.707
  649   1HB   ASP  90          2HB       ASP  90  -9.396   3.001 -10.325
  650   2HB   ASP  90          1HB       ASP  90 -10.393   4.092 -11.274
  651    H    LYS  91           H        LYS  91 -11.099   6.355  -9.992
  652    HA   LYS  91           HA       LYS  91 -11.363   6.459  -7.163
  653   1HB   LYS  91          2HB       LYS  91 -12.523   7.827  -9.150
  654   2HB   LYS  91          1HB       LYS  91 -13.782   6.627  -8.899
  655   1HG   LYS  91          2HG       LYS  91 -12.671   8.237  -6.629
  656   2HG   LYS  91          1HG       LYS  91 -13.975   8.838  -7.651
  657   1HD   LYS  91          2HD       LYS  91 -15.385   6.994  -7.033
  658   2HD   LYS  91          1HD       LYS  91 -14.063   6.223  -6.155
  659   1HE   LYS  91          2HE       LYS  91 -15.738   7.420  -4.724
  660   2HE   LYS  91          1HE       LYS  91 -14.064   7.916  -4.493
  661   1HZ   LYS  91          1HZ       LYS  91 -14.423   9.919  -5.575
  662   2HZ   LYS  91          2HZ       LYS  91 -15.850   9.718  -4.679
  663   3HZ   LYS  91          3HZ       LYS  91 -15.836   9.390  -6.343
  664    H    ALA  92           H        ALA  92 -12.534   4.309  -9.682
  665    HA   ALA  92           HA       ALA  92 -14.106   2.629  -8.038
  666   1HB   ALA  92          1HB       ALA  92 -13.996   1.037  -9.875
  667   2HB   ALA  92          2HB       ALA  92 -12.680   1.952 -10.611
  668   3HB   ALA  92          3HB       ALA  92 -14.289   2.666 -10.486
  669    H    ALA  93           H        ALA  93 -10.698   2.936  -8.515
  670    HA   ALA  93           HA       ALA  93  -9.977   0.326  -7.594
  671   1HB   ALA  93          1HB       ALA  93  -8.304   2.835  -7.719
  672   2HB   ALA  93          2HB       ALA  93  -8.469   1.644  -9.010
  673   3HB   ALA  93          3HB       ALA  93  -7.704   1.194  -7.487
  674    H    CYS  94           H        CYS  94 -10.662   3.404  -6.109
  675    HA   CYS  94           HA       CYS  94  -9.717   2.920  -3.516
  676   1HB   CYS  94          2HB       CYS  94 -10.481   5.116  -4.044
  677   2HB   CYS  94          1HB       CYS  94 -12.057   4.525  -4.558
  678    H    VAL  95           H        VAL  95 -12.881   2.240  -4.984
  679    HA   VAL  95           HA       VAL  95 -13.902   0.885  -2.712
  680    HB   VAL  95           HB       VAL  95 -14.814   0.567  -5.571
  681   1HG1  VAL  95          1HG1      VAL  95 -16.998   0.048  -4.553
  682   2HG1  VAL  95          2HG1      VAL  95 -16.256   0.137  -2.956
  683   3HG1  VAL  95          3HG1      VAL  95 -15.748  -1.110  -4.093
  684   1HG2  VAL  95          1HG2      VAL  95 -14.757   2.929  -4.987
  685   2HG2  VAL  95          2HG2      VAL  95 -15.684   2.604  -3.523
  686   3HG2  VAL  95          3HG2      VAL  95 -16.422   2.360  -5.104
  687    H    SER  96           H        SER  96 -11.971  -0.054  -5.385
  688    HA   SER  96           HA       SER  96 -12.308  -2.845  -5.266
  689   1HB   SER  96          2HB       SER  96 -10.065  -1.081  -6.209
  690   2HB   SER  96          1HB       SER  96 -10.047  -2.835  -6.409
  691    HG   SER  96           HG       SER  96 -12.039  -1.060  -7.406
  692    H    LEU  97           H        LEU  97 -10.201  -0.634  -3.495
  693    HA   LEU  97           HA       LEU  97  -8.575  -2.741  -2.417
  694   1HB   LEU  97          2HB       LEU  97  -8.778   0.188  -1.735
  695   2HB   LEU  97          1HB       LEU  97  -7.609  -0.911  -1.025
  696    HG   LEU  97           HG       LEU  97  -7.794  -0.349  -3.987
  697   1HD1  LEU  97          1HD1      LEU  97  -5.917   0.805  -1.924
  698   2HD1  LEU  97          2HD1      LEU  97  -7.191   1.682  -2.771
  699   3HD1  LEU  97          3HD1      LEU  97  -5.811   1.046  -3.665
  700   1HD2  LEU  97          1HD2      LEU  97  -6.791  -2.493  -3.450
  701   2HD2  LEU  97          2HD2      LEU  97  -5.705  -1.720  -2.296
  702   3HD2  LEU  97          3HD2      LEU  97  -5.557  -1.365  -4.017
  703    H    ALA  98           H        ALA  98 -11.491  -1.149  -1.502
  704    HA   ALA  98           HA       ALA  98 -11.371  -2.166   1.222
  705   1HB   ALA  98          1HB       ALA  98 -13.487  -1.020   1.547
  706   2HB   ALA  98          2HB       ALA  98 -13.556  -0.640  -0.174
  707   3HB   ALA  98          3HB       ALA  98 -12.290   0.061   0.834
  708    H    THR  99           H        THR  99 -12.209  -3.355  -1.755
  709    HA   THR  99           HA       THR  99 -13.972  -5.360  -0.522
  710    HB   THR  99           HB       THR  99 -14.470  -5.991  -2.951
  711    HG1  THR  99           1HG      THR  99 -13.646  -3.351  -3.545
  712   1HG2  THR  99          1HG2      THR  99 -16.126  -4.191  -3.191
  713   2HG2  THR  99          2HG2      THR  99 -15.284  -3.257  -1.952
  714   3HG2  THR  99          3HG2      THR  99 -16.056  -4.787  -1.531
  715    H    LEU 100           H        LEU 100 -10.880  -4.735  -1.517
  716    HA   LEU 100           HA       LEU 100 -10.134  -7.465  -2.143
  717   1HB   LEU 100          2HB       LEU 100  -9.084  -5.148  -2.946
  718   2HB   LEU 100          1HB       LEU 100  -8.162  -5.320  -1.467
  719    HG   LEU 100           HG       LEU 100  -8.207  -7.377  -3.680
  720   1HD1  LEU 100          1HD1      LEU 100  -6.165  -5.249  -3.045
  721   2HD1  LEU 100          2HD1      LEU 100  -7.218  -5.292  -4.458
  722   3HD1  LEU 100          3HD1      LEU 100  -5.980  -6.528  -4.243
  723   1HD2  LEU 100          1HD2      LEU 100  -7.658  -8.257  -1.447
  724   2HD2  LEU 100          2HD2      LEU 100  -6.377  -7.054  -1.300
  725   3HD2  LEU 100          3HD2      LEU 100  -6.275  -8.306  -2.539
  726    H    ASN 101           H        ASN 101  -9.699  -8.912  -0.552
  727    HA   ASN 101           HA       ASN 101  -9.735  -8.025   2.171
  728   1HB   ASN 101          2HB       ASN 101 -10.770 -10.147   1.631
  729   2HB   ASN 101          1HB       ASN 101  -9.242 -10.783   1.028
  730   1HD2  ASN 101          1HD2      ASN 101 -10.941  -9.673   3.891
  731   2HD2  ASN 101          2HD2      ASN 101  -9.982 -10.557   5.032
  732    H    LEU 102           H        LEU 102  -7.983  -6.671   2.313
  733    HA   LEU 102           HA       LEU 102  -5.334  -7.820   2.078
  734   1HB   LEU 102          2HB       LEU 102  -6.291  -5.089   2.937
  735   2HB   LEU 102          1HB       LEU 102  -4.608  -5.574   2.997
  736    HG   LEU 102           HG       LEU 102  -6.316  -5.357   0.520
  737   1HD1  LEU 102          1HD1      LEU 102  -3.948  -3.764   1.475
  738   2HD1  LEU 102          2HD1      LEU 102  -5.620  -3.209   1.401
  739   3HD1  LEU 102          3HD1      LEU 102  -4.747  -3.579  -0.085
  740   1HD2  LEU 102          1HD2      LEU 102  -4.259  -5.891  -0.708
  741   2HD2  LEU 102          2HD2      LEU 102  -4.775  -7.228   0.318
  742   3HD2  LEU 102          3HD2      LEU 102  -3.435  -6.199   0.819
  743    H    GLY 103           H        GLY 103  -6.088  -9.504   3.600
  744   1HA   GLY 103          2HA       GLY 103  -5.298  -8.675   6.319
  745   2HA   GLY 103          1HA       GLY 103  -6.635  -9.791   6.063
  746    H    THR 104           H        THR 104  -5.620 -11.351   4.037
  747    HA   THR 104           HA       THR 104  -3.952 -13.135   5.476
  748    HB   THR 104           HB       THR 104  -3.872 -14.354   3.241
  749    HG1  THR 104           1HG      THR 104  -5.655 -13.448   1.825
  750   1HG2  THR 104          1HG2      THR 104  -6.252 -15.007   3.351
  751   2HG2  THR 104          2HG2      THR 104  -6.568 -13.626   4.400
  752   3HG2  THR 104          3HG2      THR 104  -5.512 -14.926   4.950
  753    H    SER 105           H        SER 105  -3.329 -11.706   2.275
  754    HA   SER 105           HA       SER 105  -0.456 -11.906   2.814
  755   1HB   SER 105          2HB       SER 105  -1.925 -11.349   0.225
  756   2HB   SER 105          1HB       SER 105  -0.192 -11.631   0.391
  757    HG   SER 105           HG       SER 105  -0.734 -13.641   0.096
  758    H    ALA 106           H        ALA 106  -2.029  -9.803   4.057
  759    HA   ALA 106           HA       ALA 106  -0.662  -7.501   2.828
  760   1HB   ALA 106          1HB       ALA 106  -3.096  -7.259   2.746
  761   2HB   ALA 106          2HB       ALA 106  -2.355  -6.054   3.801
  762   3HB   ALA 106          3HB       ALA 106  -3.170  -7.455   4.499
  763    H    LYS 107           H        LYS 107   0.166  -5.912   4.311
  764    HA   LYS 107           HA       LYS 107   0.636  -6.957   7.012
  765   1HB   LYS 107          2HB       LYS 107   2.558  -5.830   5.032
  766   2HB   LYS 107          1HB       LYS 107   2.840  -5.513   6.738
  767   1HG   LYS 107          2HG       LYS 107   3.257  -7.719   7.221
  768   2HG   LYS 107          1HG       LYS 107   2.312  -8.309   5.853
  769   1HD   LYS 107          2HD       LYS 107   4.025  -7.635   4.312
  770   2HD   LYS 107          1HD       LYS 107   4.944  -6.858   5.604
  771   1HE   LYS 107          2HE       LYS 107   5.426  -8.969   6.618
  772   2HE   LYS 107          1HE       LYS 107   4.299  -9.802   5.549
  773   1HZ   LYS 107          1HZ       LYS 107   6.761  -8.415   4.632
  774   2HZ   LYS 107          2HZ       LYS 107   5.727  -9.371   3.683
  775   3HZ   LYS 107          3HZ       LYS 107   6.656 -10.081   4.914
  776    H    GLY 108           H        GLY 108  -0.369  -4.368   5.023
  777   1HA   GLY 108          2HA       GLY 108  -1.495  -2.925   7.151
  778   2HA   GLY 108          1HA       GLY 108   0.016  -2.156   6.697
  779    H    TYR 109           H        TYR 109  -2.348  -0.803   6.458
  780    HA   TYR 109           HA       TYR 109  -2.309  -0.092   3.690
  781   1HB   TYR 109          2HB       TYR 109  -3.672  -2.028   3.404
  782   2HB   TYR 109          1HB       TYR 109  -4.584  -1.694   4.866
  783    HD1  TYR 109           1HD      TYR 109  -4.391   1.340   3.099
  784    HD2  TYR 109           2HD      TYR 109  -6.304  -2.447   3.039
  785    HE1  TYR 109           1HE      TYR 109  -6.245   2.295   1.787
  786    HE2  TYR 109           2HE      TYR 109  -8.151  -1.508   1.718
  787    HH   TYR 109           HH       TYR 109  -9.189   0.631   1.287
  788    H    GLY 110           H        GLY 110  -2.571   2.102   3.734
  789   1HA   GLY 110          2HA       GLY 110  -4.225   3.234   5.896
  790   2HA   GLY 110          1HA       GLY 110  -2.557   3.754   5.717
  791    H    VAL 111           H        VAL 111  -4.973   5.335   5.576
  792    HA   VAL 111           HA       VAL 111  -4.777   6.252   2.781
  793    HB   VAL 111           HB       VAL 111  -7.079   6.731   4.688
  794   1HG1  VAL 111          1HG1      VAL 111  -6.819   7.268   1.733
  795   2HG1  VAL 111          2HG1      VAL 111  -6.795   8.483   3.012
  796   3HG1  VAL 111          3HG1      VAL 111  -8.258   7.543   2.714
  797   1HG2  VAL 111          1HG2      VAL 111  -6.966   4.375   4.090
  798   2HG2  VAL 111          2HG2      VAL 111  -6.874   4.797   2.381
  799   3HG2  VAL 111          3HG2      VAL 111  -8.340   5.147   3.296
  800    H    ASN 112           H        ASN 112  -3.959   8.210   2.455
  801    HA   ASN 112           HA       ASN 112  -3.140  10.293   2.790
  802   1HB   ASN 112          2HB       ASN 112  -5.023  10.194   5.133
  803   2HB   ASN 112          1HB       ASN 112  -3.944  11.557   4.904
  804   1HD2  ASN 112          1HD2      ASN 112  -6.867  10.131   4.022
  805   2HD2  ASN 112          2HD2      ASN 112  -7.292  11.261   2.790
  806    H    ILE 113           H        ILE 113  -2.036   7.762   4.064
  807    HA   ILE 113           HA       ILE 113  -0.528   8.788   6.311
  808    HB   ILE 113           HB       ILE 113  -0.348   6.113   4.913
  809   1HG1  ILE 113          2HG1      ILE 113  -2.533   6.463   5.951
  810   2HG1  ILE 113          1HG1      ILE 113  -1.609   5.265   6.853
  811   1HG2  ILE 113          1HG2      ILE 113   0.855   5.374   6.916
  812   2HG2  ILE 113          2HG2      ILE 113   0.808   7.021   7.547
  813   3HG2  ILE 113          3HG2      ILE 113   1.715   6.664   6.077
  814   1HD1  ILE 113          1HD1      ILE 113  -1.978   8.154   7.614
  815   2HD1  ILE 113          2HD1      ILE 113  -1.045   6.960   8.516
  816   3HD1  ILE 113          3HD1      ILE 113  -2.788   6.767   8.343
  817    H    SER 114           H        SER 114   1.518   9.518   6.251
  818    HA   SER 114           HA       SER 114   3.127   8.981   3.858
  819   1HB   SER 114          2HB       SER 114   2.915  11.676   5.229
  820   2HB   SER 114          1HB       SER 114   3.919  11.294   3.829
  821    HG   SER 114           HG       SER 114   1.519  10.506   3.188
  822    H    GLY 115           H        GLY 115   4.753   7.766   4.553
  823   1HA   GLY 115          2HA       GLY 115   6.952   8.324   5.848
  824   2HA   GLY 115          1HA       GLY 115   5.872   8.270   7.237
  825    H    GLU 116           H        GLU 116   6.100   6.313   4.322
  826    HA   GLU 116           HA       GLU 116   5.208   3.987   5.547
  827   1HB   GLU 116          2HB       GLU 116   6.498   4.632   2.924
  828   2HB   GLU 116          1HB       GLU 116   6.170   2.960   3.359
  829   1HG   GLU 116          2HG       GLU 116   4.420   4.161   1.977
  830   2HG   GLU 116          1HG       GLU 116   3.853   3.317   3.419
  831    H    ASN 117           H        ASN 117   8.469   5.201   5.249
  832    HA   ASN 117           HA       ASN 117   9.828   2.755   5.581
  833   1HB   ASN 117          2HB       ASN 117  10.948   4.845   4.868
  834   2HB   ASN 117          1HB       ASN 117  10.725   5.502   6.484
  835   1HD2  ASN 117          1HD2      ASN 117  12.362   3.052   4.587
  836   2HD2  ASN 117          2HD2      ASN 117  13.626   2.749   5.729
  837    H    ASN 118           H        ASN 118   8.617   5.115   7.936
  838    HA   ASN 118           HA       ASN 118   8.724   2.961   9.942
  839   1HB   ASN 118          2HB       ASN 118   8.813   5.940  10.494
  840   2HB   ASN 118          1HB       ASN 118   8.819   4.665  11.706
  841   1HD2  ASN 118          1HD2      ASN 118  10.667   6.530   9.547
  842   2HD2  ASN 118          2HD2      ASN 118  12.215   5.833   9.901
  843    H    ILE 119           H        ILE 119   6.730   2.492   8.684
  844    HA   ILE 119           HA       ILE 119   4.515   4.115   8.490
  845    HB   ILE 119           HB       ILE 119   4.737   2.014   7.281
  846   1HG1  ILE 119          2HG1      ILE 119   2.415   1.130   7.631
  847   2HG1  ILE 119          1HG1      ILE 119   2.286   2.176   9.043
  848   1HG2  ILE 119          1HG2      ILE 119   5.756   0.649   8.986
  849   2HG2  ILE 119          2HG2      ILE 119   4.297  -0.133   8.376
  850   3HG2  ILE 119          3HG2      ILE 119   4.272   0.685   9.939
  851   1HD1  ILE 119          1HD1      ILE 119   2.747   3.100   6.218
  852   2HD1  ILE 119          2HD1      ILE 119   2.563   4.133   7.636
  853   3HD1  ILE 119          3HD1      ILE 119   1.212   3.143   7.083
  854    H    THR 120           H        THR 120   2.730   4.521   9.683
  855    HA   THR 120           HA       THR 120   3.037   4.458  12.519
  856    HB   THR 120           HB       THR 120   2.005   6.361  11.310
  857    HG1  THR 120           1HG      THR 120   1.511   5.960  13.549
  858   1HG2  THR 120          1HG2      THR 120   0.754   5.136   9.617
  859   2HG2  THR 120          2HG2      THR 120  -0.326   6.185  10.538
  860   3HG2  THR 120          3HG2      THR 120  -0.289   4.450  10.862
  861    H    SER 121           H        SER 121   0.974   3.858  13.841
  862    HA   SER 121           HA       SER 121   0.642   1.045  13.626
  863   1HB   SER 121          2HB       SER 121  -0.863   3.006  15.378
  864   2HB   SER 121          1HB       SER 121  -0.711   1.266  15.634
  865    HG   SER 121           HG       SER 121   1.692   1.828  15.571
  866    H    PHE 122           H        PHE 122  -1.708   0.135  13.883
  867    HA   PHE 122           HA       PHE 122  -3.250   1.281  11.644
  868   1HB   PHE 122          2HB       PHE 122  -2.781  -1.652  12.199
  869   2HB   PHE 122          1HB       PHE 122  -3.697  -0.980  10.856
  870    HD1  PHE 122           1HD      PHE 122  -2.522   0.273   9.072
  871    HD2  PHE 122           2HD      PHE 122  -0.424  -1.820  12.123
  872    HE1  PHE 122           1HE      PHE 122  -0.480   0.333   7.705
  873    HE2  PHE 122           2HE      PHE 122   1.626  -1.760  10.762
  874    HZ   PHE 122           HZ       PHE 122   1.608  -0.676   8.561
  875    H    GLY 123           H        GLY 123  -5.360   1.441  11.856
  876   1HA   GLY 123          2HA       GLY 123  -6.774  -0.232  13.825
  877   2HA   GLY 123          1HA       GLY 123  -7.063   1.508  13.795
  878    H    ASN 124           H        ASN 124  -8.741  -0.977  13.038
  879    HA   ASN 124           HA       ASN 124  -8.907  -0.947  10.197
  880   1HB   ASN 124          2HB       ASN 124 -10.511  -2.332  12.326
  881   2HB   ASN 124          1HB       ASN 124 -10.975  -2.408  10.627
  882   1HD2  ASN 124          1HD2      ASN 124 -10.037  -4.509  12.468
  883   2HD2  ASN 124          2HD2      ASN 124  -8.652  -5.214  11.695
  884    H    SER 125           H        SER 125  -9.147   1.353  10.214
  885    HA   SER 125           HA       SER 125 -11.839   1.973   9.327
  886   1HB   SER 125          2HB       SER 125 -11.838   2.678  11.729
  887   2HB   SER 125          1HB       SER 125 -10.427   3.684  11.417
  888    HG   SER 125           HG       SER 125 -12.949   4.359  11.180
  889    H    ALA 126           H        ALA 126 -11.656   4.286   8.232
  890    HA   ALA 126           HA       ALA 126  -8.947   4.742   7.275
  891   1HB   ALA 126          1HB       ALA 126  -9.507   4.459   4.948
  892   2HB   ALA 126          2HB       ALA 126 -11.161   4.015   5.372
  893   3HB   ALA 126          3HB       ALA 126  -9.819   2.969   5.835
  894    H    ASP 127           H        ASP 127  -8.591   6.812   6.933
  895    HA   ASP 127           HA       ASP 127 -10.310   8.606   5.642
  896   1HB   ASP 127          2HB       ASP 127 -11.622   8.490   7.711
  897   2HB   ASP 127          1HB       ASP 127 -10.198   8.895   8.651
  898    H    GLN 128           H        GLN 128  -8.400   9.294   8.526
  899    HA   GLN 128           HA       GLN 128  -6.190  10.207   6.805
  900   1HB   GLN 128          2HB       GLN 128  -7.173  11.448   9.388
  901   2HB   GLN 128          1HB       GLN 128  -5.710  11.931   8.540
  902   1HG   GLN 128          2HG       GLN 128  -7.029  12.615   6.617
  903   2HG   GLN 128          1HG       GLN 128  -8.501  12.095   7.430
  904   1HE2  GLN 128          1HE2      GLN 128  -9.434  14.113   7.388
  905   2HE2  GLN 128          2HE2      GLN 128  -8.861  15.437   8.352
  906    H    ALA 129           H        ALA 129  -6.731   7.646   8.067
  907    HA   ALA 129           HA       ALA 129  -4.293   7.370   9.644
  908   1HB   ALA 129          1HB       ALA 129  -6.050   7.644  11.306
  909   2HB   ALA 129          2HB       ALA 129  -5.444   5.987  11.321
  910   3HB   ALA 129          3HB       ALA 129  -6.988   6.353  10.552
  911    H    ALA 130           H        ALA 130  -4.013   4.889  10.116
  912    HA   ALA 130           HA       ALA 130  -4.470   3.514   7.552
  913   1HB   ALA 130          1HB       ALA 130  -2.472   2.207   8.064
  914   2HB   ALA 130          2HB       ALA 130  -2.303   3.055   9.601
  915   3HB   ALA 130          3HB       ALA 130  -2.119   3.935   8.084
  916    H    LYS 131           H        LYS 131  -5.011   1.307   7.558
  917    HA   LYS 131           HA       LYS 131  -6.017   0.255  10.110
  918   1HB   LYS 131          2HB       LYS 131  -7.950  -0.568   9.135
  919   2HB   LYS 131          1HB       LYS 131  -7.744   0.940   8.252
  920   1HG   LYS 131          2HG       LYS 131  -6.574  -1.554   7.123
  921   2HG   LYS 131          1HG       LYS 131  -8.318  -1.310   7.027
  922   1HD   LYS 131          2HD       LYS 131  -6.236   0.623   6.020
  923   2HD   LYS 131          1HD       LYS 131  -7.124  -0.527   5.018
  924   1HE   LYS 131          2HE       LYS 131  -9.231   0.570   5.966
  925   2HE   LYS 131          1HE       LYS 131  -8.159   1.863   6.504
  926   1HZ   LYS 131          1HZ       LYS 131  -8.375   0.934   3.693
  927   2HZ   LYS 131          2HZ       LYS 131  -7.520   2.283   4.252
  928   3HZ   LYS 131          3HZ       LYS 131  -9.215   2.261   4.316
  929    H    SER 132           H        SER 132  -6.184  -2.212  10.036
  930    HA   SER 132           HA       SER 132  -3.645  -3.178   8.977
  931   1HB   SER 132          2HB       SER 132  -4.128  -3.600  11.339
  932   2HB   SER 132          1HB       SER 132  -5.601  -4.462  10.899
  933    HG   SER 132           HG       SER 132  -3.043  -5.251   9.963
  934    H    THR 133           H        THR 133  -7.103  -3.744   8.670
  935    HA   THR 133           HA       THR 133  -6.552  -5.555   6.421
  936    HB   THR 133           HB       THR 133  -8.542  -6.926   7.187
  937    HG1  THR 133           1HG      THR 133  -8.548  -5.050   9.110
  938   1HG2  THR 133          1HG2      THR 133  -7.219  -8.245   8.797
  939   2HG2  THR 133          2HG2      THR 133  -6.072  -6.910   8.925
  940   3HG2  THR 133          3HG2      THR 133  -6.263  -7.764   7.394
  941    H    ALA 134           H        ALA 134  -8.230  -5.692   4.840
  942    HA   ALA 134           HA       ALA 134 -10.418  -3.771   5.115
  943   1HB   ALA 134          1HB       ALA 134 -10.043  -2.898   2.877
  944   2HB   ALA 134          2HB       ALA 134  -8.615  -3.921   2.704
  945   3HB   ALA 134          3HB       ALA 134  -8.629  -2.621   3.896
  946    H    ILE 135           H        ILE 135 -12.229  -4.227   3.901
  947    HA   ILE 135           HA       ILE 135 -12.748  -5.908   1.893
  948    HB   ILE 135           HB       ILE 135 -11.646  -7.748   3.166
  949   1HG1  ILE 135          2HG1      ILE 135 -14.608  -8.102   2.638
  950   2HG1  ILE 135          1HG1      ILE 135 -13.317  -8.254   1.449
  951   1HG2  ILE 135          1HG2      ILE 135 -12.298  -7.082   5.418
  952   2HG2  ILE 135          2HG2      ILE 135 -12.795  -8.741   5.086
  953   3HG2  ILE 135          3HG2      ILE 135 -13.983  -7.439   5.047
  954   1HD1  ILE 135          1HD1      ILE 135 -13.714 -10.014   3.855
  955   2HD1  ILE 135          2HD1      ILE 135 -12.439 -10.179   2.646
  956   3HD1  ILE 135          3HD1      ILE 135 -14.125 -10.420   2.186
  957    H    THR 136           H        THR 136 -13.564  -4.654   4.870
  958    HA   THR 136           HA       THR 136 -16.376  -5.205   4.822
  959    HB   THR 136           HB       THR 136 -15.059  -3.104   6.530
  960    HG1  THR 136           1HG      THR 136 -14.772  -5.027   8.004
  961   1HG2  THR 136          1HG2      THR 136 -17.304  -5.062   7.048
  962   2HG2  THR 136          2HG2      THR 136 -17.498  -3.352   6.669
  963   3HG2  THR 136          3HG2      THR 136 -16.720  -3.838   8.174
  964    HA   PRO 137           HA       PRO 137 -17.656  -1.830   2.170
  965   1HB   PRO 137          2HB       PRO 137 -20.124  -1.475   3.422
  966   2HB   PRO 137          1HB       PRO 137 -19.794  -2.564   2.077
  967   1HG   PRO 137          2HG       PRO 137 -19.984  -3.154   4.989
  968   2HG   PRO 137          1HG       PRO 137 -20.495  -4.137   3.607
  969   1HD   PRO 137          2HD       PRO 137 -18.262  -4.699   4.979
  970   2HD   PRO 137          1HD       PRO 137 -18.353  -4.928   3.221
  971    H    ALA 138           H        ALA 138 -18.104  -1.686   5.668
  972    HA   ALA 138           HA       ALA 138 -18.426   1.037   6.047
  973   1HB   ALA 138          1HB       ALA 138 -17.541   0.686   8.297
  974   2HB   ALA 138          2HB       ALA 138 -16.913  -0.887   7.809
  975   3HB   ALA 138          3HB       ALA 138 -18.653  -0.604   7.841
  976    H    GLU 139           H        GLU 139 -15.495  -0.781   5.393
  977    HA   GLU 139           HA       GLU 139 -13.604   1.200   6.016
  978   1HB   GLU 139          2HB       GLU 139 -13.351  -1.340   5.410
  979   2HB   GLU 139          1HB       GLU 139 -13.224  -0.748   3.761
  980   1HG   GLU 139          2HG       GLU 139 -11.485   0.369   5.912
  981   2HG   GLU 139          1HG       GLU 139 -11.081  -1.168   5.141
  982    H    ALA 140           H        ALA 140 -14.959   0.250   2.866
  983    HA   ALA 140           HA       ALA 140 -13.914   2.350   1.342
  984   1HB   ALA 140          1HB       ALA 140 -16.526   0.911   0.883
  985   2HB   ALA 140          2HB       ALA 140 -14.941   0.309   0.397
  986   3HB   ALA 140          3HB       ALA 140 -15.578   1.790  -0.318
  987    H    ALA 141           H        ALA 141 -16.794   2.125   3.301
  988    HA   ALA 141           HA       ALA 141 -18.080   4.455   2.386
  989   1HB   ALA 141          1HB       ALA 141 -18.323   3.129   5.081
  990   2HB   ALA 141          2HB       ALA 141 -19.220   2.674   3.634
  991   3HB   ALA 141          3HB       ALA 141 -19.469   4.260   4.362
  992    H    THR 142           H        THR 142 -15.615   3.932   4.890
  993    HA   THR 142           HA       THR 142 -15.976   6.645   5.858
  994    HB   THR 142           HB       THR 142 -13.775   4.765   6.700
  995    HG1  THR 142           1HG      THR 142 -15.668   3.578   6.956
  996   1HG2  THR 142          1HG2      THR 142 -13.995   5.961   8.827
  997   2HG2  THR 142          2HG2      THR 142 -15.302   6.933   8.153
  998   3HG2  THR 142          3HG2      THR 142 -13.668   7.086   7.508
  999    H    ALA 143           H        ALA 143 -13.591   4.795   3.990
 1000    HA   ALA 143           HA       ALA 143 -11.707   6.948   3.864
 1001   1HB   ALA 143          1HB       ALA 143 -11.006   4.617   3.674
 1002   2HB   ALA 143          2HB       ALA 143 -10.504   5.565   2.275
 1003   3HB   ALA 143          3HB       ALA 143 -11.885   4.475   2.151
 1004    H    CYS 144           H        CYS 144 -13.813   5.461   1.396
 1005    HA   CYS 144           HA       CYS 144 -13.378   7.686  -0.392
 1006   1HB   CYS 144          2HB       CYS 144 -14.356   4.984  -0.611
 1007   2HB   CYS 144          1HB       CYS 144 -15.501   6.095  -1.356
 1008    H    LYS 145           H        LYS 145 -14.550   8.276   2.132
 1009    HA   LYS 145           HA       LYS 145 -17.335   8.827   1.877
 1010   1HB   LYS 145          2HB       LYS 145 -16.461   8.634   4.060
 1011   2HB   LYS 145          1HB       LYS 145 -15.126   9.718   3.716
 1012   1HG   LYS 145          2HG       LYS 145 -16.814  11.571   3.537
 1013   2HG   LYS 145          1HG       LYS 145 -18.011  10.430   4.160
 1014   1HD   LYS 145          2HD       LYS 145 -16.963  11.879   5.915
 1015   2HD   LYS 145          1HD       LYS 145 -16.778  10.145   6.198
 1016   1HE   LYS 145          2HE       LYS 145 -14.517  10.248   5.224
 1017   2HE   LYS 145          1HE       LYS 145 -14.707  11.983   4.994
 1018   1HZ   LYS 145          1HZ       LYS 145 -14.879  10.678   7.650
 1019   2HZ   LYS 145          2HZ       LYS 145 -14.728  12.333   7.313
 1020   3HZ   LYS 145          3HZ       LYS 145 -13.430  11.279   7.004
 1021    H    ASN 146           H        ASN 146 -14.413  10.839   1.687
 1022    HA   ASN 146           HA       ASN 146 -15.419  12.433  -0.435
 1023   1HB   ASN 146          2HB       ASN 146 -16.755  13.425   1.389
 1024   2HB   ASN 146          1HB       ASN 146 -15.278  13.754   2.291
 1025   1HD2  ASN 146          1HD2      ASN 146 -13.947  15.444   1.650
 1026   2HD2  ASN 146          2HD2      ASN 146 -14.453  16.639   0.500
 1027    H    THR 147           H        THR 147 -13.507  12.191  -1.467
 1028    HA   THR 147           HA       THR 147 -11.285  13.747  -0.654
 1029    HB   THR 147           HB       THR 147 -10.844  12.034   0.955
 1030    HG1  THR 147           1HG      THR 147  -9.035  11.112  -0.908
 1031   1HG2  THR 147          1HG2      THR 147 -12.198  10.233  -0.006
 1032   2HG2  THR 147          2HG2      THR 147 -10.574   9.676   0.389
 1033   3HG2  THR 147          3HG2      THR 147 -11.005  10.015  -1.288
 1034    H    ASP 148           H        ASP 148 -11.054  14.568  -2.649
 1035    HA   ASP 148           HA       ASP 148 -10.854  12.724  -4.917
 1036   1HB   ASP 148          2HB       ASP 148 -11.113  15.731  -4.806
 1037   2HB   ASP 148          1HB       ASP 148 -10.800  14.849  -6.296
 1038    H    SER 149           H        SER 149  -9.110  15.779  -4.348
 1039    HA   SER 149           HA       SER 149  -6.711  14.651  -5.453
 1040   1HB   SER 149          2HB       SER 149  -5.705  16.857  -4.914
 1041   2HB   SER 149          1HB       SER 149  -7.211  17.007  -5.821
 1042    HG   SER 149           HG       SER 149  -6.690  18.267  -3.677
 1043    H    THR 150           H        THR 150  -8.129  14.730  -2.414
 1044    HA   THR 150           HA       THR 150  -5.737  14.515  -0.828
 1045    HB   THR 150           HB       THR 150  -8.517  13.717   0.031
 1046    HG1  THR 150           1HG      THR 150  -7.449  16.340  -0.347
 1047   1HG2  THR 150          1HG2      THR 150  -6.731  13.353   1.644
 1048   2HG2  THR 150          2HG2      THR 150  -7.775  14.667   2.185
 1049   3HG2  THR 150          3HG2      THR 150  -6.201  15.025   1.471
 1050    H    ASN 151           H        ASN 151  -7.204  12.500  -2.976
 1051    HA   ASN 151           HA       ASN 151  -7.308  10.097  -1.388
 1052   1HB   ASN 151          2HB       ASN 151  -8.950  10.613  -3.206
 1053   2HB   ASN 151          1HB       ASN 151  -7.656  10.372  -4.377
 1054   1HD2  ASN 151          1HD2      ASN 151  -6.903   8.308  -4.778
 1055   2HD2  ASN 151          2HD2      ASN 151  -7.753   6.894  -4.250
 1056    H    LYS 152           H        LYS 152  -5.113   9.988  -0.761
 1057    HA   LYS 152           HA       LYS 152  -3.608   8.418  -2.725
 1058   1HB   LYS 152          2HB       LYS 152  -1.658   9.526  -1.046
 1059   2HB   LYS 152          1HB       LYS 152  -1.911   9.858  -2.749
 1060   1HG   LYS 152          2HG       LYS 152  -1.892  11.966  -1.850
 1061   2HG   LYS 152          1HG       LYS 152  -3.617  11.611  -1.893
 1062   1HD   LYS 152          2HD       LYS 152  -3.638  11.114   0.447
 1063   2HD   LYS 152          1HD       LYS 152  -1.876  11.199   0.534
 1064   1HE   LYS 152          2HE       LYS 152  -2.000  13.586  -0.120
 1065   2HE   LYS 152          1HE       LYS 152  -3.757  13.478  -0.094
 1066   1HZ   LYS 152          1HZ       LYS 152  -2.045  12.907   2.261
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.734  13.094   2.230
 1068   3HZ   LYS 152          3HZ       LYS 152  -2.723  14.426   1.943
 1069    H    VAL 153           H        VAL 153  -3.013   6.512  -1.995
 1070    HA   VAL 153           HA       VAL 153  -3.145   6.014   0.881
 1071    HB   VAL 153           HB       VAL 153  -5.260   5.278   0.440
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.994   4.167  -1.631
 1073   2HG1  VAL 153          2HG1      VAL 153  -4.360   4.339  -2.274
 1074   3HG1  VAL 153          3HG1      VAL 153  -5.322   5.773  -1.916
 1075   1HG2  VAL 153          1HG2      VAL 153  -3.513   2.903  -0.164
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.251   2.789   0.100
 1077   3HG2  VAL 153          3HG2      VAL 153  -4.200   3.378   1.391
 1078    H    THR 154           H        THR 154  -1.009   5.659   1.109
 1079    HA   THR 154           HA       THR 154   0.394   3.632  -0.339
 1080    HB   THR 154           HB       THR 154   2.035   3.916   1.548
 1081    HG1  THR 154           1HG      THR 154   1.558   5.320   3.194
 1082   1HG2  THR 154          1HG2      THR 154   2.640   6.228   0.988
 1083   2HG2  THR 154          2HG2      THR 154   1.050   6.467   0.266
 1084   3HG2  THR 154          3HG2      THR 154   2.181   5.321  -0.454
 1085    H    TYR 155           H        TYR 155   0.468   1.392   0.126
 1086    HA   TYR 155           HA       TYR 155  -0.344   0.632   2.834
 1087   1HB   TYR 155          2HB       TYR 155  -1.885  -1.054   2.163
 1088   2HB   TYR 155          1HB       TYR 155  -2.353   0.440   1.370
 1089    HD1  TYR 155           1HD      TYR 155  -1.222  -2.985   0.899
 1090    HD2  TYR 155           2HD      TYR 155  -2.031   0.704  -1.058
 1091    HE1  TYR 155           1HE      TYR 155  -1.208  -4.142  -1.272
 1092    HE2  TYR 155           2HE      TYR 155  -2.033  -0.438  -3.235
 1093    HH   TYR 155           HH       TYR 155  -2.416  -3.530  -3.689
 1094    H    PHE 156           H        PHE 156   0.169  -1.634   3.374
 1095    HA   PHE 156           HA       PHE 156   2.655  -2.465   2.040
 1096   1HB   PHE 156          2HB       PHE 156   1.885  -2.269   4.929
 1097   2HB   PHE 156          1HB       PHE 156   3.086  -3.437   4.419
 1098    HD1  PHE 156           1HD      PHE 156   5.188  -2.687   3.406
 1099    HD2  PHE 156           2HD      PHE 156   2.376   0.046   5.053
 1100    HE1  PHE 156           1HE      PHE 156   6.923  -0.950   3.470
 1101    HE2  PHE 156           2HE      PHE 156   4.109   1.791   5.123
 1102    HZ   PHE 156           HZ       PHE 156   6.385   1.290   4.329
 1103    H    MET 157           H        MET 157   2.959  -4.668   1.684
 1104    HA   MET 157           HA       MET 157   0.745  -6.375   2.566
 1105   1HB   MET 157          2HB       MET 157   0.628  -7.436   0.338
 1106   2HB   MET 157          1HB       MET 157   0.133  -5.745   0.340
 1107   1HG   MET 157          2HG       MET 157   2.339  -5.127  -0.546
 1108   2HG   MET 157          1HG       MET 157   2.784  -6.832  -0.592
 1109   1HE   MET 157          1HE       MET 157   3.379  -6.802  -3.130
 1110   2HE   MET 157          2HE       MET 157   3.074  -5.066  -3.143
 1111   3HE   MET 157          3HE       MET 157   2.350  -6.098  -4.376
 1112    H    LYS 158           H        LYS 158   1.173  -8.569   2.700
 1113    HA   LYS 158           HA       LYS 158   3.602  -9.134   3.922
 1114   1HB   LYS 158          2HB       LYS 158   1.439 -10.290   4.331
 1115   2HB   LYS 158          1HB       LYS 158   1.646 -11.136   2.805
 1116   1HG   LYS 158          2HG       LYS 158   3.560 -12.294   3.613
 1117   2HG   LYS 158          1HG       LYS 158   3.625 -11.287   5.061
 1118   1HD   LYS 158          2HD       LYS 158   1.425 -13.226   4.342
 1119   2HD   LYS 158          1HD       LYS 158   2.668 -13.473   5.571
 1120   1HE   LYS 158          2HE       LYS 158   1.826 -11.591   6.842
 1121   2HE   LYS 158          1HE       LYS 158   0.639 -11.244   5.586
 1122   1HZ   LYS 158          1HZ       LYS 158  -0.496 -12.404   7.256
 1123   2HZ   LYS 158          2HZ       LYS 158   0.727 -13.559   7.429
 1124   3HZ   LYS 158          3HZ       LYS 158  -0.239 -13.551   6.030
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1 -24.179  -4.440  -6.513
    2   2H    MET   1          2HT       MET   1 -24.130  -3.745  -4.965
    3   3H    MET   1          3HT       MET   1 -22.832  -4.690  -5.509
    4    HA   MET   1           HA       MET   1 -22.460  -3.067  -7.305
    5   1HB   MET   1          2HB       MET   1 -24.715  -2.089  -7.285
    6   2HB   MET   1          1HB       MET   1 -24.428  -1.450  -5.673
    7   1HG   MET   1          2HG       MET   1 -24.190   0.292  -7.328
    8   2HG   MET   1          1HG       MET   1 -22.642  -0.032  -6.552
    9   1HE   MET   1          1HE       MET   1 -21.415   1.314  -8.501
   10   2HE   MET   1          2HE       MET   1 -22.972   1.620  -9.267
   11   3HE   MET   1          3HE       MET   1 -21.640   0.964 -10.215
   12    H    GLU   2           H        GLU   2 -23.183  -1.666  -4.077
   13    HA   GLU   2           HA       GLU   2 -20.357  -0.921  -3.926
   14   1HB   GLU   2          2HB       GLU   2 -20.966   0.788  -2.443
   15   2HB   GLU   2          1HB       GLU   2 -22.255   0.757  -3.633
   16   1HG   GLU   2          2HG       GLU   2 -22.339  -0.335  -0.831
   17   2HG   GLU   2          1HG       GLU   2 -23.185   1.077  -1.450
   18    H    GLN   3           H        GLN   3 -22.193  -3.433  -2.949
   19    HA   GLN   3           HA       GLN   3 -21.134  -3.804  -0.296
   20   1HB   GLN   3          2HB       GLN   3 -22.479  -5.797  -2.136
   21   2HB   GLN   3          1HB       GLN   3 -22.155  -6.031  -0.425
   22   1HG   GLN   3          2HG       GLN   3 -23.694  -4.250   0.138
   23   2HG   GLN   3          1HG       GLN   3 -23.978  -3.933  -1.574
   24   1HE2  GLN   3          1HE2      GLN   3 -23.906  -6.796  -2.231
   25   2HE2  GLN   3          2HE2      GLN   3 -25.419  -7.445  -1.693
   26    H    SER   4           H        SER   4 -19.719  -5.620   0.262
   27    HA   SER   4           HA       SER   4 -17.628  -5.987  -1.696
   28   1HB   SER   4          2HB       SER   4 -16.656  -7.407   0.268
   29   2HB   SER   4          1HB       SER   4 -16.725  -5.652   0.433
   30    HG   SER   4           HG       SER   4 -17.535  -6.773   2.286
   31    H    ALA   5           H        ALA   5 -18.813  -7.159  -3.258
   32    HA   ALA   5           HA       ALA   5 -19.519  -9.915  -2.492
   33   1HB   ALA   5          1HB       ALA   5 -20.891  -9.969  -4.515
   34   2HB   ALA   5          2HB       ALA   5 -20.381  -8.329  -4.908
   35   3HB   ALA   5          3HB       ALA   5 -21.352  -8.627  -3.467
   36    H    SER   6           H        SER   6 -17.267  -8.018  -4.153
   37    HA   SER   6           HA       SER   6 -16.188 -10.284  -5.646
   38   1HB   SER   6          2HB       SER   6 -15.133  -7.454  -5.362
   39   2HB   SER   6          1HB       SER   6 -14.558  -8.673  -6.501
   40    HG   SER   6           HG       SER   6 -16.331  -6.935  -7.039
   41    H    ASP   7           H        ASP   7 -16.400  -9.949  -2.670
   42    HA   ASP   7           HA       ASP   7 -13.920  -9.267  -1.526
   43   1HB   ASP   7          2HB       ASP   7 -14.876 -10.025   0.542
   44   2HB   ASP   7          1HB       ASP   7 -16.141  -9.220  -0.380
   45    H    SER   8           H        SER   8 -15.099 -12.223  -2.862
   46    HA   SER   8           HA       SER   8 -12.600 -13.519  -1.998
   47   1HB   SER   8          2HB       SER   8 -14.636 -14.621  -1.090
   48   2HB   SER   8          1HB       SER   8 -15.224 -14.854  -2.734
   49    HG   SER   8           HG       SER   8 -13.987 -16.534  -2.905
   50    H    ASN   9           H        ASN   9 -14.903 -12.977  -4.604
   51    HA   ASN   9           HA       ASN   9 -13.778 -14.580  -6.572
   52   1HB   ASN   9          2HB       ASN   9 -15.966 -13.516  -6.808
   53   2HB   ASN   9          1HB       ASN   9 -15.199 -11.934  -6.922
   54   1HD2  ASN   9          1HD2      ASN   9 -15.975 -11.485  -8.959
   55   2HD2  ASN   9          2HD2      ASN   9 -15.413 -12.319 -10.372
   56    H    LYS  10           H        LYS  10 -13.231 -11.037  -6.218
   57    HA   LYS  10           HA       LYS  10 -11.049 -11.308  -8.122
   58   1HB   LYS  10          2HB       LYS  10 -11.138  -9.035  -8.479
   59   2HB   LYS  10          1HB       LYS  10 -12.808  -9.376  -8.064
   60   1HG   LYS  10          2HG       LYS  10 -12.484  -8.522  -5.839
   61   2HG   LYS  10          1HG       LYS  10 -10.754  -8.318  -6.132
   62   1HD   LYS  10          2HD       LYS  10 -13.033  -6.824  -7.433
   63   2HD   LYS  10          1HD       LYS  10 -11.777  -6.170  -6.373
   64   1HE   LYS  10          2HE       LYS  10 -10.092  -6.536  -8.022
   65   2HE   LYS  10          1HE       LYS  10 -11.204  -7.446  -9.042
   66   1HZ   LYS  10          1HZ       LYS  10 -11.341  -4.541  -8.426
   67   2HZ   LYS  10          2HZ       LYS  10 -12.505  -5.391  -9.314
   68   3HZ   LYS  10          3HZ       LYS  10 -10.924  -5.245  -9.911
   69    H    SER  11           H        SER  11 -11.540 -11.168  -4.757
   70    HA   SER  11           HA       SER  11  -9.035 -10.029  -4.032
   71   1HB   SER  11          2HB       SER  11 -10.991 -10.049  -2.507
   72   2HB   SER  11          1HB       SER  11 -10.869 -11.804  -2.398
   73    HG   SER  11           HG       SER  11  -8.483 -10.886  -1.834
   74    H    GLN  12           H        GLN  12 -10.270 -13.331  -4.394
   75    HA   GLN  12           HA       GLN  12  -8.021 -14.710  -3.477
   76   1HB   GLN  12          2HB       GLN  12 -10.368 -15.575  -4.091
   77   2HB   GLN  12          1HB       GLN  12  -9.756 -15.668  -5.736
   78   1HG   GLN  12          2HG       GLN  12  -7.911 -17.106  -4.871
   79   2HG   GLN  12          1HG       GLN  12  -8.756 -17.135  -3.326
   80   1HE2  GLN  12          1HE2      GLN  12  -9.152 -19.313  -3.359
   81   2HE2  GLN  12          2HE2      GLN  12 -10.266 -20.049  -4.464
   82    H    ASN  13           H        ASN  13  -8.906 -13.688  -6.762
   83    HA   ASN  13           HA       ASN  13  -6.615 -14.716  -8.038
   84   1HB   ASN  13          2HB       ASN  13  -8.562 -12.544  -8.803
   85   2HB   ASN  13          1HB       ASN  13  -7.187 -12.958  -9.822
   86   1HD2  ASN  13          1HD2      ASN  13 -10.314 -13.925  -8.698
   87   2HD2  ASN  13          2HD2      ASN  13 -10.476 -15.310  -9.726
   88    H    ALA  14           H        ALA  14  -7.327 -11.549  -6.637
   89    HA   ALA  14           HA       ALA  14  -4.929 -10.289  -7.365
   90   1HB   ALA  14          1HB       ALA  14  -5.432  -8.678  -5.618
   91   2HB   ALA  14          2HB       ALA  14  -6.631  -9.775  -4.930
   92   3HB   ALA  14          3HB       ALA  14  -6.888  -9.077  -6.531
   93    H    ILE  15           H        ILE  15  -5.808 -12.146  -4.462
   94    HA   ILE  15           HA       ILE  15  -3.448 -11.836  -3.019
   95    HB   ILE  15           HB       ILE  15  -5.279 -14.239  -3.145
   96   1HG1  ILE  15          2HG1      ILE  15  -6.459 -12.308  -2.344
   97   2HG1  ILE  15          1HG1      ILE  15  -6.103 -13.331  -0.959
   98   1HG2  ILE  15          1HG2      ILE  15  -4.299 -14.927  -1.012
   99   2HG2  ILE  15          2HG2      ILE  15  -3.136 -13.606  -1.124
  100   3HG2  ILE  15          3HG2      ILE  15  -3.102 -14.915  -2.307
  101   1HD1  ILE  15          1HD1      ILE  15  -5.764 -10.980  -0.452
  102   2HD1  ILE  15          2HD1      ILE  15  -4.580 -10.863  -1.754
  103   3HD1  ILE  15          3HD1      ILE  15  -4.250 -11.878  -0.352
  104    H    SER  16           H        SER  16  -4.281 -14.186  -5.519
  105    HA   SER  16           HA       SER  16  -1.994 -15.765  -5.428
  106   1HB   SER  16          2HB       SER  16  -4.079 -16.232  -6.748
  107   2HB   SER  16          1HB       SER  16  -3.555 -15.022  -7.916
  108    HG   SER  16           HG       SER  16  -1.689 -16.299  -8.300
  109    H    GLU  17           H        GLU  17  -2.627 -12.830  -7.341
  110    HA   GLU  17           HA       GLU  17  -0.086 -12.881  -8.624
  111   1HB   GLU  17          2HB       GLU  17  -2.059 -10.610  -8.360
  112   2HB   GLU  17          1HB       GLU  17  -0.701 -10.665  -9.474
  113   1HG   GLU  17          2HG       GLU  17  -3.137 -12.430  -9.489
  114   2HG   GLU  17          1HG       GLU  17  -2.712 -11.181 -10.659
  115    H    VAL  18           H        VAL  18  -1.424 -10.966  -5.929
  116    HA   VAL  18           HA       VAL  18   0.873  -9.320  -5.697
  117    HB   VAL  18           HB       VAL  18  -1.380  -8.679  -4.845
  118   1HG1  VAL  18          1HG1      VAL  18  -2.036 -10.749  -3.773
  119   2HG1  VAL  18          2HG1      VAL  18  -2.069  -9.420  -2.614
  120   3HG1  VAL  18          3HG1      VAL  18  -0.737 -10.576  -2.595
  121   1HG2  VAL  18          1HG2      VAL  18  -0.562  -7.528  -2.834
  122   2HG2  VAL  18          2HG2      VAL  18   0.577  -7.422  -4.175
  123   3HG2  VAL  18          3HG2      VAL  18   0.877  -8.548  -2.851
  124    H    MET  19           H        MET  19  -0.048 -12.369  -4.170
  125    HA   MET  19           HA       MET  19   2.041 -12.359  -2.237
  126   1HB   MET  19          2HB       MET  19   0.030 -13.775  -2.035
  127   2HB   MET  19          1HB       MET  19   0.554 -14.706  -3.427
  128   1HG   MET  19          2HG       MET  19   2.533 -15.438  -2.211
  129   2HG   MET  19          1HG       MET  19   2.033 -14.487  -0.814
  130   1HE   MET  19          1HE       MET  19  -0.309 -18.134  -2.413
  131   2HE   MET  19          2HE       MET  19   1.221 -17.582  -3.099
  132   3HE   MET  19          3HE       MET  19  -0.227 -16.588  -3.256
  133    H    SER  20           H        SER  20   1.789 -13.452  -5.552
  134    HA   SER  20           HA       SER  20   4.301 -14.783  -5.610
  135   1HB   SER  20          2HB       SER  20   2.732 -13.582  -7.906
  136   2HB   SER  20          1HB       SER  20   4.027 -14.772  -8.038
  137    HG   SER  20           HG       SER  20   1.411 -15.082  -7.032
  138    H    ALA  21           H        ALA  21   3.194 -11.515  -6.298
  139    HA   ALA  21           HA       ALA  21   5.559 -10.470  -7.375
  140   1HB   ALA  21          1HB       ALA  21   4.648  -8.281  -6.817
  141   2HB   ALA  21          2HB       ALA  21   3.454  -9.036  -5.760
  142   3HB   ALA  21          3HB       ALA  21   3.399  -9.323  -7.500
  143    H    THR  22           H        THR  22   4.391 -10.520  -3.997
  144    HA   THR  22           HA       THR  22   6.650  -9.187  -2.938
  145    HB   THR  22           HB       THR  22   5.916 -10.208  -0.736
  146    HG1  THR  22           1HG      THR  22   3.850 -11.235  -0.780
  147   1HG2  THR  22          1HG2      THR  22   5.152  -8.003  -1.496
  148   2HG2  THR  22          2HG2      THR  22   3.899  -8.845  -0.582
  149   3HG2  THR  22          3HG2      THR  22   3.805  -8.766  -2.342
  150    H    SER  23           H        SER  23   5.856 -12.615  -3.331
  151    HA   SER  23           HA       SER  23   8.103 -13.700  -2.071
  152   1HB   SER  23          2HB       SER  23   6.560 -14.797  -4.436
  153   2HB   SER  23          1HB       SER  23   7.678 -15.721  -3.432
  154    HG   SER  23           HG       SER  23   5.228 -14.513  -2.646
  155    H    ALA  24           H        ALA  24   7.634 -12.712  -5.450
  156    HA   ALA  24           HA       ALA  24  10.181 -13.485  -6.383
  157   1HB   ALA  24          1HB       ALA  24   8.339 -12.984  -7.892
  158   2HB   ALA  24          2HB       ALA  24   9.741 -11.979  -8.264
  159   3HB   ALA  24          3HB       ALA  24   8.371 -11.293  -7.390
  160    H    ILE  25           H        ILE  25   8.985 -10.405  -5.089
  161    HA   ILE  25           HA       ILE  25  11.364  -8.957  -5.468
  162    HB   ILE  25           HB       ILE  25   8.894  -8.584  -3.831
  163   1HG1  ILE  25          2HG1      ILE  25   8.853  -8.052  -6.219
  164   2HG1  ILE  25          1HG1      ILE  25   8.644  -6.600  -5.246
  165   1HG2  ILE  25          1HG2      ILE  25  10.641  -7.795  -2.384
  166   2HG2  ILE  25          2HG2      ILE  25   9.713  -6.438  -3.020
  167   3HG2  ILE  25          3HG2      ILE  25  11.309  -6.805  -3.681
  168   1HD1  ILE  25          1HD1      ILE  25  10.989  -6.025  -5.610
  169   2HD1  ILE  25          2HD1      ILE  25  10.112  -6.189  -7.132
  170   3HD1  ILE  25          3HD1      ILE  25  11.192  -7.474  -6.591
  171    H    ASN  26           H        ASN  26  10.106 -10.788  -2.694
  172    HA   ASN  26           HA       ASN  26  12.111 -10.078  -0.853
  173   1HB   ASN  26          2HB       ASN  26  10.045 -11.170  -0.142
  174   2HB   ASN  26          1HB       ASN  26  10.482 -12.624  -1.035
  175   1HD2  ASN  26          1HD2      ASN  26  11.107 -10.691   1.784
  176   2HD2  ASN  26          2HD2      ASN  26  12.033 -11.880   2.630
  177    H    GLY  27           H        GLY  27  11.929 -12.653  -3.256
  178   1HA   GLY  27          2HA       GLY  27  14.289 -14.012  -2.484
  179   2HA   GLY  27          1HA       GLY  27  13.490 -14.137  -4.042
  180    H    LEU  28           H        LEU  28  13.862 -11.026  -4.063
  181    HA   LEU  28           HA       LEU  28  16.403 -11.142  -5.468
  182   1HB   LEU  28          2HB       LEU  28  14.458  -8.857  -5.135
  183   2HB   LEU  28          1HB       LEU  28  15.863  -8.853  -6.180
  184    HG   LEU  28           HG       LEU  28  13.430 -10.616  -6.488
  185   1HD1  LEU  28          1HD1      LEU  28  13.056  -9.300  -8.526
  186   2HD1  LEU  28          2HD1      LEU  28  14.423  -8.269  -8.102
  187   3HD1  LEU  28          3HD1      LEU  28  12.991  -8.303  -7.073
  188   1HD2  LEU  28          1HD2      LEU  28  15.904 -10.376  -8.199
  189   2HD2  LEU  28          2HD2      LEU  28  14.461 -11.307  -8.600
  190   3HD2  LEU  28          3HD2      LEU  28  15.448 -11.765  -7.213
  191    H    TYR  29           H        TYR  29  15.323 -10.431  -2.368
  192    HA   TYR  29           HA       TYR  29  17.762  -8.884  -1.814
  193   1HB   TYR  29          2HB       TYR  29  14.962  -8.327  -0.866
  194   2HB   TYR  29          1HB       TYR  29  16.371  -7.720  -0.011
  195    HD1  TYR  29           1HD      TYR  29  14.608  -7.602  -3.282
  196    HD2  TYR  29           2HD      TYR  29  17.485  -5.791  -0.726
  197    HE1  TYR  29           1HE      TYR  29  14.690  -5.646  -4.769
  198    HE2  TYR  29           2HE      TYR  29  17.572  -3.829  -2.197
  199    HH   TYR  29           HH       TYR  29  15.289  -3.233  -4.615
  200    H    ILE  30           H        ILE  30  17.765 -11.561  -1.526
  201    HA   ILE  30           HA       ILE  30  16.902 -12.495   1.019
  202    HB   ILE  30           HB       ILE  30  18.965 -13.620  -0.883
  203   1HG1  ILE  30          2HG1      ILE  30  16.697 -13.541  -1.807
  204   2HG1  ILE  30          1HG1      ILE  30  17.184 -15.204  -1.492
  205   1HG2  ILE  30          1HG2      ILE  30  17.692 -14.931   1.515
  206   2HG2  ILE  30          2HG2      ILE  30  19.377 -14.424   1.380
  207   3HG2  ILE  30          3HG2      ILE  30  18.760 -15.716   0.352
  208   1HD1  ILE  30          1HD1      ILE  30  15.873 -15.167   0.587
  209   2HD1  ILE  30          2HD1      ILE  30  14.888 -14.859  -0.843
  210   3HD1  ILE  30          3HD1      ILE  30  15.353 -13.523   0.207
  211    H    GLY  31           H        GLY  31  19.870 -11.066  -0.189
  212   1HA   GLY  31          2HA       GLY  31  21.332 -11.597   2.255
  213   2HA   GLY  31          1HA       GLY  31  21.902 -10.667   0.877
  214    H    GLN  32           H        GLN  32  18.941  -9.470   1.560
  215    HA   GLN  32           HA       GLN  32  20.107  -7.304   3.160
  216   1HB   GLN  32          2HB       GLN  32  17.872  -7.356   1.154
  217   2HB   GLN  32          1HB       GLN  32  18.000  -6.053   2.322
  218   1HG   GLN  32          2HG       GLN  32  19.008  -5.328   0.298
  219   2HG   GLN  32          1HG       GLN  32  20.287  -5.598   1.475
  220   1HE2  GLN  32          1HE2      GLN  32  18.637  -8.116  -0.313
  221   2HE2  GLN  32          2HE2      GLN  32  20.002  -8.616  -1.249
  222    H    THR  33           H        THR  33  19.533  -7.182   5.191
  223    HA   THR  33           HA       THR  33  17.475  -8.884   6.259
  224    HB   THR  33           HB       THR  33  19.081  -6.790   7.738
  225    HG1  THR  33           1HG      THR  33  19.725  -9.473   7.021
  226   1HG2  THR  33          1HG2      THR  33  17.196  -7.709   8.988
  227   2HG2  THR  33          2HG2      THR  33  18.723  -8.287   9.657
  228   3HG2  THR  33          3HG2      THR  33  17.748  -9.347   8.639
  229    H    SER  34           H        SER  34  17.949  -5.457   5.683
  230    HA   SER  34           HA       SER  34  15.166  -4.973   6.505
  231   1HB   SER  34          2HB       SER  34  16.058  -2.657   7.182
  232   2HB   SER  34          1HB       SER  34  16.447  -4.012   8.240
  233    HG   SER  34           HG       SER  34  18.111  -2.376   6.887
  234    H    TYR  35           H        TYR  35  16.993  -5.243   3.924
  235    HA   TYR  35           HA       TYR  35  16.998  -4.447   1.791
  236   1HB   TYR  35          2HB       TYR  35  14.418  -3.071   2.590
  237   2HB   TYR  35          1HB       TYR  35  14.953  -3.419   0.951
  238    HD1  TYR  35           1HD      TYR  35  14.655  -5.599  -0.006
  239    HD2  TYR  35           2HD      TYR  35  13.620  -4.889   4.061
  240    HE1  TYR  35           1HE      TYR  35  13.458  -7.742   0.062
  241    HE2  TYR  35           2HE      TYR  35  12.429  -7.037   4.138
  242    HH   TYR  35           HH       TYR  35  12.785  -9.416   1.816
  243    H    SER  36           H        SER  36  18.376  -2.951   3.845
  244    HA   SER  36           HA       SER  36  17.710  -0.193   3.697
  245   1HB   SER  36          2HB       SER  36  20.009  -1.694   4.918
  246   2HB   SER  36          1HB       SER  36  19.919   0.071   4.954
  247    HG   SER  36           HG       SER  36  17.716  -0.305   5.834
  248    H    GLY  37           H        GLY  37  19.068  -1.974   1.343
  249   1HA   GLY  37          2HA       GLY  37  21.028  -0.105   0.404
  250   2HA   GLY  37          1HA       GLY  37  20.262  -1.374  -0.546
  251    H    LEU  38           H        LEU  38  17.672  -0.027   0.657
  252    HA   LEU  38           HA       LEU  38  17.404   1.804  -1.624
  253   1HB   LEU  38          2HB       LEU  38  15.260   0.338  -0.094
  254   2HB   LEU  38          1HB       LEU  38  14.997   1.370  -1.486
  255    HG   LEU  38           HG       LEU  38  16.533  -1.230  -1.493
  256   1HD1  LEU  38          1HD1      LEU  38  14.656  -2.076  -2.801
  257   2HD1  LEU  38          2HD1      LEU  38  13.824  -0.533  -2.617
  258   3HD1  LEU  38          3HD1      LEU  38  14.129  -1.543  -1.204
  259   1HD2  LEU  38          1HD2      LEU  38  15.800   0.637  -3.746
  260   2HD2  LEU  38          2HD2      LEU  38  16.538  -0.955  -3.931
  261   3HD2  LEU  38          3HD2      LEU  38  17.424   0.338  -3.123
  262    H    ASP  39           H        ASP  39  16.728   1.560   1.879
  263    HA   ASP  39           HA       ASP  39  15.008   3.760   1.993
  264   1HB   ASP  39          2HB       ASP  39  15.483   3.859   4.442
  265   2HB   ASP  39          1HB       ASP  39  14.983   2.283   3.856
  266    H    SER  40           H        SER  40  18.468   3.716   2.841
  267    HA   SER  40           HA       SER  40  18.607   6.466   3.361
  268   1HB   SER  40          2HB       SER  40  20.840   4.626   2.470
  269   2HB   SER  40          1HB       SER  40  21.025   6.169   3.307
  270    HG   SER  40           HG       SER  40  19.417   4.174   4.478
  271    H    THR  41           H        THR  41  18.924   4.621   0.415
  272    HA   THR  41           HA       THR  41  20.090   6.579  -1.222
  273    HB   THR  41           HB       THR  41  18.178   4.419  -2.117
  274    HG1  THR  41           1HG      THR  41  19.737   2.980  -1.772
  275   1HG2  THR  41          1HG2      THR  41  18.833   6.043  -3.841
  276   2HG2  THR  41          2HG2      THR  41  19.517   4.449  -4.165
  277   3HG2  THR  41          3HG2      THR  41  20.532   5.723  -3.492
  278    H    ILE  42           H        ILE  42  16.694   5.816  -0.519
  279    HA   ILE  42           HA       ILE  42  15.741   7.920  -2.275
  280    HB   ILE  42           HB       ILE  42  14.205   6.207  -0.310
  281   1HG1  ILE  42          2HG1      ILE  42  15.255   4.842  -2.039
  282   2HG1  ILE  42          1HG1      ILE  42  13.515   4.917  -2.299
  283   1HG2  ILE  42          1HG2      ILE  42  13.199   7.908  -2.589
  284   2HG2  ILE  42          2HG2      ILE  42  13.053   8.294  -0.875
  285   3HG2  ILE  42          3HG2      ILE  42  12.218   6.888  -1.535
  286   1HD1  ILE  42          1HD1      ILE  42  13.878   6.622  -4.034
  287   2HD1  ILE  42          2HD1      ILE  42  14.688   5.097  -4.397
  288   3HD1  ILE  42          3HD1      ILE  42  15.619   6.468  -3.793
  289    H    LEU  43           H        LEU  43  16.305   7.395   1.122
  290    HA   LEU  43           HA       LEU  43  14.852   9.444   2.288
  291   1HB   LEU  43          2HB       LEU  43  16.139   7.637   3.444
  292   2HB   LEU  43          1HB       LEU  43  17.610   8.527   3.094
  293    HG   LEU  43           HG       LEU  43  16.697  10.431   4.434
  294   1HD1  LEU  43          1HD1      LEU  43  14.332   9.904   4.275
  295   2HD1  LEU  43          2HD1      LEU  43  14.838   9.957   5.964
  296   3HD1  LEU  43          3HD1      LEU  43  14.588   8.404   5.166
  297   1HD2  LEU  43          1HD2      LEU  43  17.010   7.779   5.830
  298   2HD2  LEU  43          2HD2      LEU  43  17.118   9.360   6.602
  299   3HD2  LEU  43          3HD2      LEU  43  18.306   8.892   5.385
  300    H    LEU  44           H        LEU  44  18.243   9.558   1.190
  301    HA   LEU  44           HA       LEU  44  18.418  12.381   1.679
  302   1HB   LEU  44          2HB       LEU  44  20.663  12.182   0.629
  303   2HB   LEU  44          1HB       LEU  44  20.396  11.104   1.980
  304    HG   LEU  44           HG       LEU  44  19.853   9.320   0.182
  305   1HD1  LEU  44          1HD1      LEU  44  21.419  11.278  -1.491
  306   2HD1  LEU  44          2HD1      LEU  44  19.736  10.814  -1.737
  307   3HD1  LEU  44          3HD1      LEU  44  21.018   9.621  -1.939
  308   1HD2  LEU  44          1HD2      LEU  44  22.661  10.350   0.556
  309   2HD2  LEU  44          2HD2      LEU  44  22.217   8.732   0.009
  310   3HD2  LEU  44          3HD2      LEU  44  21.798   9.258   1.641
  311    H    ASN  45           H        ASN  45  17.089  10.587  -0.778
  312    HA   ASN  45           HA       ASN  45  17.846  12.115  -3.056
  313   1HB   ASN  45          2HB       ASN  45  17.026   9.835  -3.298
  314   2HB   ASN  45          1HB       ASN  45  15.478  10.294  -2.596
  315   1HD2  ASN  45          1HD2      ASN  45  17.512  10.456  -5.413
  316   2HD2  ASN  45          2HD2      ASN  45  16.287  11.009  -6.509
  317    H    THR  46           H        THR  46  14.959  12.138  -0.969
  318    HA   THR  46           HA       THR  46  14.169  14.641  -2.312
  319    HB   THR  46           HB       THR  46  12.279  12.679  -1.002
  320    HG1  THR  46           1HG      THR  46  13.537  12.524  -3.391
  321   1HG2  THR  46          1HG2      THR  46  10.563  13.907  -2.216
  322   2HG2  THR  46          2HG2      THR  46  11.788  14.959  -2.922
  323   3HG2  THR  46          3HG2      THR  46  11.481  15.004  -1.185
  324    H    SER  47           H        SER  47  15.148  16.040  -0.831
  325    HA   SER  47           HA       SER  47  15.115  17.464   0.945
  326   1HB   SER  47          2HB       SER  47  12.246  16.531   1.102
  327   2HB   SER  47          1HB       SER  47  12.888  18.036   1.767
  328    HG   SER  47           HG       SER  47  13.362  17.532  -0.931
  329    H    ALA  48           H        ALA  48  15.785  14.624   1.561
  330    HA   ALA  48           HA       ALA  48  16.480  13.449   3.368
  331   1HB   ALA  48          1HB       ALA  48  17.110  15.604   4.342
  332   2HB   ALA  48          2HB       ALA  48  16.556  14.463   5.567
  333   3HB   ALA  48          3HB       ALA  48  15.492  15.760   5.028
  334    H    ILE  49           H        ILE  49  13.323  14.226   2.776
  335    HA   ILE  49           HA       ILE  49  12.386  11.916   4.291
  336    HB   ILE  49           HB       ILE  49  10.983  14.601   4.363
  337   1HG1  ILE  49          2HG1      ILE  49  12.215  12.941   6.576
  338   2HG1  ILE  49          1HG1      ILE  49  12.835  14.468   5.954
  339   1HG2  ILE  49          1HG2      ILE  49   9.296  13.467   5.747
  340   2HG2  ILE  49          2HG2      ILE  49  10.111  11.930   5.461
  341   3HG2  ILE  49          3HG2      ILE  49   9.377  12.802   4.116
  342   1HD1  ILE  49          1HD1      ILE  49  10.207  14.087   7.368
  343   2HD1  ILE  49          2HD1      ILE  49  10.855  15.616   6.771
  344   3HD1  ILE  49          3HD1      ILE  49  11.676  14.757   8.074
  345    HA   PRO  50           HA       PRO  50  11.135  11.296   0.026
  346   1HB   PRO  50          2HB       PRO  50   9.733   8.988   1.270
  347   2HB   PRO  50          1HB       PRO  50  10.860   9.029  -0.093
  348   1HG   PRO  50          2HG       PRO  50  11.639   8.114   2.285
  349   2HG   PRO  50          1HG       PRO  50  12.728   9.078   1.272
  350   1HD   PRO  50          2HD       PRO  50  11.174   9.889   3.692
  351   2HD   PRO  50          1HD       PRO  50  12.815  10.354   3.194
  352    H    ASP  51           H        ASP  51   9.643  12.694  -0.617
  353    HA   ASP  51           HA       ASP  51   7.145  13.085   0.743
  354   1HB   ASP  51          2HB       ASP  51   8.295  14.978  -0.257
  355   2HB   ASP  51          1HB       ASP  51   8.227  14.221  -1.845
  356    H    ASN  52           H        ASN  52   8.215  10.857  -1.462
  357    HA   ASN  52           HA       ASN  52   6.106  10.735  -3.336
  358   1HB   ASN  52          2HB       ASN  52   6.998   8.487  -3.876
  359   2HB   ASN  52          1HB       ASN  52   8.260   9.714  -3.819
  360   1HD2  ASN  52          1HD2      ASN  52   6.914   6.902  -2.275
  361   2HD2  ASN  52          2HD2      ASN  52   8.241   6.609  -1.211
  362    H    TYR  53           H        TYR  53   6.206   9.924  -0.080
  363    HA   TYR  53           HA       TYR  53   4.597   7.622   0.059
  364   1HB   TYR  53          2HB       TYR  53   4.876   9.906   2.023
  365   2HB   TYR  53          1HB       TYR  53   4.166   8.341   2.378
  366    HD1  TYR  53           1HD      TYR  53   6.378   6.941   0.552
  367    HD2  TYR  53           2HD      TYR  53   6.466   9.587   3.873
  368    HE1  TYR  53           1HE      TYR  53   8.568   6.049   1.187
  369    HE2  TYR  53           2HE      TYR  53   8.664   8.704   4.527
  370    HH   TYR  53           HH       TYR  53  10.408   6.436   2.495
  371    H    LYS  54           H        LYS  54   3.804  10.910  -0.632
  372    HA   LYS  54           HA       LYS  54   0.966  10.181  -0.653
  373   1HB   LYS  54          2HB       LYS  54   0.445  12.449   0.327
  374   2HB   LYS  54          1HB       LYS  54   1.172  11.298   1.440
  375   1HG   LYS  54          2HG       LYS  54   3.354  12.386   1.117
  376   2HG   LYS  54          1HG       LYS  54   2.593  13.555   0.036
  377   1HD   LYS  54          2HD       LYS  54   1.251  14.429   1.806
  378   2HD   LYS  54          1HD       LYS  54   1.745  13.133   2.895
  379   1HE   LYS  54          2HE       LYS  54   2.930  15.173   3.446
  380   2HE   LYS  54          1HE       LYS  54   4.057  13.970   2.823
  381   1HZ   LYS  54          1HZ       LYS  54   2.913  16.221   1.249
  382   2HZ   LYS  54          2HZ       LYS  54   4.051  15.092   0.692
  383   3HZ   LYS  54          3HZ       LYS  54   4.471  16.181   1.914
  384    H    ASP  55           H        ASP  55  -0.134  10.996  -2.368
  385    HA   ASP  55           HA       ASP  55   1.286  12.743  -4.235
  386   1HB   ASP  55          2HB       ASP  55   0.236  10.702  -5.156
  387   2HB   ASP  55          1HB       ASP  55  -1.327  11.241  -4.545
  388    H    THR  56           H        THR  56   0.027  14.613  -5.179
  389    HA   THR  56           HA       THR  56  -1.737  15.717  -3.095
  390    HB   THR  56           HB       THR  56   0.432  16.908  -3.281
  391    HG1  THR  56           1HG      THR  56  -1.809  18.465  -4.134
  392   1HG2  THR  56          1HG2      THR  56  -0.556  17.628  -6.040
  393   2HG2  THR  56          2HG2      THR  56   0.850  16.632  -5.664
  394   3HG2  THR  56          3HG2      THR  56   0.840  18.345  -5.238
  395    H    THR  57           H        THR  57  -1.789  14.494  -6.167
  396    HA   THR  57           HA       THR  57  -3.817  16.392  -7.087
  397    HB   THR  57           HB       THR  57  -2.561  14.107  -8.618
  398    HG1  THR  57           1HG      THR  57  -0.936  15.563  -8.350
  399   1HG2  THR  57          1HG2      THR  57  -4.750  14.783  -9.481
  400   2HG2  THR  57          2HG2      THR  57  -3.463  15.269 -10.585
  401   3HG2  THR  57          3HG2      THR  57  -4.220  16.464  -9.531
  402    H    ASN  58           H        ASN  58  -3.380  12.841  -6.813
  403    HA   ASN  58           HA       ASN  58  -5.605  12.171  -5.414
  404   1HB   ASN  58          2HB       ASN  58  -7.386  11.633  -6.947
  405   2HB   ASN  58          1HB       ASN  58  -6.964  13.327  -7.158
  406   1HD2  ASN  58          1HD2      ASN  58  -7.042  10.190  -8.588
  407   2HD2  ASN  58          2HD2      ASN  58  -6.610  10.673 -10.196
  408    H    LYS  59           H        LYS  59  -2.895  11.213  -6.742
  409    HA   LYS  59           HA       LYS  59  -3.776   8.466  -7.026
  410   1HB   LYS  59          2HB       LYS  59  -2.945   8.092  -9.230
  411   2HB   LYS  59          1HB       LYS  59  -4.036   9.462  -9.286
  412   1HG   LYS  59          2HG       LYS  59  -1.031   9.684  -9.238
  413   2HG   LYS  59          1HG       LYS  59  -2.014   9.701 -10.702
  414   1HD   LYS  59          2HD       LYS  59  -2.502  11.650  -8.477
  415   2HD   LYS  59          1HD       LYS  59  -1.260  11.942  -9.695
  416   1HE   LYS  59          2HE       LYS  59  -4.170  11.427 -10.269
  417   2HE   LYS  59          1HE       LYS  59  -3.408  13.018 -10.239
  418   1HZ   LYS  59          1HZ       LYS  59  -3.473  12.363 -12.483
  419   2HZ   LYS  59          2HZ       LYS  59  -2.916  10.799 -12.145
  420   3HZ   LYS  59          3HZ       LYS  59  -1.864  12.124 -11.998
  421    H    LYS  60           H        LYS  60  -2.512   8.128  -5.135
  422    HA   LYS  60           HA       LYS  60   0.078   7.153  -6.053
  423   1HB   LYS  60          2HB       LYS  60   0.403   9.361  -4.785
  424   2HB   LYS  60          1HB       LYS  60  -0.101   8.473  -3.351
  425   1HG   LYS  60          2HG       LYS  60   2.086   8.069  -3.105
  426   2HG   LYS  60          1HG       LYS  60   1.819   6.820  -4.322
  427   1HD   LYS  60          2HD       LYS  60   3.712   8.067  -5.022
  428   2HD   LYS  60          1HD       LYS  60   2.373   8.559  -6.063
  429   1HE   LYS  60          2HE       LYS  60   2.039  10.558  -4.723
  430   2HE   LYS  60          1HE       LYS  60   3.318  10.053  -3.620
  431   1HZ   LYS  60          1HZ       LYS  60   4.377  11.548  -5.000
  432   2HZ   LYS  60          2HZ       LYS  60   3.544  11.048  -6.386
  433   3HZ   LYS  60          3HZ       LYS  60   4.767  10.068  -5.734
  434    H    ILE  61           H        ILE  61   0.174   5.061  -5.604
  435    HA   ILE  61           HA       ILE  61  -0.862   4.115  -3.034
  436    HB   ILE  61           HB       ILE  61  -1.784   2.084  -4.036
  437   1HG1  ILE  61          2HG1      ILE  61  -1.085   3.395  -6.672
  438   2HG1  ILE  61          1HG1      ILE  61  -0.478   1.862  -6.050
  439   1HG2  ILE  61          1HG2      ILE  61  -2.908   4.626  -5.186
  440   2HG2  ILE  61          2HG2      ILE  61  -3.286   3.911  -3.619
  441   3HG2  ILE  61          3HG2      ILE  61  -3.765   3.086  -5.102
  442   1HD1  ILE  61          1HD1      ILE  61  -3.328   2.430  -6.830
  443   2HD1  ILE  61          2HD1      ILE  61  -2.700   0.895  -6.232
  444   3HD1  ILE  61          3HD1      ILE  61  -2.149   1.528  -7.783
  445    H    THR  62           H        THR  62   0.524   2.785  -2.007
  446    HA   THR  62           HA       THR  62   2.924   2.016  -3.473
  447    HB   THR  62           HB       THR  62   2.690   3.104  -0.984
  448    HG1  THR  62           1HG      THR  62   4.885   2.551  -0.788
  449   1HG2  THR  62          1HG2      THR  62   3.152   0.145  -0.559
  450   2HG2  THR  62          2HG2      THR  62   1.770   1.073   0.025
  451   3HG2  THR  62          3HG2      THR  62   3.385   1.408   0.649
  452    H    ASN  63           H        ASN  63   3.195   0.091  -4.215
  453    HA   ASN  63           HA       ASN  63   2.971  -2.384  -3.306
  454   1HB   ASN  63          2HB       ASN  63   0.663  -2.169  -2.624
  455   2HB   ASN  63          1HB       ASN  63   0.196  -1.598  -4.222
  456   1HD2  ASN  63          1HD2      ASN  63   1.144  -4.354  -2.323
  457   2HD2  ASN  63          2HD2      ASN  63   0.644  -5.552  -3.463
  458    HA   PRO  64           HA       PRO  64   2.066  -2.879  -7.892
  459   1HB   PRO  64          2HB       PRO  64   1.062  -0.659  -9.273
  460   2HB   PRO  64          1HB       PRO  64   0.109  -1.959  -8.555
  461   1HG   PRO  64          2HG       PRO  64   0.157   0.744  -7.753
  462   2HG   PRO  64          1HG       PRO  64  -0.599  -0.599  -6.884
  463   1HD   PRO  64          2HD       PRO  64   2.041   0.695  -6.462
  464   2HD   PRO  64          1HD       PRO  64   0.933  -0.027  -5.259
  465    H    PHE  65           H        PHE  65   2.887  -2.463 -10.074
  466    HA   PHE  65           HA       PHE  65   5.067  -0.502 -10.188
  467   1HB   PHE  65          2HB       PHE  65   6.464  -2.337 -11.285
  468   2HB   PHE  65          1HB       PHE  65   6.236  -2.466  -9.546
  469    HD1  PHE  65           1HD      PHE  65   4.987  -4.267  -8.587
  470    HD2  PHE  65           2HD      PHE  65   5.324  -3.880 -12.810
  471    HE1  PHE  65           1HE      PHE  65   4.126  -6.555  -8.863
  472    HE2  PHE  65           2HE      PHE  65   4.463  -6.166 -13.093
  473    HZ   PHE  65           HZ       PHE  65   3.861  -7.507 -11.117
  474    H    GLY  66           H        GLY  66   2.407  -0.562 -11.365
  475   1HA   GLY  66          2HA       GLY  66   2.756  -1.492 -14.101
  476   2HA   GLY  66          1HA       GLY  66   1.285  -0.848 -13.383
  477    H    GLY  67           H        GLY  67   3.285   1.359 -12.409
  478   1HA   GLY  67          2HA       GLY  67   3.431   2.886 -14.907
  479   2HA   GLY  67          1HA       GLY  67   2.486   3.537 -13.574
  480    H    GLU  68           H        GLU  68   3.548   5.065 -12.529
  481    HA   GLU  68           HA       GLU  68   6.454   5.092 -12.490
  482   1HB   GLU  68          2HB       GLU  68   4.471   6.955 -11.165
  483   2HB   GLU  68          1HB       GLU  68   6.194   7.249 -11.368
  484   1HG   GLU  68          2HG       GLU  68   4.283   6.918 -13.662
  485   2HG   GLU  68          1HG       GLU  68   4.708   8.476 -12.954
  486    H    LEU  69           H        LEU  69   7.142   3.483 -11.141
  487    HA   LEU  69           HA       LEU  69   6.064   3.446  -8.409
  488   1HB   LEU  69          2HB       LEU  69   6.829   1.192  -8.186
  489   2HB   LEU  69          1HB       LEU  69   5.912   1.321  -9.671
  490    HG   LEU  69           HG       LEU  69   8.859   1.607  -9.902
  491   1HD1  LEU  69          1HD1      LEU  69   7.516  -1.048  -9.408
  492   2HD1  LEU  69          2HD1      LEU  69   8.618  -0.233  -8.298
  493   3HD1  LEU  69          3HD1      LEU  69   9.202  -0.798  -9.863
  494   1HD2  LEU  69          1HD2      LEU  69   6.715   0.202 -11.497
  495   2HD2  LEU  69          2HD2      LEU  69   8.424   0.235 -11.924
  496   3HD2  LEU  69          3HD2      LEU  69   7.496   1.731 -11.895
  497    H    ASN  70           H        ASN  70   7.333   3.629  -6.652
  498    HA   ASN  70           HA       ASN  70  10.195   4.210  -7.067
  499   1HB   ASN  70          2HB       ASN  70   8.869   6.130  -6.194
  500   2HB   ASN  70          1HB       ASN  70   8.390   5.143  -4.816
  501   1HD2  ASN  70          1HD2      ASN  70   9.345   6.337  -3.240
  502   2HD2  ASN  70          2HD2      ASN  70  11.058   6.537  -3.096
  503    H    VAL  71           H        VAL  71  11.651   2.946  -5.969
  504    HA   VAL  71           HA       VAL  71  10.526   0.747  -4.411
  505    HB   VAL  71           HB       VAL  71  12.785  -0.267  -4.550
  506   1HG1  VAL  71          1HG1      VAL  71  11.615   0.589  -7.195
  507   2HG1  VAL  71          2HG1      VAL  71  11.100  -0.792  -6.228
  508   3HG1  VAL  71          3HG1      VAL  71  12.709  -0.771  -6.946
  509   1HG2  VAL  71          1HG2      VAL  71  13.434   2.124  -6.273
  510   2HG2  VAL  71          2HG2      VAL  71  14.457   0.704  -6.054
  511   3HG2  VAL  71          3HG2      VAL  71  14.121   1.770  -4.688
  512    H    GLY  72           H        GLY  72  10.661   0.590  -2.264
  513   1HA   GLY  72          2HA       GLY  72  12.867   1.793  -0.818
  514   2HA   GLY  72          1HA       GLY  72  11.296   2.518  -0.497
  515    HA   PRO  73           HA       PRO  73  11.449  -1.389   2.020
  516   1HB   PRO  73          2HB       PRO  73  13.538  -1.352   3.635
  517   2HB   PRO  73          1HB       PRO  73  13.754  -1.735   1.921
  518   1HG   PRO  73          2HG       PRO  73  14.461   0.732   3.406
  519   2HG   PRO  73          1HG       PRO  73  15.196   0.046   1.948
  520   1HD   PRO  73          2HD       PRO  73  13.187   2.114   2.141
  521   2HD   PRO  73          1HD       PRO  73  13.972   1.474   0.683
  522    H    ALA  74           H        ALA  74  11.183  -1.763   4.396
  523    HA   ALA  74           HA       ALA  74  10.287   0.661   5.777
  524   1HB   ALA  74          1HB       ALA  74   9.183  -0.861   7.336
  525   2HB   ALA  74          2HB       ALA  74   9.880  -2.243   6.490
  526   3HB   ALA  74          3HB       ALA  74   8.713  -1.204   5.671
  527    H    ASN  75           H        ASN  75  10.587  -0.187   8.425
  528    HA   ASN  75           HA       ASN  75  13.264   0.526   8.938
  529   1HB   ASN  75          2HB       ASN  75  11.459   0.967  10.538
  530   2HB   ASN  75          1HB       ASN  75  11.257  -0.762  10.799
  531   1HD2  ASN  75          1HD2      ASN  75  12.581  -1.808  12.198
  532   2HD2  ASN  75          2HD2      ASN  75  13.814  -1.019  13.127
  533    H    ASN  76           H        ASN  76  11.605  -2.608   9.224
  534    HA   ASN  76           HA       ASN  76  13.922  -3.983   8.309
  535   1HB   ASN  76          2HB       ASN  76  14.526  -3.581  10.712
  536   2HB   ASN  76          1HB       ASN  76  13.124  -4.537  11.177
  537   1HD2  ASN  76          1HD2      ASN  76  13.277  -6.713  11.194
  538   2HD2  ASN  76          2HD2      ASN  76  14.675  -7.599  10.672
  539    H    ASN  77           H        ASN  77  13.466  -6.104   7.710
  540    HA   ASN  77           HA       ASN  77  10.937  -6.443   6.629
  541   1HB   ASN  77          2HB       ASN  77  12.944  -7.479   5.713
  542   2HB   ASN  77          1HB       ASN  77  13.083  -8.511   7.129
  543   1HD2  ASN  77          1HD2      ASN  77  13.021 -10.360   5.893
  544   2HD2  ASN  77          2HD2      ASN  77  11.568 -10.940   5.162
  545    H    THR  78           H        THR  78  12.156  -7.566   9.706
  546    HA   THR  78           HA       THR  78  10.335  -9.569  10.321
  547    HB   THR  78           HB       THR  78  10.709  -8.829  12.734
  548    HG1  THR  78           1HG      THR  78  11.750  -7.008  13.070
  549   1HG2  THR  78          1HG2      THR  78  12.050 -10.574  11.688
  550   2HG2  THR  78          2HG2      THR  78  13.063  -9.563  12.718
  551   3HG2  THR  78          3HG2      THR  78  13.103  -9.360  10.967
  552    H    ALA  79           H        ALA  79   9.908  -6.083  10.400
  553    HA   ALA  79           HA       ALA  79   7.213  -6.418  11.509
  554   1HB   ALA  79          1HB       ALA  79   8.789  -3.903  10.953
  555   2HB   ALA  79          2HB       ALA  79   8.576  -4.670  12.527
  556   3HB   ALA  79          3HB       ALA  79   7.188  -3.968  11.693
  557    H    PHE  80           H        PHE  80   8.657  -4.396   8.974
  558    HA   PHE  80           HA       PHE  80   6.687  -5.405   7.059
  559   1HB   PHE  80          2HB       PHE  80   7.437  -2.477   7.220
  560   2HB   PHE  80          1HB       PHE  80   6.208  -3.209   6.203
  561    HD1  PHE  80           1HD      PHE  80   6.971  -1.818   9.443
  562    HD2  PHE  80           2HD      PHE  80   4.116  -4.061   7.226
  563    HE1  PHE  80           1HE      PHE  80   5.282  -1.366  11.173
  564    HE2  PHE  80           2HE      PHE  80   2.418  -3.610   8.949
  565    HZ   PHE  80           HZ       PHE  80   3.001  -2.262  10.926
  566    H    GLY  81           H        GLY  81   7.496  -5.314   4.859
  567   1HA   GLY  81          2HA       GLY  81  10.402  -5.581   4.928
  568   2HA   GLY  81          1HA       GLY  81   9.335  -6.252   3.708
  569    H    TYR  82           H        TYR  82   8.142  -4.503   2.409
  570    HA   TYR  82           HA       TYR  82   9.902  -2.290   1.741
  571   1HB   TYR  82          2HB       TYR  82   9.875  -3.223  -0.703
  572   2HB   TYR  82          1HB       TYR  82  11.045  -3.866   0.449
  573    HD1  TYR  82           1HD      TYR  82  10.888  -6.106   1.257
  574    HD2  TYR  82           2HD      TYR  82   7.911  -4.582  -1.372
  575    HE1  TYR  82           1HE      TYR  82  10.022  -8.379   0.945
  576    HE2  TYR  82           2HE      TYR  82   7.032  -6.863  -1.694
  577    HH   TYR  82           HH       TYR  82   8.025  -9.275  -1.484
  578    H    TYR  83           H        TYR  83   9.005  -0.881   0.160
  579    HA   TYR  83           HA       TYR  83   6.185  -1.325  -0.470
  580   1HB   TYR  83          2HB       TYR  83   5.745   1.080  -0.079
  581   2HB   TYR  83          1HB       TYR  83   6.198   0.226   1.387
  582    HD1  TYR  83           1HD      TYR  83   8.043   0.959   2.686
  583    HD2  TYR  83           2HD      TYR  83   7.481   2.514  -1.235
  584    HE1  TYR  83           1HE      TYR  83   9.822   2.609   3.090
  585    HE2  TYR  83           2HE      TYR  83   9.253   4.167  -0.839
  586    HH   TYR  83           HH       TYR  83  10.426   5.229   0.890
  587    H    LEU  84           H        LEU  84   5.497  -0.452  -2.408
  588    HA   LEU  84           HA       LEU  84   7.591   0.668  -4.143
  589   1HB   LEU  84          2HB       LEU  84   5.344  -1.216  -4.903
  590   2HB   LEU  84          1HB       LEU  84   6.364  -0.390  -6.055
  591    HG   LEU  84           HG       LEU  84   7.191  -2.578  -5.949
  592   1HD1  LEU  84          1HD1      LEU  84   8.955  -0.939  -5.927
  593   2HD1  LEU  84          2HD1      LEU  84   9.431  -2.352  -4.983
  594   3HD1  LEU  84          3HD1      LEU  84   8.915  -0.877  -4.164
  595   1HD2  LEU  84          1HD2      LEU  84   6.055  -3.330  -3.946
  596   2HD2  LEU  84          2HD2      LEU  84   7.144  -2.371  -2.942
  597   3HD2  LEU  84          3HD2      LEU  84   7.769  -3.734  -3.870
  598    H    THR  85           H        THR  85   7.009   2.815  -3.843
  599    HA   THR  85           HA       THR  85   4.220   3.505  -3.682
  600    HB   THR  85           HB       THR  85   6.315   5.627  -3.817
  601    HG1  THR  85           1HG      THR  85   6.029   4.582  -1.292
  602   1HG2  THR  85          1HG2      THR  85   3.963   6.180  -3.450
  603   2HG2  THR  85          2HG2      THR  85   4.934   6.574  -2.031
  604   3HG2  THR  85          3HG2      THR  85   3.930   5.126  -2.037
  605    H    LEU  86           H        LEU  86   3.118   3.596  -5.462
  606    HA   LEU  86           HA       LEU  86   4.400   4.639  -7.893
  607   1HB   LEU  86          2HB       LEU  86   3.919   2.269  -7.999
  608   2HB   LEU  86          1HB       LEU  86   2.269   2.554  -7.504
  609    HG   LEU  86           HG       LEU  86   3.038   3.944  -9.970
  610   1HD1  LEU  86          1HD1      LEU  86   2.870   0.939  -9.848
  611   2HD1  LEU  86          2HD1      LEU  86   4.306   1.885 -10.240
  612   3HD1  LEU  86          3HD1      LEU  86   2.912   1.910 -11.319
  613   1HD2  LEU  86          1HD2      LEU  86   0.748   2.162  -9.141
  614   2HD2  LEU  86          2HD2      LEU  86   0.855   3.028 -10.674
  615   3HD2  LEU  86          3HD2      LEU  86   0.753   3.926  -9.158
  616    H    THR  87           H        THR  87   3.329   6.203  -9.080
  617    HA   THR  87           HA       THR  87   1.008   7.399  -7.812
  618    HB   THR  87           HB       THR  87   1.175   9.063  -9.675
  619    HG1  THR  87           1HG      THR  87   2.216   7.530 -11.146
  620   1HG2  THR  87          1HG2      THR  87   3.279  10.081  -8.928
  621   2HG2  THR  87          2HG2      THR  87   3.732   8.564  -8.151
  622   3HG2  THR  87          3HG2      THR  87   2.337   9.470  -7.569
  623    H    ARG  88           H        ARG  88  -0.952   6.793  -8.269
  624    HA   ARG  88           HA       ARG  88  -2.330   6.814 -10.552
  625   1HB   ARG  88          2HB       ARG  88  -0.626   4.852 -11.195
  626   2HB   ARG  88          1HB       ARG  88  -1.737   3.889 -10.231
  627   1HG   ARG  88          2HG       ARG  88  -3.568   4.397 -11.653
  628   2HG   ARG  88          1HG       ARG  88  -2.630   5.608 -12.528
  629   1HD   ARG  88          2HD       ARG  88  -2.732   3.633 -13.867
  630   2HD   ARG  88          1HD       ARG  88  -1.090   3.793 -13.248
  631    HE   ARG  88           HE       ARG  88  -3.100   1.956 -12.102
  632   1HH1  ARG  88          1HH1      ARG  88   0.232   2.791 -12.842
  633   2HH1  ARG  88          2HH1      ARG  88   0.827   1.188 -12.538
  634   1HH2  ARG  88          1HH2      ARG  88  -2.337  -0.132 -11.712
  635   2HH2  ARG  88          2HH2      ARG  88  -0.659  -0.516 -11.939
  636    H    LEU  89           H        LEU  89  -4.447   6.560 -10.016
  637    HA   LEU  89           HA       LEU  89  -5.299   4.538  -8.182
  638   1HB   LEU  89          2HB       LEU  89  -4.398   6.444  -6.727
  639   2HB   LEU  89          1HB       LEU  89  -5.773   7.375  -7.280
  640    HG   LEU  89           HG       LEU  89  -5.973   6.241  -5.009
  641   1HD1  LEU  89          1HD1      LEU  89  -8.074   5.671  -7.079
  642   2HD1  LEU  89          2HD1      LEU  89  -7.899   7.154  -6.141
  643   3HD1  LEU  89          3HD1      LEU  89  -8.313   5.641  -5.333
  644   1HD2  LEU  89          1HD2      LEU  89  -6.731   3.885  -5.075
  645   2HD2  LEU  89          2HD2      LEU  89  -5.035   4.101  -5.505
  646   3HD2  LEU  89          3HD2      LEU  89  -6.231   3.812  -6.765
  647    H    ASP  90           H        ASP  90  -7.511   4.249  -8.183
  648    HA   ASP  90           HA       ASP  90  -9.097   5.825 -10.067
  649   1HB   ASP  90          2HB       ASP  90  -9.084   2.795 -10.070
  650   2HB   ASP  90          1HB       ASP  90  -9.911   3.858 -11.200
  651    H    LYS  91           H        LYS  91 -11.351   5.762  -9.532
  652    HA   LYS  91           HA       LYS  91 -11.887   5.282  -6.785
  653   1HB   LYS  91          2HB       LYS  91 -13.059   6.912  -8.449
  654   2HB   LYS  91          1HB       LYS  91 -14.048   5.517  -8.860
  655   1HG   LYS  91          2HG       LYS  91 -13.738   6.433  -6.023
  656   2HG   LYS  91          1HG       LYS  91 -14.928   7.156  -7.104
  657   1HD   LYS  91          2HD       LYS  91 -16.030   5.053  -7.402
  658   2HD   LYS  91          1HD       LYS  91 -14.745   4.201  -6.543
  659   1HE   LYS  91          2HE       LYS  91 -16.780   4.546  -5.175
  660   2HE   LYS  91          1HE       LYS  91 -15.336   5.275  -4.479
  661   1HZ   LYS  91          1HZ       LYS  91 -17.352   6.766  -6.071
  662   2HZ   LYS  91          2HZ       LYS  91 -16.045   7.418  -5.217
  663   3HZ   LYS  91          3HZ       LYS  91 -17.330   6.704  -4.375
  664    H    ALA  92           H        ALA  92 -12.460   3.501  -9.758
  665    HA   ALA  92           HA       ALA  92 -13.910   1.350  -8.661
  666   1HB   ALA  92          1HB       ALA  92 -13.289   0.125 -10.667
  667   2HB   ALA  92          2HB       ALA  92 -12.034   1.310 -11.025
  668   3HB   ALA  92          3HB       ALA  92 -13.733   1.781 -11.080
  669    H    ALA  93           H        ALA  93 -10.457   1.987  -8.966
  670    HA   ALA  93           HA       ALA  93  -9.549  -0.530  -8.017
  671   1HB   ALA  93          1HB       ALA  93  -8.135   2.139  -7.895
  672   2HB   ALA  93          2HB       ALA  93  -8.110   1.033  -9.271
  673   3HB   ALA  93          3HB       ALA  93  -7.389   0.547  -7.736
  674    H    CYS  94           H        CYS  94 -10.333   2.525  -6.484
  675    HA   CYS  94           HA       CYS  94  -9.496   2.020  -3.883
  676   1HB   CYS  94          2HB       CYS  94 -10.199   4.213  -4.460
  677   2HB   CYS  94          1HB       CYS  94 -11.769   3.645  -5.014
  678    H    VAL  95           H        VAL  95 -12.670   1.352  -5.376
  679    HA   VAL  95           HA       VAL  95 -13.739   0.107  -3.070
  680    HB   VAL  95           HB       VAL  95 -14.635  -0.231  -5.933
  681   1HG1  VAL  95          1HG1      VAL  95 -16.814  -0.791  -4.950
  682   2HG1  VAL  95          2HG1      VAL  95 -16.105  -0.688  -3.339
  683   3HG1  VAL  95          3HG1      VAL  95 -15.561  -1.933  -4.465
  684   1HG2  VAL  95          1HG2      VAL  95 -16.253   1.544  -5.441
  685   2HG2  VAL  95          2HG2      VAL  95 -14.591   2.116  -5.306
  686   3HG2  VAL  95          3HG2      VAL  95 -15.521   1.762  -3.852
  687    H    SER  96           H        SER  96 -11.937  -1.035  -5.793
  688    HA   SER  96           HA       SER  96 -12.323  -3.791  -5.499
  689   1HB   SER  96          2HB       SER  96 -10.038  -2.147  -6.553
  690   2HB   SER  96          1HB       SER  96 -10.078  -3.909  -6.666
  691    HG   SER  96           HG       SER  96 -11.883  -2.038  -7.818
  692    H    LEU  97           H        LEU  97 -10.158  -1.554  -3.874
  693    HA   LEU  97           HA       LEU  97  -8.674  -3.687  -2.603
  694   1HB   LEU  97          2HB       LEU  97  -8.534  -0.688  -2.327
  695   2HB   LEU  97          1HB       LEU  97  -7.452  -1.809  -1.518
  696    HG   LEU  97           HG       LEU  97  -7.737  -1.662  -4.518
  697   1HD1  LEU  97          1HD1      LEU  97  -5.669  -0.363  -2.743
  698   2HD1  LEU  97          2HD1      LEU  97  -6.904   0.472  -3.685
  699   3HD1  LEU  97          3HD1      LEU  97  -5.624  -0.422  -4.505
  700   1HD2  LEU  97          1HD2      LEU  97  -5.659  -2.922  -2.730
  701   2HD2  LEU  97          2HD2      LEU  97  -5.616  -2.879  -4.491
  702   3HD2  LEU  97          3HD2      LEU  97  -6.886  -3.776  -3.662
  703    H    ALA  98           H        ALA  98 -11.415  -1.747  -1.906
  704    HA   ALA  98           HA       ALA  98 -11.339  -2.251   0.941
  705   1HB   ALA  98          1HB       ALA  98 -13.538  -1.123  -0.778
  706   2HB   ALA  98          2HB       ALA  98 -12.324  -0.192   0.096
  707   3HB   ALA  98          3HB       ALA  98 -13.509  -1.146   0.985
  708    H    THR  99           H        THR  99 -12.655  -3.688  -1.913
  709    HA   THR  99           HA       THR  99 -14.257  -5.577  -0.380
  710    HB   THR  99           HB       THR  99 -14.808  -6.512  -2.672
  711    HG1  THR  99           1HG      THR  99 -13.693  -4.091  -3.653
  712   1HG2  THR  99          1HG2      THR  99 -16.317  -4.966  -1.536
  713   2HG2  THR  99          2HG2      THR  99 -16.308  -4.663  -3.274
  714   3HG2  THR  99          3HG2      THR  99 -15.421  -3.595  -2.188
  715    H    LEU 100           H        LEU 100 -11.121  -5.204  -1.303
  716    HA   LEU 100           HA       LEU 100 -10.523  -8.024  -1.727
  717   1HB   LEU 100          2HB       LEU 100  -9.377  -5.792  -2.719
  718   2HB   LEU 100          1HB       LEU 100  -8.390  -5.995  -1.281
  719    HG   LEU 100           HG       LEU 100  -8.750  -8.174  -3.345
  720   1HD1  LEU 100          1HD1      LEU 100  -7.761  -6.209  -4.404
  721   2HD1  LEU 100          2HD1      LEU 100  -6.569  -7.494  -4.216
  722   3HD1  LEU 100          3HD1      LEU 100  -6.556  -6.114  -3.121
  723   1HD2  LEU 100          1HD2      LEU 100  -6.681  -7.733  -1.188
  724   2HD2  LEU 100          2HD2      LEU 100  -6.719  -9.074  -2.336
  725   3HD2  LEU 100          3HD2      LEU 100  -7.997  -8.907  -1.133
  726    H    ASN 101           H        ASN 101  -9.768  -9.337  -0.101
  727    HA   ASN 101           HA       ASN 101  -9.942  -8.290   2.565
  728   1HB   ASN 101          2HB       ASN 101 -10.646 -10.615   1.959
  729   2HB   ASN 101          1HB       ASN 101  -8.945 -11.021   1.730
  730   1HD2  ASN 101          1HD2      ASN 101 -10.206  -8.850   4.184
  731   2HD2  ASN 101          2HD2      ASN 101  -9.791  -9.846   5.540
  732    H    LEU 102           H        LEU 102  -8.319  -6.693   2.447
  733    HA   LEU 102           HA       LEU 102  -5.558  -7.566   2.244
  734   1HB   LEU 102          2HB       LEU 102  -6.774  -4.839   2.697
  735   2HB   LEU 102          1HB       LEU 102  -5.048  -5.142   2.618
  736    HG   LEU 102           HG       LEU 102  -7.013  -5.621   0.372
  737   1HD1  LEU 102          1HD1      LEU 102  -6.661  -3.252   0.790
  738   2HD1  LEU 102          2HD1      LEU 102  -5.870  -3.741  -0.709
  739   3HD1  LEU 102          3HD1      LEU 102  -4.915  -3.489   0.753
  740   1HD2  LEU 102          1HD2      LEU 102  -4.003  -5.830   0.414
  741   2HD2  LEU 102          2HD2      LEU 102  -5.049  -6.061  -0.987
  742   3HD2  LEU 102          3HD2      LEU 102  -5.124  -7.191   0.363
  743    H    GLY 103           H        GLY 103  -5.951  -8.984   4.064
  744   1HA   GLY 103          2HA       GLY 103  -4.898  -7.676   6.458
  745   2HA   GLY 103          1HA       GLY 103  -6.349  -8.656   6.643
  746    H    THR 104           H        THR 104  -5.887 -10.745   4.997
  747    HA   THR 104           HA       THR 104  -4.052 -12.340   6.435
  748    HB   THR 104           HB       THR 104  -5.311 -12.936   3.756
  749    HG1  THR 104           1HG      THR 104  -7.030 -13.781   4.980
  750   1HG2  THR 104          1HG2      THR 104  -5.134 -15.284   4.510
  751   2HG2  THR 104          2HG2      THR 104  -4.273 -14.741   5.950
  752   3HG2  THR 104          3HG2      THR 104  -3.554 -14.516   4.355
  753    H    SER 105           H        SER 105  -3.961 -11.057   3.102
  754    HA   SER 105           HA       SER 105  -1.147 -11.857   2.969
  755   1HB   SER 105          2HB       SER 105  -2.956 -10.949   0.722
  756   2HB   SER 105          1HB       SER 105  -1.360 -11.688   0.568
  757    HG   SER 105           HG       SER 105  -2.376 -13.519   0.571
  758    H    ALA 106           H        ALA 106  -2.262  -9.429   4.360
  759    HA   ALA 106           HA       ALA 106  -0.567  -7.467   2.966
  760   1HB   ALA 106          1HB       ALA 106  -3.154  -6.848   4.388
  761   2HB   ALA 106          2HB       ALA 106  -2.933  -6.891   2.640
  762   3HB   ALA 106          3HB       ALA 106  -2.086  -5.683   3.606
  763    H    LYS 107           H        LYS 107   0.798  -6.270   4.235
  764    HA   LYS 107           HA       LYS 107   1.189  -7.093   6.963
  765   1HB   LYS 107          2HB       LYS 107   2.674  -5.533   5.000
  766   2HB   LYS 107          1HB       LYS 107   2.653  -4.730   6.559
  767   1HG   LYS 107          2HG       LYS 107   4.587  -5.999   6.597
  768   2HG   LYS 107          1HG       LYS 107   3.436  -6.961   7.519
  769   1HD   LYS 107          2HD       LYS 107   3.138  -8.485   5.743
  770   2HD   LYS 107          1HD       LYS 107   3.924  -7.409   4.586
  771   1HE   LYS 107          2HE       LYS 107   6.052  -7.704   5.724
  772   2HE   LYS 107          1HE       LYS 107   5.282  -8.715   6.942
  773   1HZ   LYS 107          1HZ       LYS 107   5.327  -9.417   4.051
  774   2HZ   LYS 107          2HZ       LYS 107   4.897 -10.408   5.361
  775   3HZ   LYS 107          3HZ       LYS 107   6.510  -9.927   5.159
  776    H    GLY 108           H        GLY 108  -0.290  -4.472   5.215
  777   1HA   GLY 108          2HA       GLY 108  -2.123  -3.712   7.092
  778   2HA   GLY 108          1HA       GLY 108  -0.706  -2.748   7.467
  779    H    TYR 109           H        TYR 109  -3.483  -2.291   6.224
  780    HA   TYR 109           HA       TYR 109  -2.535  -0.854   3.836
  781   1HB   TYR 109          2HB       TYR 109  -4.152  -2.546   3.267
  782   2HB   TYR 109          1HB       TYR 109  -5.242  -2.003   4.538
  783    HD1  TYR 109           1HD      TYR 109  -3.541   0.464   2.485
  784    HD2  TYR 109           2HD      TYR 109  -7.071  -1.856   2.915
  785    HE1  TYR 109           1HE      TYR 109  -4.676   1.919   0.860
  786    HE2  TYR 109           2HE      TYR 109  -8.228  -0.402   1.288
  787    HH   TYR 109           HH       TYR 109  -8.028   1.881   0.388
  788    H    GLY 110           H        GLY 110  -2.485   1.319   3.985
  789   1HA   GLY 110          2HA       GLY 110  -4.229   2.583   6.003
  790   2HA   GLY 110          1HA       GLY 110  -2.521   2.985   5.898
  791    H    VAL 111           H        VAL 111  -4.435   4.949   5.722
  792    HA   VAL 111           HA       VAL 111  -4.118   5.756   2.919
  793    HB   VAL 111           HB       VAL 111  -6.158   7.078   3.114
  794   1HG1  VAL 111          1HG1      VAL 111  -6.580   4.187   3.819
  795   2HG1  VAL 111          2HG1      VAL 111  -6.297   4.835   2.203
  796   3HG1  VAL 111          3HG1      VAL 111  -7.773   5.252   3.073
  797   1HG2  VAL 111          1HG2      VAL 111  -6.458   5.804   5.822
  798   2HG2  VAL 111          2HG2      VAL 111  -7.703   6.742   4.997
  799   3HG2  VAL 111          3HG2      VAL 111  -6.196   7.517   5.488
  800    H    ASN 112           H        ASN 112  -3.155   7.642   2.572
  801    HA   ASN 112           HA       ASN 112  -2.102   9.622   2.909
  802   1HB   ASN 112          2HB       ASN 112  -4.131   9.779   5.131
  803   2HB   ASN 112          1HB       ASN 112  -2.994  11.083   4.808
  804   1HD2  ASN 112          1HD2      ASN 112  -5.833   9.426   3.736
  805   2HD2  ASN 112          2HD2      ASN 112  -6.234  10.518   2.458
  806    H    ILE 113           H        ILE 113  -1.184   7.114   4.360
  807    HA   ILE 113           HA       ILE 113   0.167   8.141   6.683
  808    HB   ILE 113           HB       ILE 113   0.221   5.514   5.245
  809   1HG1  ILE 113          2HG1      ILE 113  -0.104   4.695   7.610
  810   2HG1  ILE 113          1HG1      ILE 113  -0.203   6.378   8.110
  811   1HG2  ILE 113          1HG2      ILE 113   2.056   4.714   6.672
  812   2HG2  ILE 113          2HG2      ILE 113   2.293   6.354   7.275
  813   3HG2  ILE 113          3HG2      ILE 113   2.587   5.989   5.575
  814   1HD1  ILE 113          1HD1      ILE 113  -2.056   4.998   6.190
  815   2HD1  ILE 113          2HD1      ILE 113  -2.169   6.678   6.711
  816   3HD1  ILE 113          3HD1      ILE 113  -2.397   5.377   7.878
  817    H    SER 114           H        SER 114   1.706   9.594   6.467
  818    HA   SER 114           HA       SER 114   3.594   9.366   4.239
  819   1HB   SER 114          2HB       SER 114   2.425  11.580   4.777
  820   2HB   SER 114          1HB       SER 114   3.428  11.639   6.227
  821    HG   SER 114           HG       SER 114   4.976  12.366   5.027
  822    H    GLY 115           H        GLY 115   4.972   7.798   4.846
  823   1HA   GLY 115          2HA       GLY 115   7.164   7.878   6.248
  824   2HA   GLY 115          1HA       GLY 115   6.024   7.790   7.586
  825    H    GLU 116           H        GLU 116   6.503   6.156   4.462
  826    HA   GLU 116           HA       GLU 116   5.175   3.816   5.216
  827   1HB   GLU 116          2HB       GLU 116   7.209   4.296   3.045
  828   2HB   GLU 116          1HB       GLU 116   6.195   2.871   3.180
  829   1HG   GLU 116          2HG       GLU 116   4.205   4.361   3.015
  830   2HG   GLU 116          1HG       GLU 116   5.311   5.692   2.674
  831    H    ASN 117           H        ASN 117   8.480   4.831   5.618
  832    HA   ASN 117           HA       ASN 117   9.776   2.431   6.048
  833   1HB   ASN 117          2HB       ASN 117  10.171   5.205   7.031
  834   2HB   ASN 117          1HB       ASN 117  11.039   3.926   7.874
  835   1HD2  ASN 117          1HD2      ASN 117  12.710   2.893   6.871
  836   2HD2  ASN 117          2HD2      ASN 117  13.341   3.381   5.338
  837    H    ASN 118           H        ASN 118   7.579   4.148   8.165
  838    HA   ASN 118           HA       ASN 118   7.176   1.702   9.615
  839   1HB   ASN 118          2HB       ASN 118   7.429   2.728  11.861
  840   2HB   ASN 118          1HB       ASN 118   8.944   2.601  10.982
  841   1HD2  ASN 118          1HD2      ASN 118   9.986   4.470  10.300
  842   2HD2  ASN 118          2HD2      ASN 118   9.557   6.031  10.923
  843    H    ILE 119           H        ILE 119   5.219   1.850   8.526
  844    HA   ILE 119           HA       ILE 119   3.407   3.959   8.629
  845    HB   ILE 119           HB       ILE 119   3.193   2.097   7.061
  846   1HG1  ILE 119          2HG1      ILE 119   0.767   2.265   8.865
  847   2HG1  ILE 119          1HG1      ILE 119   1.188   3.449   7.633
  848   1HG2  ILE 119          1HG2      ILE 119   2.342  -0.080   7.772
  849   2HG2  ILE 119          2HG2      ILE 119   2.412   0.440   9.455
  850   3HG2  ILE 119          3HG2      ILE 119   3.897   0.283   8.518
  851   1HD1  ILE 119          1HD1      ILE 119  -0.550   1.934   6.864
  852   2HD1  ILE 119          2HD1      ILE 119   0.518   0.557   7.133
  853   3HD1  ILE 119          3HD1      ILE 119   0.918   1.756   5.904
  854    H    THR 120           H        THR 120   1.485   4.243   9.864
  855    HA   THR 120           HA       THR 120   1.959   3.988  12.654
  856    HB   THR 120           HB       THR 120  -0.335   5.056  12.823
  857    HG1  THR 120           1HG      THR 120  -1.501   5.045  11.065
  858   1HG2  THR 120          1HG2      THR 120   0.444   7.227  11.994
  859   2HG2  THR 120          2HG2      THR 120   1.727   6.426  11.085
  860   3HG2  THR 120          3HG2      THR 120   1.729   6.373  12.848
  861    H    SER 121           H        SER 121   0.038   3.344  14.109
  862    HA   SER 121           HA       SER 121  -0.372   0.589  13.919
  863   1HB   SER 121          2HB       SER 121  -2.179   1.112  15.717
  864   2HB   SER 121          1HB       SER 121  -0.487   1.449  16.083
  865    HG   SER 121           HG       SER 121  -1.318   3.343  16.569
  866    H    PHE 122           H        PHE 122  -2.438  -0.557  13.817
  867    HA   PHE 122           HA       PHE 122  -3.996   0.512  11.561
  868   1HB   PHE 122          2HB       PHE 122  -3.591  -2.379  12.349
  869   2HB   PHE 122          1HB       PHE 122  -4.335  -1.781  10.871
  870    HD1  PHE 122           1HD      PHE 122  -2.910  -0.530   9.223
  871    HD2  PHE 122           2HD      PHE 122  -1.272  -2.697  12.495
  872    HE1  PHE 122           1HE      PHE 122  -0.726  -0.580   8.092
  873    HE2  PHE 122           2HE      PHE 122   0.915  -2.749  11.373
  874    HZ   PHE 122           HZ       PHE 122   1.206  -1.662   9.199
  875    H    GLY 123           H        GLY 123  -6.194   0.249  11.480
  876   1HA   GLY 123          2HA       GLY 123  -7.542  -0.861  13.849
  877   2HA   GLY 123          1HA       GLY 123  -7.976   0.743  13.268
  878    H    ASN 124           H        ASN 124  -9.958   0.529  12.403
  879    HA   ASN 124           HA       ASN 124 -10.239  -1.283  10.127
  880   1HB   ASN 124          2HB       ASN 124 -12.003  -1.276  12.560
  881   2HB   ASN 124          1HB       ASN 124 -12.658  -1.724  10.991
  882   1HD2  ASN 124          1HD2      ASN 124 -11.863  -3.584   9.957
  883   2HD2  ASN 124          2HD2      ASN 124 -11.068  -4.834  10.845
  884    H    SER 125           H        SER 125  -9.827   1.512  10.210
  885    HA   SER 125           HA       SER 125 -12.048   2.345   8.583
  886   1HB   SER 125          2HB       SER 125 -12.804   2.833  10.963
  887   2HB   SER 125          1HB       SER 125 -11.465   3.981  11.065
  888    HG   SER 125           HG       SER 125 -13.208   4.180   8.884
  889    H    ALA 126           H        ALA 126 -11.032   3.250   6.927
  890    HA   ALA 126           HA       ALA 126  -8.430   4.458   7.334
  891   1HB   ALA 126          1HB       ALA 126  -8.822   2.979   5.429
  892   2HB   ALA 126          2HB       ALA 126  -8.336   4.596   4.917
  893   3HB   ALA 126          3HB       ALA 126 -10.028   4.108   4.809
  894    H    ASP 127           H        ASP 127  -8.553   6.413   8.229
  895    HA   ASP 127           HA       ASP 127  -9.363   8.571   6.517
  896   1HB   ASP 127          2HB       ASP 127 -11.473   8.221   7.725
  897   2HB   ASP 127          1HB       ASP 127 -10.621   8.310   9.262
  898    H    GLN 128           H        GLN 128  -7.282   9.198   6.441
  899    HA   GLN 128           HA       GLN 128  -5.180   9.827   7.054
  900   1HB   GLN 128          2HB       GLN 128  -6.639  10.773   9.526
  901   2HB   GLN 128          1HB       GLN 128  -4.957  11.142   9.173
  902   1HG   GLN 128          2HG       GLN 128  -5.640  12.327   7.152
  903   2HG   GLN 128          1HG       GLN 128  -7.328  11.948   7.497
  904   1HE2  GLN 128          1HE2      GLN 128  -4.556  13.819   8.450
  905   2HE2  GLN 128          2HE2      GLN 128  -5.402  14.922   9.479
  906    H    ALA 129           H        ALA 129  -6.348   7.169   7.911
  907    HA   ALA 129           HA       ALA 129  -4.340   6.466   9.914
  908   1HB   ALA 129          1HB       ALA 129  -6.454   6.951  11.108
  909   2HB   ALA 129          2HB       ALA 129  -5.945   5.270  11.271
  910   3HB   ALA 129          3HB       ALA 129  -7.249   5.690  10.161
  911    H    ALA 130           H        ALA 130  -4.194   4.071  10.189
  912    HA   ALA 130           HA       ALA 130  -4.609   2.728   7.605
  913   1HB   ALA 130          1HB       ALA 130  -2.709   2.042   9.849
  914   2HB   ALA 130          2HB       ALA 130  -2.282   2.881   8.358
  915   3HB   ALA 130          3HB       ALA 130  -2.831   1.206   8.301
  916    H    LYS 131           H        LYS 131  -5.229   0.447   7.672
  917    HA   LYS 131           HA       LYS 131  -6.604  -0.330  10.146
  918   1HB   LYS 131          2HB       LYS 131  -8.566  -0.924   9.098
  919   2HB   LYS 131          1HB       LYS 131  -8.108   0.486   8.150
  920   1HG   LYS 131          2HG       LYS 131  -7.210  -2.195   7.227
  921   2HG   LYS 131          1HG       LYS 131  -8.903  -1.753   7.019
  922   1HD   LYS 131          2HD       LYS 131  -6.540  -0.172   6.012
  923   2HD   LYS 131          1HD       LYS 131  -7.563  -1.233   5.037
  924   1HE   LYS 131          2HE       LYS 131  -9.511   0.208   5.871
  925   2HE   LYS 131          1HE       LYS 131  -8.276   1.360   6.373
  926   1HZ   LYS 131          1HZ       LYS 131  -8.623   0.345   3.608
  927   2HZ   LYS 131          2HZ       LYS 131  -7.532   1.533   4.110
  928   3HZ   LYS 131          3HZ       LYS 131  -9.198   1.834   4.172
  929    H    SER 132           H        SER 132  -6.848  -2.643  10.417
  930    HA   SER 132           HA       SER 132  -4.441  -3.952   9.456
  931   1HB   SER 132          2HB       SER 132  -5.054  -5.681  11.172
  932   2HB   SER 132          1HB       SER 132  -4.830  -4.059  11.824
  933    HG   SER 132           HG       SER 132  -6.737  -5.177  12.589
  934    H    THR 133           H        THR 133  -7.784  -3.955   8.758
  935    HA   THR 133           HA       THR 133  -7.408  -6.168   6.910
  936    HB   THR 133           HB       THR 133  -9.808  -6.923   7.707
  937    HG1  THR 133           1HG      THR 133  -8.713  -5.509   9.879
  938   1HG2  THR 133          1HG2      THR 133  -8.747  -8.656   9.118
  939   2HG2  THR 133          2HG2      THR 133  -7.246  -7.728   9.097
  940   3HG2  THR 133          3HG2      THR 133  -7.885  -8.406   7.599
  941    H    ALA 134           H        ALA 134  -8.612  -6.028   5.101
  942    HA   ALA 134           HA       ALA 134 -10.692  -3.948   5.000
  943   1HB   ALA 134          1HB       ALA 134  -8.808  -4.772   2.786
  944   2HB   ALA 134          2HB       ALA 134  -8.746  -3.263   3.694
  945   3HB   ALA 134          3HB       ALA 134 -10.118  -3.601   2.640
  946    H    ILE 135           H        ILE 135 -12.628  -4.611   4.367
  947    HA   ILE 135           HA       ILE 135 -13.227  -6.582   2.480
  948    HB   ILE 135           HB       ILE 135 -12.287  -8.032   4.366
  949   1HG1  ILE 135          2HG1      ILE 135 -14.141  -9.722   4.186
  950   2HG1  ILE 135          1HG1      ILE 135 -15.100  -8.495   3.362
  951   1HG2  ILE 135          1HG2      ILE 135 -13.252  -6.852   6.246
  952   2HG2  ILE 135          2HG2      ILE 135 -13.779  -8.535   6.238
  953   3HG2  ILE 135          3HG2      ILE 135 -14.876  -7.263   5.696
  954   1HD1  ILE 135          1HD1      ILE 135 -12.452  -9.571   2.421
  955   2HD1  ILE 135          2HD1      ILE 135 -13.451  -8.378   1.587
  956   3HD1  ILE 135          3HD1      ILE 135 -14.037 -10.029   1.795
  957    H    THR 136           H        THR 136 -13.938  -3.977   4.028
  958    HA   THR 136           HA       THR 136 -16.772  -4.531   4.599
  959    HB   THR 136           HB       THR 136 -14.976  -2.466   5.898
  960    HG1  THR 136           1HG      THR 136 -14.733  -3.886   7.514
  961   1HG2  THR 136          1HG2      THR 136 -16.818  -2.163   7.479
  962   2HG2  THR 136          2HG2      THR 136 -17.796  -3.316   6.571
  963   3HG2  THR 136          3HG2      THR 136 -17.329  -1.783   5.834
  964    HA   PRO 137           HA       PRO 137 -17.744  -1.530   1.388
  965   1HB   PRO 137          2HB       PRO 137 -20.295  -1.407   2.904
  966   2HB   PRO 137          1HB       PRO 137 -20.020  -1.719   1.186
  967   1HG   PRO 137          2HG       PRO 137 -20.712  -3.691   2.837
  968   2HG   PRO 137          1HG       PRO 137 -19.539  -3.961   1.534
  969   1HD   PRO 137          2HD       PRO 137 -19.068  -3.583   4.466
  970   2HD   PRO 137          1HD       PRO 137 -18.258  -4.677   3.325
  971    H    ALA 138           H        ALA 138 -18.715  -0.959   4.793
  972    HA   ALA 138           HA       ALA 138 -18.855   1.848   4.628
  973   1HB   ALA 138          1HB       ALA 138 -18.679   1.832   7.069
  974   2HB   ALA 138          2HB       ALA 138 -18.169   0.144   7.021
  975   3HB   ALA 138          3HB       ALA 138 -19.794   0.588   6.500
  976    H    GLU 139           H        GLU 139 -16.172  -0.333   5.125
  977    HA   GLU 139           HA       GLU 139 -14.188   1.480   5.897
  978   1HB   GLU 139          2HB       GLU 139 -13.904  -0.962   5.944
  979   2HB   GLU 139          1HB       GLU 139 -13.970  -1.014   4.191
  980   1HG   GLU 139          2HG       GLU 139 -11.699  -1.243   5.027
  981   2HG   GLU 139          1HG       GLU 139 -11.891   0.218   4.050
  982    H    ALA 140           H        ALA 140 -15.296   0.448   2.692
  983    HA   ALA 140           HA       ALA 140 -13.617   2.146   1.183
  984   1HB   ALA 140          1HB       ALA 140 -16.340   1.054   0.478
  985   2HB   ALA 140          2HB       ALA 140 -14.795   0.261   0.173
  986   3HB   ALA 140          3HB       ALA 140 -15.191   1.767  -0.652
  987    H    ALA 141           H        ALA 141 -16.914   2.510   2.403
  988    HA   ALA 141           HA       ALA 141 -17.537   4.946   1.211
  989   1HB   ALA 141          1HB       ALA 141 -19.305   5.134   2.850
  990   2HB   ALA 141          2HB       ALA 141 -18.529   3.915   3.862
  991   3HB   ALA 141          3HB       ALA 141 -19.176   3.468   2.281
  992    H    THR 142           H        THR 142 -15.467   4.302   3.925
  993    HA   THR 142           HA       THR 142 -15.664   6.980   4.980
  994    HB   THR 142           HB       THR 142 -13.627   4.857   5.674
  995    HG1  THR 142           1HG      THR 142 -15.640   3.984   6.108
  996   1HG2  THR 142          1HG2      THR 142 -13.510   6.067   7.817
  997   2HG2  THR 142          2HG2      THR 142 -14.636   7.270   7.188
  998   3HG2  THR 142          3HG2      THR 142 -13.038   7.092   6.463
  999    H    ALA 143           H        ALA 143 -13.222   5.108   3.167
 1000    HA   ALA 143           HA       ALA 143 -11.486   7.457   3.143
 1001   1HB   ALA 143          1HB       ALA 143 -10.928   4.639   2.244
 1002   2HB   ALA 143          2HB       ALA 143 -10.509   5.335   3.811
 1003   3HB   ALA 143          3HB       ALA 143  -9.755   5.952   2.341
 1004    H    CYS 144           H        CYS 144 -13.686   5.883   1.064
 1005    HA   CYS 144           HA       CYS 144 -12.317   6.716  -1.366
 1006   1HB   CYS 144          2HB       CYS 144 -13.935   4.587  -0.807
 1007   2HB   CYS 144          1HB       CYS 144 -15.064   5.685  -1.595
 1008    H    LYS 145           H        LYS 145 -13.972   8.361   0.817
 1009    HA   LYS 145           HA       LYS 145 -15.073  10.173  -1.208
 1010   1HB   LYS 145          2HB       LYS 145 -16.346   9.432   1.425
 1011   2HB   LYS 145          1HB       LYS 145 -16.838  10.819   0.467
 1012   1HG   LYS 145          2HG       LYS 145 -17.191   9.107  -1.429
 1013   2HG   LYS 145          1HG       LYS 145 -17.152   7.907  -0.135
 1014   1HD   LYS 145          2HD       LYS 145 -19.446   8.581  -0.604
 1015   2HD   LYS 145          1HD       LYS 145 -18.966   9.106   1.013
 1016   1HE   LYS 145          2HE       LYS 145 -18.418  11.338   0.042
 1017   2HE   LYS 145          1HE       LYS 145 -19.105  10.786  -1.484
 1018   1HZ   LYS 145          1HZ       LYS 145 -21.235  10.528  -0.438
 1019   2HZ   LYS 145          2HZ       LYS 145 -20.656  12.093  -0.119
 1020   3HZ   LYS 145          3HZ       LYS 145 -20.591  10.905   1.084
 1021    H    ASN 146           H        ASN 146 -15.107  12.388  -0.604
 1022    HA   ASN 146           HA       ASN 146 -14.173  14.305   0.171
 1023   1HB   ASN 146          2HB       ASN 146 -13.441  12.752   2.666
 1024   2HB   ASN 146          1HB       ASN 146 -13.541  14.500   2.508
 1025   1HD2  ASN 146          1HD2      ASN 146 -15.239  11.579   3.020
 1026   2HD2  ASN 146          2HD2      ASN 146 -16.805  12.265   3.303
 1027    H    THR 147           H        THR 147 -12.577  11.917  -0.990
 1028    HA   THR 147           HA       THR 147  -9.914  12.934  -0.285
 1029    HB   THR 147           HB       THR 147  -9.158  10.593  -1.072
 1030    HG1  THR 147           1HG      THR 147 -11.056   9.110  -0.376
 1031   1HG2  THR 147          1HG2      THR 147  -9.520   9.648   1.171
 1032   2HG2  THR 147          2HG2      THR 147 -10.698  10.915   1.506
 1033   3HG2  THR 147          3HG2      THR 147  -9.006  11.332   1.247
 1034    H    ASP 148           H        ASP 148 -10.185  14.499  -1.996
 1035    HA   ASP 148           HA       ASP 148  -9.968  13.407  -4.703
 1036   1HB   ASP 148          2HB       ASP 148 -10.196  16.237  -3.657
 1037   2HB   ASP 148          1HB       ASP 148  -9.878  15.866  -5.349
 1038    H    SER 149           H        SER 149  -8.281  16.171  -3.301
 1039    HA   SER 149           HA       SER 149  -5.756  15.317  -4.343
 1040   1HB   SER 149          2HB       SER 149  -4.990  17.284  -2.792
 1041   2HB   SER 149          1HB       SER 149  -5.967  17.646  -4.220
 1042    HG   SER 149           HG       SER 149  -6.547  18.464  -1.912
 1043    H    THR 150           H        THR 150  -7.587  14.604  -1.614
 1044    HA   THR 150           HA       THR 150  -5.348  13.933   0.106
 1045    HB   THR 150           HB       THR 150  -8.226  13.300   0.708
 1046    HG1  THR 150           1HG      THR 150  -7.140  15.810   1.392
 1047   1HG2  THR 150          1HG2      THR 150  -6.504  12.557   2.290
 1048   2HG2  THR 150          2HG2      THR 150  -7.524  13.808   3.002
 1049   3HG2  THR 150          3HG2      THR 150  -5.909  14.211   2.422
 1050    H    ASN 151           H        ASN 151  -6.455  12.451  -2.524
 1051    HA   ASN 151           HA       ASN 151  -6.793   9.805  -1.356
 1052   1HB   ASN 151          2HB       ASN 151  -8.215  10.633  -3.306
 1053   2HB   ASN 151          1HB       ASN 151  -6.782  10.417  -4.308
 1054   1HD2  ASN 151          1HD2      ASN 151  -9.234   9.010  -4.640
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.935   7.343  -4.318
 1056    H    LYS 152           H        LYS 152  -4.846   9.215  -0.605
 1057    HA   LYS 152           HA       LYS 152  -3.135   8.066  -2.609
 1058   1HB   LYS 152          2HB       LYS 152  -1.033   8.900  -1.468
 1059   2HB   LYS 152          1HB       LYS 152  -1.896  10.078  -2.440
 1060   1HG   LYS 152          2HG       LYS 152  -2.537   9.995   0.445
 1061   2HG   LYS 152          1HG       LYS 152  -0.951  10.616  -0.013
 1062   1HD   LYS 152          2HD       LYS 152  -2.100  12.152  -1.609
 1063   2HD   LYS 152          1HD       LYS 152  -3.641  11.613  -0.939
 1064   1HE   LYS 152          2HE       LYS 152  -3.145  12.527   1.183
 1065   2HE   LYS 152          1HE       LYS 152  -1.449  12.770   0.762
 1066   1HZ   LYS 152          1HZ       LYS 152  -1.955  14.572  -0.579
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.021  14.780   0.725
 1068   3HZ   LYS 152          3HZ       LYS 152  -3.582  14.142  -0.742
 1069    H    VAL 153           H        VAL 153  -3.065   6.016  -1.981
 1070    HA   VAL 153           HA       VAL 153  -3.055   5.492   0.895
 1071    HB   VAL 153           HB       VAL 153  -4.298   3.414   0.385
 1072   1HG1  VAL 153          1HG1      VAL 153  -6.461   4.507   0.000
 1073   2HG1  VAL 153          2HG1      VAL 153  -5.614   5.970  -0.498
 1074   3HG1  VAL 153          3HG1      VAL 153  -5.472   5.390   1.160
 1075   1HG2  VAL 153          1HG2      VAL 153  -5.459   3.190  -1.761
 1076   2HG2  VAL 153          2HG2      VAL 153  -3.707   3.112  -1.951
 1077   3HG2  VAL 153          3HG2      VAL 153  -4.575   4.589  -2.371
 1078    H    THR 154           H        THR 154  -0.859   5.214   1.143
 1079    HA   THR 154           HA       THR 154   0.530   3.159  -0.310
 1080    HB   THR 154           HB       THR 154   2.239   3.524   1.553
 1081    HG1  THR 154           1HG      THR 154   1.740   5.686   2.597
 1082   1HG2  THR 154          1HG2      THR 154   1.335   5.917  -0.057
 1083   2HG2  THR 154          2HG2      THR 154   2.387   4.623  -0.635
 1084   3HG2  THR 154          3HG2      THR 154   2.933   5.696   0.654
 1085    H    TYR 155           H        TYR 155   0.286   0.964   0.061
 1086    HA   TYR 155           HA       TYR 155  -0.310   0.213   2.843
 1087   1HB   TYR 155          2HB       TYR 155  -1.908  -1.461   2.172
 1088   2HB   TYR 155          1HB       TYR 155  -2.404   0.118   1.594
 1089    HD1  TYR 155           1HD      TYR 155  -1.536  -3.270   0.673
 1090    HD2  TYR 155           2HD      TYR 155  -2.187   0.657  -0.835
 1091    HE1  TYR 155           1HE      TYR 155  -1.730  -4.182  -1.600
 1092    HE2  TYR 155           2HE      TYR 155  -2.396  -0.242  -3.115
 1093    HH   TYR 155           HH       TYR 155  -2.739  -3.566  -3.751
 1094    H    PHE 156           H        PHE 156   0.594  -1.567   3.638
 1095    HA   PHE 156           HA       PHE 156   2.649  -2.852   1.999
 1096   1HB   PHE 156          2HB       PHE 156   2.209  -2.575   4.958
 1097   2HB   PHE 156          1HB       PHE 156   3.265  -3.831   4.329
 1098    HD1  PHE 156           1HD      PHE 156   5.446  -3.371   3.699
 1099    HD2  PHE 156           2HD      PHE 156   2.747  -0.163   4.425
 1100    HE1  PHE 156           1HE      PHE 156   7.318  -1.782   3.600
 1101    HE2  PHE 156           2HE      PHE 156   4.617   1.435   4.323
 1102    HZ   PHE 156           HZ       PHE 156   6.907   0.620   3.911
 1103    H    MET 157           H        MET 157   2.769  -5.076   1.775
 1104    HA   MET 157           HA       MET 157   0.489  -6.616   2.759
 1105   1HB   MET 157          2HB       MET 157   0.302  -7.750   0.581
 1106   2HB   MET 157          1HB       MET 157  -0.042  -6.031   0.471
 1107   1HG   MET 157          2HG       MET 157   2.531  -7.377  -0.351
 1108   2HG   MET 157          1HG       MET 157   1.246  -6.839  -1.429
 1109   1HE   MET 157          1HE       MET 157   4.308  -4.382  -2.068
 1110   2HE   MET 157          2HE       MET 157   3.274  -5.616  -2.789
 1111   3HE   MET 157          3HE       MET 157   4.447  -6.063  -1.547
 1112    H    LYS 158           H        LYS 158   0.866  -8.951   2.797
 1113    HA   LYS 158           HA       LYS 158   3.191  -9.610   4.130
 1114   1HB   LYS 158          2HB       LYS 158   1.159 -10.868   4.382
 1115   2HB   LYS 158          1HB       LYS 158   1.191 -11.351   2.695
 1116   1HG   LYS 158          2HG       LYS 158   3.203 -12.664   3.101
 1117   2HG   LYS 158          1HG       LYS 158   3.187 -12.164   4.796
 1118   1HD   LYS 158          2HD       LYS 158   0.749 -13.432   3.646
 1119   2HD   LYS 158          1HD       LYS 158   2.133 -14.454   4.031
 1120   1HE   LYS 158          2HE       LYS 158   0.543 -14.351   5.867
 1121   2HE   LYS 158          1HE       LYS 158   2.097 -13.679   6.332
 1122   1HZ   LYS 158          1HZ       LYS 158   1.172 -11.471   6.076
 1123   2HZ   LYS 158          2HZ       LYS 158   0.222 -12.378   7.149
 1124   3HZ   LYS 158          3HZ       LYS 158  -0.310 -12.120   5.566
  Start of MODEL   11
    1   1H    MET   1          1HT       MET   1 -16.419 -11.173   7.762
    2   2H    MET   1          2HT       MET   1 -16.020 -10.659   9.325
    3   3H    MET   1          3HT       MET   1 -15.923  -9.573   8.027
    4    HA   MET   1           HA       MET   1 -18.378 -10.782   9.160
    5   1HB   MET   1          2HB       MET   1 -17.447  -7.905   9.003
    6   2HB   MET   1          1HB       MET   1 -18.990  -8.440   9.645
    7   1HG   MET   1          2HG       MET   1 -17.797  -9.654  11.421
    8   2HG   MET   1          1HG       MET   1 -16.272  -9.035  10.787
    9   1HE   MET   1          1HE       MET   1 -17.200  -6.082   9.880
   10   2HE   MET   1          2HE       MET   1 -15.674  -6.410  10.699
   11   3HE   MET   1          3HE       MET   1 -16.750  -5.152  11.307
   12    H    GLU   2           H        GLU   2 -16.948  -8.763   6.629
   13    HA   GLU   2           HA       GLU   2 -19.583  -8.369   5.436
   14   1HB   GLU   2          2HB       GLU   2 -17.845  -6.522   5.870
   15   2HB   GLU   2          1HB       GLU   2 -16.999  -7.174   4.473
   16   1HG   GLU   2          2HG       GLU   2 -18.251  -5.477   3.562
   17   2HG   GLU   2          1HG       GLU   2 -19.258  -6.894   3.266
   18    H    GLN   3           H        GLN   3 -20.203  -9.162   3.517
   19    HA   GLN   3           HA       GLN   3 -18.261 -10.715   1.944
   20   1HB   GLN   3          2HB       GLN   3 -21.286 -10.735   1.920
   21   2HB   GLN   3          1HB       GLN   3 -20.280 -11.652   0.806
   22   1HG   GLN   3          2HG       GLN   3 -19.358 -12.930   2.645
   23   2HG   GLN   3          1HG       GLN   3 -20.280 -11.970   3.802
   24   1HE2  GLN   3          1HE2      GLN   3 -20.311 -14.863   3.255
   25   2HE2  GLN   3          2HE2      GLN   3 -21.964 -15.243   2.890
   26    H    SER   4           H        SER   4 -17.276  -9.120   0.811
   27    HA   SER   4           HA       SER   4 -18.743  -6.879  -0.225
   28   1HB   SER   4          2HB       SER   4 -15.821  -7.580  -0.606
   29   2HB   SER   4          1HB       SER   4 -16.567  -5.994  -0.797
   30    HG   SER   4           HG       SER   4 -15.627  -6.048   1.206
   31    H    ALA   5           H        ALA   5 -18.873  -9.797  -1.377
   32    HA   ALA   5           HA       ALA   5 -19.433 -10.721  -3.365
   33   1HB   ALA   5          1HB       ALA   5 -19.999  -9.320  -5.278
   34   2HB   ALA   5          2HB       ALA   5 -19.280  -7.922  -4.479
   35   3HB   ALA   5          3HB       ALA   5 -20.712  -8.689  -3.792
   36    H    SER   6           H        SER   6 -17.133  -8.159  -4.322
   37    HA   SER   6           HA       SER   6 -15.732  -9.969  -6.065
   38   1HB   SER   6          2HB       SER   6 -14.954  -7.176  -5.183
   39   2HB   SER   6          1HB       SER   6 -14.321  -8.053  -6.575
   40    HG   SER   6           HG       SER   6 -16.366  -7.961  -7.527
   41    H    ASP   7           H        ASP   7 -15.816 -10.075  -2.930
   42    HA   ASP   7           HA       ASP   7 -13.155  -9.695  -2.042
   43   1HB   ASP   7          2HB       ASP   7 -13.881 -10.765   0.018
   44   2HB   ASP   7          1HB       ASP   7 -15.100  -9.626  -0.533
   45    H    SER   8           H        SER   8 -14.807 -12.361  -3.529
   46    HA   SER   8           HA       SER   8 -12.495 -14.095  -3.061
   47   1HB   SER   8          2HB       SER   8 -15.126 -14.719  -4.423
   48   2HB   SER   8          1HB       SER   8 -13.870 -15.882  -4.011
   49    HG   SER   8           HG       SER   8 -15.762 -14.650  -2.403
   50    H    ASN   9           H        ASN   9 -13.727 -11.941  -5.381
   51    HA   ASN   9           HA       ASN   9 -12.662 -13.388  -7.661
   52   1HB   ASN   9          2HB       ASN   9 -14.138 -10.764  -7.428
   53   2HB   ASN   9          1HB       ASN   9 -13.518 -11.385  -8.953
   54   1HD2  ASN   9          1HD2      ASN   9 -15.552 -11.519  -9.853
   55   2HD2  ASN   9          2HD2      ASN   9 -16.702 -12.727  -9.384
   56    H    LYS  10           H        LYS  10 -12.204 -10.073  -6.365
   57    HA   LYS  10           HA       LYS  10  -9.859  -9.835  -8.067
   58   1HB   LYS  10          2HB       LYS  10 -11.621  -8.019  -7.814
   59   2HB   LYS  10          1HB       LYS  10 -10.950  -7.723  -6.215
   60   1HG   LYS  10          2HG       LYS  10  -8.811  -7.157  -7.164
   61   2HG   LYS  10          1HG       LYS  10  -9.385  -7.567  -8.781
   62   1HD   LYS  10          2HD       LYS  10 -11.170  -5.789  -8.427
   63   2HD   LYS  10          1HD       LYS  10 -10.227  -5.275  -7.024
   64   1HE   LYS  10          2HE       LYS  10  -9.141  -5.484  -9.828
   65   2HE   LYS  10          1HE       LYS  10  -9.742  -3.993  -9.106
   66   1HZ   LYS  10          1HZ       LYS  10  -8.031  -4.260  -7.362
   67   2HZ   LYS  10          2HZ       LYS  10  -7.371  -4.065  -8.913
   68   3HZ   LYS  10          3HZ       LYS  10  -7.417  -5.603  -8.198
   69    H    SER  11           H        SER  11 -10.660 -10.014  -4.661
   70    HA   SER  11           HA       SER  11  -8.253  -9.110  -3.582
   71   1HB   SER  11          2HB       SER  11 -10.326  -9.470  -2.268
   72   2HB   SER  11          1HB       SER  11 -10.105 -11.212  -2.430
   73    HG   SER  11           HG       SER  11  -7.831 -10.293  -1.522
   74    H    GLN  12           H        GLN  12  -9.226 -12.384  -4.561
   75    HA   GLN  12           HA       GLN  12  -6.857 -13.624  -3.599
   76   1HB   GLN  12          2HB       GLN  12  -8.867 -14.592  -5.636
   77   2HB   GLN  12          1HB       GLN  12  -7.595 -15.579  -4.931
   78   1HG   GLN  12          2HG       GLN  12  -8.585 -15.146  -2.690
   79   2HG   GLN  12          1HG       GLN  12  -9.923 -14.327  -3.494
   80   1HE2  GLN  12          1HE2      GLN  12  -9.950 -16.694  -1.817
   81   2HE2  GLN  12          2HE2      GLN  12 -10.630 -17.968  -2.769
   82    H    ASN  13           H        ASN  13  -7.743 -12.148  -6.654
   83    HA   ASN  13           HA       ASN  13  -5.533 -13.141  -8.135
   84   1HB   ASN  13          2HB       ASN  13  -7.273 -10.706  -8.542
   85   2HB   ASN  13          1HB       ASN  13  -6.002 -11.184  -9.662
   86   1HD2  ASN  13          1HD2      ASN  13  -8.812 -10.959 -10.187
   87   2HD2  ASN  13          2HD2      ASN  13  -9.366 -12.531 -10.658
   88    H    ALA  14           H        ALA  14  -6.116 -10.041  -6.482
   89    HA   ALA  14           HA       ALA  14  -3.630  -8.871  -6.885
   90   1HB   ALA  14          1HB       ALA  14  -5.524  -7.683  -5.912
   91   2HB   ALA  14          2HB       ALA  14  -4.094  -7.538  -4.888
   92   3HB   ALA  14          3HB       ALA  14  -5.388  -8.651  -4.445
   93    H    ILE  15           H        ILE  15  -4.653 -11.113  -4.342
   94    HA   ILE  15           HA       ILE  15  -2.317 -11.198  -2.824
   95    HB   ILE  15           HB       ILE  15  -4.349 -13.355  -3.406
   96   1HG1  ILE  15          2HG1      ILE  15  -3.905 -11.616  -0.970
   97   2HG1  ILE  15          1HG1      ILE  15  -5.143 -11.350  -2.194
   98   1HG2  ILE  15          1HG2      ILE  15  -3.440 -14.568  -1.470
   99   2HG2  ILE  15          2HG2      ILE  15  -2.126 -13.394  -1.365
  100   3HG2  ILE  15          3HG2      ILE  15  -2.268 -14.435  -2.781
  101   1HD1  ILE  15          1HD1      ILE  15  -6.084 -12.398  -0.232
  102   2HD1  ILE  15          2HD1      ILE  15  -4.935 -13.729  -0.367
  103   3HD1  ILE  15          3HD1      ILE  15  -6.163 -13.495  -1.610
  104    H    SER  16           H        SER  16  -3.243 -13.117  -5.658
  105    HA   SER  16           HA       SER  16  -0.978 -14.776  -5.704
  106   1HB   SER  16          2HB       SER  16  -2.671 -13.916  -8.058
  107   2HB   SER  16          1HB       SER  16  -1.674 -15.366  -7.949
  108    HG   SER  16           HG       SER  16  -4.057 -14.755  -6.540
  109    H    GLU  17           H        GLU  17  -1.601 -11.600  -7.069
  110    HA   GLU  17           HA       GLU  17   0.692 -11.396  -8.696
  111   1HB   GLU  17          2HB       GLU  17  -0.815  -9.188  -7.277
  112   2HB   GLU  17          1HB       GLU  17   0.317  -8.967  -8.599
  113   1HG   GLU  17          2HG       GLU  17  -2.279 -10.473  -8.777
  114   2HG   GLU  17          1HG       GLU  17  -2.026  -8.810  -9.300
  115    H    VAL  18           H        VAL  18   0.078 -10.013  -5.466
  116    HA   VAL  18           HA       VAL  18   2.698  -8.950  -5.261
  117    HB   VAL  18           HB       VAL  18   2.128  -8.360  -2.962
  118   1HG1  VAL  18          1HG1      VAL  18  -0.121  -7.875  -4.914
  119   2HG1  VAL  18          2HG1      VAL  18   1.363  -6.931  -4.779
  120   3HG1  VAL  18          3HG1      VAL  18   0.196  -6.935  -3.456
  121   1HG2  VAL  18          1HG2      VAL  18  -0.070  -8.927  -2.031
  122   2HG2  VAL  18          2HG2      VAL  18   0.904 -10.370  -2.317
  123   3HG2  VAL  18          3HG2      VAL  18  -0.398  -9.948  -3.431
  124    H    MET  19           H        MET  19   1.252 -11.953  -4.130
  125    HA   MET  19           HA       MET  19   3.201 -12.671  -2.250
  126   1HB   MET  19          2HB       MET  19   0.963 -13.792  -2.666
  127   2HB   MET  19          1HB       MET  19   1.708 -14.602  -4.033
  128   1HG   MET  19          2HG       MET  19   2.809 -14.825  -1.250
  129   2HG   MET  19          1HG       MET  19   1.541 -15.890  -1.850
  130   1HE   MET  19          1HE       MET  19   4.765 -18.152  -1.831
  131   2HE   MET  19          2HE       MET  19   3.132 -17.942  -1.200
  132   3HE   MET  19          3HE       MET  19   4.418 -16.848  -0.696
  133    H    SER  20           H        SER  20   3.114 -12.983  -5.742
  134    HA   SER  20           HA       SER  20   5.385 -14.656  -5.993
  135   1HB   SER  20          2HB       SER  20   3.649 -14.249  -7.782
  136   2HB   SER  20          1HB       SER  20   4.365 -12.656  -8.029
  137    HG   SER  20           HG       SER  20   6.074 -13.534  -8.965
  138    H    ALA  21           H        ALA  21   4.919 -11.171  -5.840
  139    HA   ALA  21           HA       ALA  21   7.627 -10.562  -6.556
  140   1HB   ALA  21          1HB       ALA  21   5.536  -8.761  -5.346
  141   2HB   ALA  21          2HB       ALA  21   5.753  -9.052  -7.072
  142   3HB   ALA  21          3HB       ALA  21   7.028  -8.260  -6.144
  143    H    THR  22           H        THR  22   5.777 -10.690  -3.531
  144    HA   THR  22           HA       THR  22   7.734  -9.507  -1.898
  145    HB   THR  22           HB       THR  22   6.528 -10.709  -0.005
  146    HG1  THR  22           1HG      THR  22   4.309 -11.385  -1.012
  147   1HG2  THR  22          1HG2      THR  22   4.548  -9.302  -0.178
  148   2HG2  THR  22          2HG2      THR  22   4.846  -9.067  -1.899
  149   3HG2  THR  22          3HG2      THR  22   5.977  -8.418  -0.713
  150    H    SER  23           H        SER  23   7.361 -12.771  -3.049
  151    HA   SER  23           HA       SER  23   9.381 -13.784  -1.234
  152   1HB   SER  23          2HB       SER  23   8.974 -15.929  -2.572
  153   2HB   SER  23          1HB       SER  23   7.611 -15.311  -1.641
  154    HG   SER  23           HG       SER  23   6.582 -14.781  -3.440
  155    H    ALA  24           H        ALA  24   9.033 -13.006  -4.673
  156    HA   ALA  24           HA       ALA  24  11.469 -14.146  -5.516
  157   1HB   ALA  24          1HB       ALA  24   9.960 -11.878  -6.800
  158   2HB   ALA  24          2HB       ALA  24   9.617 -13.591  -7.038
  159   3HB   ALA  24          3HB       ALA  24  11.157 -12.917  -7.572
  160    H    ILE  25           H        ILE  25  10.668 -10.900  -4.357
  161    HA   ILE  25           HA       ILE  25  13.075  -9.660  -5.096
  162    HB   ILE  25           HB       ILE  25  11.098  -8.377  -4.418
  163   1HG1  ILE  25          2HG1      ILE  25  13.510  -7.838  -2.664
  164   2HG1  ILE  25          1HG1      ILE  25  13.343  -7.341  -4.344
  165   1HG2  ILE  25          1HG2      ILE  25  11.735  -9.280  -1.612
  166   2HG2  ILE  25          2HG2      ILE  25  10.355  -9.810  -2.572
  167   3HG2  ILE  25          3HG2      ILE  25  10.488  -8.122  -2.078
  168   1HD1  ILE  25          1HD1      ILE  25  11.634  -6.407  -2.048
  169   2HD1  ILE  25          2HD1      ILE  25  11.464  -5.906  -3.731
  170   3HD1  ILE  25          3HD1      ILE  25  12.924  -5.492  -2.830
  171    H    ASN  26           H        ASN  26  12.246 -11.644  -2.342
  172    HA   ASN  26           HA       ASN  26  14.462 -11.102  -0.702
  173   1HB   ASN  26          2HB       ASN  26  12.515 -12.375   0.089
  174   2HB   ASN  26          1HB       ASN  26  12.894 -13.673  -1.036
  175   1HD2  ASN  26          1HD2      ASN  26  13.179 -15.239   0.466
  176   2HD2  ASN  26          2HD2      ASN  26  14.490 -15.254   1.597
  177    H    GLY  27           H        GLY  27  13.927 -13.549  -3.208
  178   1HA   GLY  27          2HA       GLY  27  16.494 -14.746  -3.004
  179   2HA   GLY  27          1HA       GLY  27  15.366 -14.934  -4.337
  180    H    LEU  28           H        LEU  28  15.385 -11.891  -4.580
  181    HA   LEU  28           HA       LEU  28  17.535 -11.745  -6.474
  182   1HB   LEU  28          2HB       LEU  28  15.672  -9.594  -5.456
  183   2HB   LEU  28          1HB       LEU  28  16.777  -9.414  -6.805
  184    HG   LEU  28           HG       LEU  28  14.430 -11.313  -6.701
  185   1HD1  LEU  28          1HD1      LEU  28  14.839  -8.762  -8.260
  186   2HD1  LEU  28          2HD1      LEU  28  13.758  -8.970  -6.880
  187   3HD1  LEU  28          3HD1      LEU  28  13.450  -9.844  -8.382
  188   1HD2  LEU  28          1HD2      LEU  28  16.272 -12.199  -8.034
  189   2HD2  LEU  28          2HD2      LEU  28  16.353 -10.687  -8.941
  190   3HD2  LEU  28          3HD2      LEU  28  14.924 -11.714  -9.061
  191    H    TYR  29           H        TYR  29  16.834 -10.298  -3.325
  192    HA   TYR  29           HA       TYR  29  19.287  -8.784  -3.356
  193   1HB   TYR  29          2HB       TYR  29  17.089  -9.099  -1.312
  194   2HB   TYR  29          1HB       TYR  29  18.566  -8.205  -0.970
  195    HD1  TYR  29           1HD      TYR  29  16.586  -8.316  -4.121
  196    HD2  TYR  29           2HD      TYR  29  17.854  -5.974  -0.808
  197    HE1  TYR  29           1HE      TYR  29  15.585  -6.325  -5.155
  198    HE2  TYR  29           2HE      TYR  29  16.862  -3.975  -1.833
  199    HH   TYR  29           HH       TYR  29  16.182  -3.156  -3.995
  200    H    ILE  30           H        ILE  30  17.999 -11.199  -1.056
  201    HA   ILE  30           HA       ILE  30  18.991 -12.831   0.163
  202    HB   ILE  30           HB       ILE  30  21.094 -12.644  -1.991
  203   1HG1  ILE  30          2HG1      ILE  30  18.836 -13.373  -2.703
  204   2HG1  ILE  30          1HG1      ILE  30  20.034 -14.654  -2.869
  205   1HG2  ILE  30          1HG2      ILE  30  22.120 -13.553   0.009
  206   2HG2  ILE  30          2HG2      ILE  30  21.908 -14.822  -1.196
  207   3HG2  ILE  30          3HG2      ILE  30  20.807 -14.719   0.178
  208   1HD1  ILE  30          1HD1      ILE  30  18.003 -14.390  -0.662
  209   2HD1  ILE  30          2HD1      ILE  30  19.224 -15.657  -0.781
  210   3HD1  ILE  30          3HD1      ILE  30  17.960 -15.534  -2.002
  211    H    GLY  31           H        GLY  31  19.678 -12.428   2.133
  212   1HA   GLY  31          2HA       GLY  31  21.535 -12.202   3.629
  213   2HA   GLY  31          1HA       GLY  31  22.300 -11.140   2.459
  214    H    GLN  32           H        GLN  32  19.715  -9.703   2.055
  215    HA   GLN  32           HA       GLN  32  20.155  -7.665   3.977
  216   1HB   GLN  32          2HB       GLN  32  17.795  -8.026   2.123
  217   2HB   GLN  32          1HB       GLN  32  18.224  -6.548   2.973
  218   1HG   GLN  32          2HG       GLN  32  19.870  -7.904   0.857
  219   2HG   GLN  32          1HG       GLN  32  18.881  -6.465   0.646
  220   1HE2  GLN  32          1HE2      GLN  32  19.622  -4.502   1.364
  221   2HE2  GLN  32          2HE2      GLN  32  21.241  -4.258   1.948
  222    H    THR  33           H        THR  33  19.472  -7.565   5.971
  223    HA   THR  33           HA       THR  33  17.782  -9.440   7.192
  224    HB   THR  33           HB       THR  33  18.407  -6.639   8.150
  225    HG1  THR  33           1HG      THR  33  20.392  -7.368   8.230
  226   1HG2  THR  33          1HG2      THR  33  18.121  -7.618  10.387
  227   2HG2  THR  33          2HG2      THR  33  17.683  -9.158   9.651
  228   3HG2  THR  33          3HG2      THR  33  16.646  -7.749   9.432
  229    H    SER  34           H        SER  34  17.190  -6.177   5.954
  230    HA   SER  34           HA       SER  34  14.334  -6.708   5.901
  231   1HB   SER  34          2HB       SER  34  14.051  -4.389   7.070
  232   2HB   SER  34          1HB       SER  34  14.351  -5.824   8.052
  233    HG   SER  34           HG       SER  34  15.998  -3.638   7.512
  234    H    TYR  35           H        TYR  35  16.542  -6.158   3.960
  235    HA   TYR  35           HA       TYR  35  16.918  -4.990   2.045
  236   1HB   TYR  35          2HB       TYR  35  14.083  -3.986   2.385
  237   2HB   TYR  35          1HB       TYR  35  15.013  -4.029   0.892
  238    HD1  TYR  35           1HD      TYR  35  15.460  -6.198  -0.223
  239    HD2  TYR  35           2HD      TYR  35  12.948  -5.917   3.200
  240    HE1  TYR  35           1HE      TYR  35  14.531  -8.422  -0.727
  241    HE2  TYR  35           2HE      TYR  35  12.019  -8.137   2.711
  242    HH   TYR  35           HH       TYR  35  11.760  -9.669   0.935
  243    H    SER  36           H        SER  36  17.270  -3.691   4.755
  244    HA   SER  36           HA       SER  36  16.460  -0.960   4.468
  245   1HB   SER  36          2HB       SER  36  18.244  -2.285   6.517
  246   2HB   SER  36          1HB       SER  36  17.625  -0.637   6.623
  247    HG   SER  36           HG       SER  36  15.475  -1.730   6.372
  248    H    GLY  37           H        GLY  37  18.787  -2.494   2.869
  249   1HA   GLY  37          2HA       GLY  37  20.949  -0.644   3.062
  250   2HA   GLY  37          1HA       GLY  37  20.664  -1.779   1.743
  251    H    LEU  38           H        LEU  38  17.868  -0.620   1.567
  252    HA   LEU  38           HA       LEU  38  18.585   1.620  -0.183
  253   1HB   LEU  38          2HB       LEU  38  15.986   0.100   0.047
  254   2HB   LEU  38          1HB       LEU  38  16.365   1.311  -1.161
  255    HG   LEU  38           HG       LEU  38  17.724  -1.370  -0.887
  256   1HD1  LEU  38          1HD1      LEU  38  16.560  -1.929  -2.953
  257   2HD1  LEU  38          2HD1      LEU  38  15.742  -0.367  -2.925
  258   3HD1  LEU  38          3HD1      LEU  38  15.415  -1.554  -1.664
  259   1HD2  LEU  38          1HD2      LEU  38  18.003   0.787  -2.973
  260   2HD2  LEU  38          2HD2      LEU  38  18.749  -0.811  -3.034
  261   3HD2  LEU  38          3HD2      LEU  38  19.216   0.334  -1.775
  262    H    ASP  39           H        ASP  39  17.781   1.294   2.932
  263    HA   ASP  39           HA       ASP  39  15.392   2.677   3.356
  264   1HB   ASP  39          2HB       ASP  39  16.727   1.345   5.064
  265   2HB   ASP  39          1HB       ASP  39  17.758   2.764   5.221
  266    H    SER  40           H        SER  40  18.588   4.013   4.135
  267    HA   SER  40           HA       SER  40  17.697   6.683   4.089
  268   1HB   SER  40          2HB       SER  40  20.534   5.685   3.784
  269   2HB   SER  40          1HB       SER  40  20.023   7.270   4.369
  270    HG   SER  40           HG       SER  40  18.933   6.094   6.099
  271    H    THR  41           H        THR  41  18.966   4.549   1.651
  272    HA   THR  41           HA       THR  41  19.835   6.337  -0.283
  273    HB   THR  41           HB       THR  41  18.367   3.757  -0.830
  274    HG1  THR  41           1HG      THR  41  21.109   4.213  -0.145
  275   1HG2  THR  41          1HG2      THR  41  19.825   3.647  -2.794
  276   2HG2  THR  41          2HG2      THR  41  20.555   5.187  -2.344
  277   3HG2  THR  41          3HG2      THR  41  18.855   5.120  -2.811
  278    H    ILE  42           H        ILE  42  16.606   4.828  -0.019
  279    HA   ILE  42           HA       ILE  42  15.483   6.503  -2.051
  280    HB   ILE  42           HB       ILE  42  14.063   4.803   0.008
  281   1HG1  ILE  42          2HG1      ILE  42  15.565   3.425  -1.300
  282   2HG1  ILE  42          1HG1      ILE  42  13.912   3.128  -1.824
  283   1HG2  ILE  42          1HG2      ILE  42  12.589   6.448  -0.992
  284   2HG2  ILE  42          2HG2      ILE  42  12.193   4.834  -1.581
  285   3HG2  ILE  42          3HG2      ILE  42  13.095   5.949  -2.607
  286   1HD1  ILE  42          1HD1      ILE  42  14.283   4.597  -3.758
  287   2HD1  ILE  42          2HD1      ILE  42  15.396   3.228  -3.723
  288   3HD1  ILE  42          3HD1      ILE  42  15.953   4.830  -3.239
  289    H    LEU  43           H        LEU  43  15.734   6.578   1.413
  290    HA   LEU  43           HA       LEU  43  13.764   8.447   2.036
  291   1HB   LEU  43          2HB       LEU  43  15.165   7.007   3.595
  292   2HB   LEU  43          1HB       LEU  43  16.429   8.210   3.414
  293    HG   LEU  43           HG       LEU  43  14.852   9.926   4.321
  294   1HD1  LEU  43          1HD1      LEU  43  12.858   9.154   5.498
  295   2HD1  LEU  43          2HD1      LEU  43  13.143   7.514   4.916
  296   3HD1  LEU  43          3HD1      LEU  43  12.761   8.803   3.773
  297   1HD2  LEU  43          1HD2      LEU  43  15.038   9.169   6.644
  298   2HD2  LEU  43          2HD2      LEU  43  16.526   8.883   5.741
  299   3HD2  LEU  43          3HD2      LEU  43  15.429   7.543   6.078
  300    H    LEU  44           H        LEU  44  17.279   9.069   1.645
  301    HA   LEU  44           HA       LEU  44  16.815  11.903   1.636
  302   1HB   LEU  44          2HB       LEU  44  19.233  12.116   1.277
  303   2HB   LEU  44          1HB       LEU  44  18.846  11.083   2.633
  304    HG   LEU  44           HG       LEU  44  19.196   9.138   0.931
  305   1HD1  LEU  44          1HD1      LEU  44  20.765  11.341  -0.400
  306   2HD1  LEU  44          2HD1      LEU  44  19.355  10.518  -1.070
  307   3HD1  LEU  44          3HD1      LEU  44  20.850   9.623  -0.791
  308   1HD2  LEU  44          1HD2      LEU  44  21.481  10.783   2.005
  309   2HD2  LEU  44          2HD2      LEU  44  21.587   9.103   1.484
  310   3HD2  LEU  44          3HD2      LEU  44  20.591   9.533   2.874
  311    H    ASN  45           H        ASN  45  16.568   9.536  -0.695
  312    HA   ASN  45           HA       ASN  45  17.561  10.680  -3.025
  313   1HB   ASN  45          2HB       ASN  45  16.668   8.400  -2.940
  314   2HB   ASN  45          1HB       ASN  45  15.049   9.036  -2.667
  315   1HD2  ASN  45          1HD2      ASN  45  17.573   8.515  -4.978
  316   2HD2  ASN  45          2HD2      ASN  45  16.626   8.877  -6.390
  317    H    THR  46           H        THR  46  14.449  11.186  -1.415
  318    HA   THR  46           HA       THR  46  14.029  13.483  -3.214
  319    HB   THR  46           HB       THR  46  11.841  11.867  -1.897
  320    HG1  THR  46           1HG      THR  46  13.358  11.221  -4.012
  321   1HG2  THR  46          1HG2      THR  46  10.400  13.002  -3.528
  322   2HG2  THR  46          2HG2      THR  46  11.792  13.900  -4.132
  323   3HG2  THR  46          3HG2      THR  46  11.224  14.159  -2.482
  324    H    SER  47           H        SER  47  14.943  14.998  -1.848
  325    HA   SER  47           HA       SER  47  14.926  16.637  -0.281
  326   1HB   SER  47          2HB       SER  47  12.563  16.726  -1.284
  327   2HB   SER  47          1HB       SER  47  12.035  15.955   0.211
  328    HG   SER  47           HG       SER  47  13.543  17.916   0.994
  329    H    ALA  48           H        ALA  48  15.426  13.821   0.621
  330    HA   ALA  48           HA       ALA  48  15.986  12.741   2.539
  331   1HB   ALA  48          1HB       ALA  48  16.743  14.917   3.386
  332   2HB   ALA  48          2HB       ALA  48  16.073  13.902   4.664
  333   3HB   ALA  48          3HB       ALA  48  15.120  15.230   4.002
  334    H    ILE  49           H        ILE  49  12.860  14.255   2.364
  335    HA   ILE  49           HA       ILE  49  11.701  11.867   3.649
  336    HB   ILE  49           HB       ILE  49  10.318  14.540   3.406
  337   1HG1  ILE  49          2HG1      ILE  49  11.753  13.444   5.840
  338   2HG1  ILE  49          1HG1      ILE  49  12.345  14.762   4.832
  339   1HG2  ILE  49          1HG2      ILE  49   9.754  12.073   5.044
  340   2HG2  ILE  49          2HG2      ILE  49   8.837  12.654   3.654
  341   3HG2  ILE  49          3HG2      ILE  49   8.850  13.583   5.154
  342   1HD1  ILE  49          1HD1      ILE  49  10.382  16.091   5.438
  343   2HD1  ILE  49          2HD1      ILE  49  11.321  15.610   6.851
  344   3HD1  ILE  49          3HD1      ILE  49   9.818  14.772   6.466
  345    HA   PRO  50           HA       PRO  50  10.950  11.414  -0.785
  346   1HB   PRO  50          2HB       PRO  50   9.439   9.027   0.177
  347   2HB   PRO  50          1HB       PRO  50  10.691   9.162  -1.064
  348   1HG   PRO  50          2HG       PRO  50  11.250   8.122   1.324
  349   2HG   PRO  50          1HG       PRO  50  12.422   9.127   0.453
  350   1HD   PRO  50          2HD       PRO  50  10.697   9.815   2.789
  351   2HD   PRO  50          1HD       PRO  50  12.354  10.331   2.416
  352    H    ASP  51           H        ASP  51   9.590  13.002  -1.305
  353    HA   ASP  51           HA       ASP  51   7.015  13.449  -0.267
  354   1HB   ASP  51          2HB       ASP  51   8.516  15.107  -1.436
  355   2HB   ASP  51          1HB       ASP  51   8.066  14.347  -2.956
  356    H    ASN  52           H        ASN  52   8.111  11.101  -2.333
  357    HA   ASN  52           HA       ASN  52   6.073  10.805  -4.245
  358   1HB   ASN  52          2HB       ASN  52   7.904   8.718  -3.035
  359   2HB   ASN  52          1HB       ASN  52   6.982   8.526  -4.521
  360   1HD2  ASN  52          1HD2      ASN  52   9.890   8.478  -3.915
  361   2HD2  ASN  52          2HD2      ASN  52  10.595   9.616  -5.017
  362    H    TYR  53           H        TYR  53   6.170  10.180  -0.906
  363    HA   TYR  53           HA       TYR  53   4.497   7.972  -0.567
  364   1HB   TYR  53          2HB       TYR  53   4.856  10.438   1.146
  365   2HB   TYR  53          1HB       TYR  53   4.042   8.970   1.664
  366    HD1  TYR  53           1HD      TYR  53   6.238   7.379  -0.148
  367    HD2  TYR  53           2HD      TYR  53   6.330  10.051   3.161
  368    HE1  TYR  53           1HE      TYR  53   8.407   6.452   0.541
  369    HE2  TYR  53           2HE      TYR  53   8.489   9.125   3.865
  370    HH   TYR  53           HH       TYR  53  10.293   6.968   1.821
  371    H    LYS  54           H        LYS  54   3.724  11.306  -1.306
  372    HA   LYS  54           HA       LYS  54   0.870  10.542  -1.344
  373   1HB   LYS  54          2HB       LYS  54   0.491  13.064  -1.096
  374   2HB   LYS  54          1HB       LYS  54   1.096  12.216   0.323
  375   1HG   LYS  54          2HG       LYS  54   3.242  13.107   0.092
  376   2HG   LYS  54          1HG       LYS  54   2.963  13.577  -1.582
  377   1HD   LYS  54          2HD       LYS  54   1.485  15.336  -0.908
  378   2HD   LYS  54          1HD       LYS  54   1.527  14.791   0.771
  379   1HE   LYS  54          2HE       LYS  54   3.753  15.477   1.055
  380   2HE   LYS  54          1HE       LYS  54   4.024  15.603  -0.681
  381   1HZ   LYS  54          1HZ       LYS  54   2.099  17.353   0.735
  382   2HZ   LYS  54          2HZ       LYS  54   2.789  17.564  -0.803
  383   3HZ   LYS  54          3HZ       LYS  54   3.741  17.748   0.587
  384    H    ASP  55           H        ASP  55  -0.354  11.340  -3.144
  385    HA   ASP  55           HA       ASP  55   1.232  12.566  -5.292
  386   1HB   ASP  55          2HB       ASP  55   0.373  10.330  -5.910
  387   2HB   ASP  55          1HB       ASP  55  -1.266  10.894  -5.588
  388    H    THR  56           H        THR  56   0.390  14.398  -6.325
  389    HA   THR  56           HA       THR  56  -1.568  15.816  -4.695
  390    HB   THR  56           HB       THR  56  -0.810  17.773  -6.218
  391    HG1  THR  56           1HG      THR  56   0.888  17.421  -7.481
  392   1HG2  THR  56          1HG2      THR  56   1.121  16.470  -4.295
  393   2HG2  THR  56          2HG2      THR  56  -0.200  17.555  -3.862
  394   3HG2  THR  56          3HG2      THR  56   1.161  18.158  -4.807
  395    H    THR  57           H        THR  57  -1.276  14.334  -7.798
  396    HA   THR  57           HA       THR  57  -3.667  15.542  -8.880
  397    HB   THR  57           HB       THR  57  -2.476  12.901  -9.744
  398    HG1  THR  57           1HG      THR  57  -0.903  14.741  -9.624
  399   1HG2  THR  57          1HG2      THR  57  -4.635  13.523 -10.724
  400   2HG2  THR  57          2HG2      THR  57  -3.354  13.544 -11.935
  401   3HG2  THR  57          3HG2      THR  57  -3.951  15.058 -11.257
  402    H    ASN  58           H        ASN  58  -2.873  13.353  -6.539
  403    HA   ASN  58           HA       ASN  58  -4.059  12.198  -5.033
  404   1HB   ASN  58          2HB       ASN  58  -6.461  13.140  -6.595
  405   2HB   ASN  58          1HB       ASN  58  -6.548  12.231  -5.088
  406   1HD2  ASN  58          1HD2      ASN  58  -6.048  15.284  -6.533
  407   2HD2  ASN  58          2HD2      ASN  58  -5.806  16.192  -5.084
  408    H    LYS  59           H        LYS  59  -2.857  10.986  -7.247
  409    HA   LYS  59           HA       LYS  59  -4.345   8.505  -6.993
  410   1HB   LYS  59          2HB       LYS  59  -4.370   7.923  -9.243
  411   2HB   LYS  59          1HB       LYS  59  -4.714   9.637  -9.302
  412   1HG   LYS  59          2HG       LYS  59  -2.032   8.420  -9.832
  413   2HG   LYS  59          1HG       LYS  59  -3.202   8.889 -11.064
  414   1HD   LYS  59          2HD       LYS  59  -3.065  11.192 -10.368
  415   2HD   LYS  59          1HD       LYS  59  -1.996  10.753  -9.031
  416   1HE   LYS  59          2HE       LYS  59  -0.491   9.759 -10.843
  417   2HE   LYS  59          1HE       LYS  59  -1.455  10.715 -11.965
  418   1HZ   LYS  59          1HZ       LYS  59   0.507  11.936 -11.295
  419   2HZ   LYS  59          2HZ       LYS  59   0.099  11.766  -9.656
  420   3HZ   LYS  59          3HZ       LYS  59  -0.873  12.701 -10.682
  421    H    LYS  60           H        LYS  60  -2.888   8.041  -5.366
  422    HA   LYS  60           HA       LYS  60  -0.494   6.741  -6.411
  423   1HB   LYS  60          2HB       LYS  60   0.231   8.960  -5.505
  424   2HB   LYS  60          1HB       LYS  60  -0.420   8.505  -3.940
  425   1HG   LYS  60          2HG       LYS  60   1.773   6.952  -5.320
  426   2HG   LYS  60          1HG       LYS  60   2.082   8.290  -4.214
  427   1HD   LYS  60          2HD       LYS  60   0.975   7.108  -2.419
  428   2HD   LYS  60          1HD       LYS  60   0.521   5.808  -3.517
  429   1HE   LYS  60          2HE       LYS  60   2.372   4.929  -2.465
  430   2HE   LYS  60          1HE       LYS  60   3.070   5.610  -3.932
  431   1HZ   LYS  60          1HZ       LYS  60   3.017   6.976  -1.296
  432   2HZ   LYS  60          2HZ       LYS  60   3.800   7.520  -2.696
  433   3HZ   LYS  60          3HZ       LYS  60   4.345   6.121  -1.907
  434    H    ILE  61           H        ILE  61  -0.415   4.722  -5.721
  435    HA   ILE  61           HA       ILE  61  -1.405   4.125  -3.022
  436    HB   ILE  61           HB       ILE  61  -2.200   1.902  -3.803
  437   1HG1  ILE  61          2HG1      ILE  61  -1.672   3.065  -6.545
  438   2HG1  ILE  61          1HG1      ILE  61  -0.980   1.596  -5.854
  439   1HG2  ILE  61          1HG2      ILE  61  -4.289   2.702  -4.813
  440   2HG2  ILE  61          2HG2      ILE  61  -3.537   4.275  -5.082
  441   3HG2  ILE  61          3HG2      ILE  61  -3.785   3.685  -3.438
  442   1HD1  ILE  61          1HD1      ILE  61  -3.885   1.994  -6.542
  443   2HD1  ILE  61          2HD1      ILE  61  -3.149   0.521  -5.917
  444   3HD1  ILE  61          3HD1      ILE  61  -2.703   1.118  -7.515
  445    H    THR  62           H        THR  62   0.096   3.071  -1.815
  446    HA   THR  62           HA       THR  62   2.579   2.290  -3.104
  447    HB   THR  62           HB       THR  62   1.796   2.284  -0.180
  448    HG1  THR  62           1HG      THR  62   3.578   4.020  -0.381
  449   1HG2  THR  62          1HG2      THR  62   4.499   1.830  -1.441
  450   2HG2  THR  62          2HG2      THR  62   3.508   0.592  -0.668
  451   3HG2  THR  62          3HG2      THR  62   4.153   1.929   0.288
  452    H    ASN  63           H        ASN  63   2.822   0.360  -3.918
  453    HA   ASN  63           HA       ASN  63   2.834  -2.055  -2.759
  454   1HB   ASN  63          2HB       ASN  63   0.512  -1.965  -2.110
  455   2HB   ASN  63          1HB       ASN  63   0.020  -1.546  -3.746
  456   1HD2  ASN  63          1HD2      ASN  63   1.193  -4.076  -1.669
  457   2HD2  ASN  63          2HD2      ASN  63   0.766  -5.391  -2.701
  458    HA   PRO  64           HA       PRO  64   1.995  -3.050  -7.259
  459   1HB   PRO  64          2HB       PRO  64   0.710  -1.092  -8.809
  460   2HB   PRO  64          1HB       PRO  64  -0.069  -2.423  -7.951
  461   1HG   PRO  64          2HG       PRO  64  -0.333   0.325  -7.392
  462   2HG   PRO  64          1HG       PRO  64  -0.888  -1.006  -6.372
  463   1HD   PRO  64          2HD       PRO  64   1.600   0.616  -6.205
  464   2HD   PRO  64          1HD       PRO  64   0.617  -0.076  -4.882
  465    H    PHE  65           H        PHE  65   2.767  -2.760  -9.485
  466    HA   PHE  65           HA       PHE  65   4.676  -0.561  -9.831
  467   1HB   PHE  65          2HB       PHE  65   6.331  -2.291 -10.714
  468   2HB   PHE  65          1HB       PHE  65   6.094  -2.264  -8.972
  469    HD1  PHE  65           1HD      PHE  65   4.998  -4.106  -7.839
  470    HD2  PHE  65           2HD      PHE  65   5.552  -4.144 -12.057
  471    HE1  PHE  65           1HE      PHE  65   4.479  -6.511  -7.883
  472    HE2  PHE  65           2HE      PHE  65   5.035  -6.547 -12.108
  473    HZ   PHE  65           HZ       PHE  65   4.507  -7.738  -9.988
  474    H    GLY  66           H        GLY  66   2.153  -0.826 -10.977
  475   1HA   GLY  66          2HA       GLY  66   2.501  -2.095 -13.586
  476   2HA   GLY  66          1HA       GLY  66   1.000  -1.475 -12.914
  477    H    GLY  67           H        GLY  67   2.899   0.960 -12.241
  478   1HA   GLY  67          2HA       GLY  67   2.779   2.207 -14.896
  479   2HA   GLY  67          1HA       GLY  67   1.900   2.949 -13.561
  480    H    GLU  68           H        GLU  68   2.936   4.497 -12.503
  481    HA   GLU  68           HA       GLU  68   5.809   4.817 -12.834
  482   1HB   GLU  68          2HB       GLU  68   4.286   6.763 -12.981
  483   2HB   GLU  68          1HB       GLU  68   3.770   6.469 -11.325
  484   1HG   GLU  68          2HG       GLU  68   5.400   7.762 -10.598
  485   2HG   GLU  68          1HG       GLU  68   6.588   6.671 -11.307
  486    H    LEU  69           H        LEU  69   6.884   3.366 -11.606
  487    HA   LEU  69           HA       LEU  69   6.065   3.058  -8.803
  488   1HB   LEU  69          2HB       LEU  69   7.299   0.948  -8.793
  489   2HB   LEU  69          1HB       LEU  69   6.054   0.974 -10.025
  490    HG   LEU  69           HG       LEU  69   8.775   1.744 -10.913
  491   1HD1  LEU  69          1HD1      LEU  69   9.496  -0.580 -11.088
  492   2HD1  LEU  69          2HD1      LEU  69   8.053  -1.100 -10.214
  493   3HD1  LEU  69          3HD1      LEU  69   9.266  -0.109  -9.403
  494   1HD2  LEU  69          1HD2      LEU  69   6.875   1.608 -12.465
  495   2HD2  LEU  69          2HD2      LEU  69   6.661  -0.090 -12.048
  496   3HD2  LEU  69          3HD2      LEU  69   8.129   0.439 -12.866
  497    H    ASN  70           H        ASN  70   7.339   3.555  -7.167
  498    HA   ASN  70           HA       ASN  70  10.195   4.102  -7.665
  499   1HB   ASN  70          2HB       ASN  70   8.812   6.170  -7.187
  500   2HB   ASN  70          1HB       ASN  70   8.475   5.494  -5.598
  501   1HD2  ASN  70          1HD2      ASN  70  10.002   5.704  -3.987
  502   2HD2  ASN  70          2HD2      ASN  70  11.540   6.466  -4.224
  503    H    VAL  71           H        VAL  71  11.536   2.862  -6.462
  504    HA   VAL  71           HA       VAL  71  10.288   0.836  -4.818
  505    HB   VAL  71           HB       VAL  71  12.507  -0.200  -4.717
  506   1HG1  VAL  71          1HG1      VAL  71  11.684   0.689  -7.475
  507   2HG1  VAL  71          2HG1      VAL  71  11.108  -0.733  -6.604
  508   3HG1  VAL  71          3HG1      VAL  71  12.790  -0.640  -7.129
  509   1HG2  VAL  71          1HG2      VAL  71  14.398   0.756  -5.945
  510   2HG2  VAL  71          2HG2      VAL  71  13.881   1.814  -4.631
  511   3HG2  VAL  71          3HG2      VAL  71  13.441   2.196  -6.297
  512    H    GLY  72           H        GLY  72  10.836   0.320  -2.674
  513   1HA   GLY  72          2HA       GLY  72  12.778   1.792  -1.187
  514   2HA   GLY  72          1HA       GLY  72  11.147   2.327  -0.809
  515    HA   PRO  73           HA       PRO  73  11.840  -1.630   1.585
  516   1HB   PRO  73          2HB       PRO  73  13.738  -1.223   3.386
  517   2HB   PRO  73          1HB       PRO  73  14.170  -1.581   1.709
  518   1HG   PRO  73          2HG       PRO  73  14.238   1.009   3.171
  519   2HG   PRO  73          1HG       PRO  73  15.306   0.411   1.892
  520   1HD   PRO  73          2HD       PRO  73  13.084   2.163   1.601
  521   2HD   PRO  73          1HD       PRO  73  14.047   1.424   0.305
  522    H    ALA  74           H        ALA  74  11.156  -2.077   3.833
  523    HA   ALA  74           HA       ALA  74  10.159   0.313   5.227
  524   1HB   ALA  74          1HB       ALA  74   8.361  -0.560   3.827
  525   2HB   ALA  74          2HB       ALA  74   7.987  -0.694   5.546
  526   3HB   ALA  74          3HB       ALA  74   8.492  -2.119   4.639
  527    H    ASN  75           H        ASN  75  11.465   0.178   6.926
  528    HA   ASN  75           HA       ASN  75  12.267  -0.362   8.946
  529   1HB   ASN  75          2HB       ASN  75   9.848  -0.185   9.452
  530   2HB   ASN  75          1HB       ASN  75   9.702  -1.924   9.224
  531   1HD2  ASN  75          1HD2      ASN  75  12.388  -0.223  10.736
  532   2HD2  ASN  75          2HD2      ASN  75  12.159  -0.889  12.317
  533    H    ASN  76           H        ASN  76  10.538  -3.400   8.446
  534    HA   ASN  76           HA       ASN  76  13.017  -4.901   8.515
  535   1HB   ASN  76          2HB       ASN  76  12.524  -4.370  10.906
  536   2HB   ASN  76          1HB       ASN  76  10.995  -5.232  10.741
  537   1HD2  ASN  76          1HD2      ASN  76  14.446  -5.516  10.958
  538   2HD2  ASN  76          2HD2      ASN  76  14.486  -7.234  11.210
  539    H    ASN  77           H        ASN  77  12.666  -7.223   8.227
  540    HA   ASN  77           HA       ASN  77  10.789  -7.573   6.120
  541   1HB   ASN  77          2HB       ASN  77  13.091  -8.565   6.210
  542   2HB   ASN  77          1HB       ASN  77  12.504  -9.676   7.441
  543   1HD2  ASN  77          1HD2      ASN  77  12.889 -11.481   6.222
  544   2HD2  ASN  77          2HD2      ASN  77  11.959 -11.890   4.825
  545    H    THR  78           H        THR  78  10.712  -8.370   9.527
  546    HA   THR  78           HA       THR  78   8.492 -10.203   9.117
  547    HB   THR  78           HB       THR  78  10.147 -10.674  10.910
  548    HG1  THR  78           1HG      THR  78   8.579 -11.309  12.398
  549   1HG2  THR  78          1HG2      THR  78  10.569  -8.381  11.668
  550   2HG2  THR  78          2HG2      THR  78  10.053  -9.411  13.004
  551   3HG2  THR  78          3HG2      THR  78   8.916  -8.275  12.278
  552    H    ALA  79           H        ALA  79   9.056  -6.907  10.110
  553    HA   ALA  79           HA       ALA  79   6.380  -6.443  11.028
  554   1HB   ALA  79          1HB       ALA  79   8.277  -5.135  11.877
  555   2HB   ALA  79          2HB       ALA  79   7.046  -4.102  11.150
  556   3HB   ALA  79          3HB       ALA  79   8.529  -4.463  10.265
  557    H    PHE  80           H        PHE  80   8.247  -5.580   8.148
  558    HA   PHE  80           HA       PHE  80   5.779  -5.516   6.584
  559   1HB   PHE  80          2HB       PHE  80   7.870  -3.326   6.459
  560   2HB   PHE  80          1HB       PHE  80   6.408  -3.427   5.486
  561    HD1  PHE  80           1HD      PHE  80   7.861  -2.174   8.467
  562    HD2  PHE  80           2HD      PHE  80   4.171  -3.395   6.736
  563    HE1  PHE  80           1HE      PHE  80   6.639  -0.918  10.196
  564    HE2  PHE  80           2HE      PHE  80   2.944  -2.141   8.455
  565    HZ   PHE  80           HZ       PHE  80   4.176  -0.902  10.189
  566    H    GLY  81           H        GLY  81   7.815  -4.239   4.530
  567   1HA   GLY  81          2HA       GLY  81   9.897  -6.175   4.270
  568   2HA   GLY  81          1HA       GLY  81   8.604  -6.462   3.110
  569    H    TYR  82           H        TYR  82   7.995  -4.700   1.724
  570    HA   TYR  82           HA       TYR  82   9.923  -2.554   1.390
  571   1HB   TYR  82          2HB       TYR  82  10.279  -3.046  -0.987
  572   2HB   TYR  82          1HB       TYR  82  10.826  -4.393   0.003
  573    HD1  TYR  82           1HD      TYR  82   9.432  -6.479   0.111
  574    HD2  TYR  82           2HD      TYR  82   8.555  -3.309  -2.587
  575    HE1  TYR  82           1HE      TYR  82   8.019  -7.997  -1.209
  576    HE2  TYR  82           2HE      TYR  82   7.141  -4.819  -3.913
  577    HH   TYR  82           HH       TYR  82   6.084  -7.792  -2.802
  578    H    TYR  83           H        TYR  83   9.100  -0.923  -0.141
  579    HA   TYR  83           HA       TYR  83   6.221  -1.152  -0.602
  580   1HB   TYR  83          2HB       TYR  83   5.755   1.017   0.268
  581   2HB   TYR  83          1HB       TYR  83   6.670   0.166   1.499
  582    HD1  TYR  83           1HD      TYR  83   9.014   0.802   1.957
  583    HD2  TYR  83           2HD      TYR  83   6.607   2.987  -0.781
  584    HE1  TYR  83           1HE      TYR  83  10.610   2.674   2.054
  585    HE2  TYR  83           2HE      TYR  83   8.192   4.861  -0.689
  586    HH   TYR  83           HH       TYR  83  11.249   4.646   0.444
  587    H    LEU  84           H        LEU  84   5.604  -0.523  -2.547
  588    HA   LEU  84           HA       LEU  84   7.526   0.966  -4.195
  589   1HB   LEU  84          2HB       LEU  84   5.496  -1.117  -4.801
  590   2HB   LEU  84          1HB       LEU  84   5.718   0.148  -5.991
  591    HG   LEU  84           HG       LEU  84   7.031  -1.867  -6.503
  592   1HD1  LEU  84          1HD1      LEU  84   9.155  -0.749  -6.914
  593   2HD1  LEU  84          2HD1      LEU  84   8.704   0.534  -5.791
  594   3HD1  LEU  84          3HD1      LEU  84   7.793   0.308  -7.285
  595   1HD2  LEU  84          1HD2      LEU  84   8.522  -1.219  -3.963
  596   2HD2  LEU  84          2HD2      LEU  84   8.963  -2.455  -5.143
  597   3HD2  LEU  84          3HD2      LEU  84   7.470  -2.612  -4.218
  598    H    THR  85           H        THR  85   7.086   3.033  -4.507
  599    HA   THR  85           HA       THR  85   4.450   4.081  -3.976
  600    HB   THR  85           HB       THR  85   7.104   5.327  -4.645
  601    HG1  THR  85           1HG      THR  85   6.588   4.789  -2.452
  602   1HG2  THR  85          1HG2      THR  85   6.061   7.531  -4.625
  603   2HG2  THR  85          2HG2      THR  85   4.468   6.789  -4.482
  604   3HG2  THR  85          3HG2      THR  85   5.423   6.552  -5.945
  605    H    LEU  86           H        LEU  86   3.032   3.616  -5.514
  606    HA   LEU  86           HA       LEU  86   3.805   4.131  -8.300
  607   1HB   LEU  86          2HB       LEU  86   3.100   1.783  -7.648
  608   2HB   LEU  86          1HB       LEU  86   1.507   2.450  -7.349
  609    HG   LEU  86           HG       LEU  86   1.783   3.336  -9.821
  610   1HD1  LEU  86          1HD1      LEU  86   3.505   0.866  -9.785
  611   2HD1  LEU  86          2HD1      LEU  86   4.066   2.513 -10.066
  612   3HD1  LEU  86          3HD1      LEU  86   2.972   1.747 -11.216
  613   1HD2  LEU  86          1HD2      LEU  86   1.085   0.490  -9.135
  614   2HD2  LEU  86          2HD2      LEU  86   0.592   1.363 -10.587
  615   3HD2  LEU  86          3HD2      LEU  86   0.010   1.881  -9.004
  616    H    THR  87           H        THR  87   2.756   5.756  -9.327
  617    HA   THR  87           HA       THR  87   0.462   6.925  -7.975
  618    HB   THR  87           HB       THR  87   0.552   8.622  -9.829
  619    HG1  THR  87           1HG      THR  87   2.426   8.607 -11.145
  620   1HG2  THR  87          1HG2      THR  87   2.591   9.726  -9.007
  621   2HG2  THR  87          2HG2      THR  87   3.085   8.219  -8.235
  622   3HG2  THR  87          3HG2      THR  87   1.631   9.052  -7.689
  623    H    ARG  88           H        ARG  88  -1.496   6.405  -8.425
  624    HA   ARG  88           HA       ARG  88  -2.870   6.248 -10.719
  625   1HB   ARG  88          2HB       ARG  88  -1.266   4.283 -11.275
  626   2HB   ARG  88          1HB       ARG  88  -2.160   3.386 -10.056
  627   1HG   ARG  88          2HG       ARG  88  -4.150   3.447 -11.288
  628   2HG   ARG  88          1HG       ARG  88  -3.559   4.736 -12.339
  629   1HD   ARG  88          2HD       ARG  88  -3.558   2.639 -13.532
  630   2HD   ARG  88          1HD       ARG  88  -1.900   3.183 -13.275
  631    HE   ARG  88           HE       ARG  88  -3.206   1.058 -11.698
  632   1HH1  ARG  88          1HH1      ARG  88  -0.378   2.517 -13.167
  633   2HH1  ARG  88          2HH1      ARG  88   0.678   1.203 -12.746
  634   1HH2  ARG  88          1HH2      ARG  88  -1.860  -0.691 -11.162
  635   2HH2  ARG  88          2HH2      ARG  88  -0.193  -0.671 -11.649
  636    H    LEU  89           H        LEU  89  -4.976   6.233 -10.101
  637    HA   LEU  89           HA       LEU  89  -5.907   4.538  -7.977
  638   1HB   LEU  89          2HB       LEU  89  -4.781   6.502  -6.821
  639   2HB   LEU  89          1HB       LEU  89  -6.033   7.516  -7.501
  640    HG   LEU  89           HG       LEU  89  -6.333   6.811  -5.085
  641   1HD1  LEU  89          1HD1      LEU  89  -8.526   6.145  -7.041
  642   2HD1  LEU  89          2HD1      LEU  89  -8.180   7.729  -6.346
  643   3HD1  LEU  89          3HD1      LEU  89  -8.748   6.419  -5.312
  644   1HD2  LEU  89          1HD2      LEU  89  -5.638   4.511  -5.244
  645   2HD2  LEU  89          2HD2      LEU  89  -6.928   4.161  -6.391
  646   3HD2  LEU  89          3HD2      LEU  89  -7.320   4.576  -4.724
  647    H    ASP  90           H        ASP  90  -8.046   4.245  -8.050
  648    HA   ASP  90           HA       ASP  90  -9.670   5.936  -9.822
  649   1HB   ASP  90          2HB       ASP  90  -9.727   2.901  -9.720
  650   2HB   ASP  90          1HB       ASP  90 -10.860   3.904 -10.613
  651    H    LYS  91           H        LYS  91 -11.974   5.875  -9.254
  652    HA   LYS  91           HA       LYS  91 -12.414   5.593  -6.438
  653   1HB   LYS  91          2HB       LYS  91 -13.634   7.190  -8.045
  654   2HB   LYS  91          1HB       LYS  91 -14.580   5.792  -8.536
  655   1HG   LYS  91          2HG       LYS  91 -14.384   6.601  -5.655
  656   2HG   LYS  91          1HG       LYS  91 -15.542   7.359  -6.746
  657   1HD   LYS  91          2HD       LYS  91 -16.651   5.295  -7.144
  658   2HD   LYS  91          1HD       LYS  91 -15.359   4.376  -6.366
  659   1HE   LYS  91          2HE       LYS  91 -17.344   4.570  -4.935
  660   2HE   LYS  91          1HE       LYS  91 -15.933   5.338  -4.214
  661   1HZ   LYS  91          1HZ       LYS  91 -17.957   6.857  -5.755
  662   2HZ   LYS  91          2HZ       LYS  91 -16.768   7.465  -4.708
  663   3HZ   LYS  91          3HZ       LYS  91 -18.089   6.598  -4.084
  664    H    ALA  92           H        ALA  92 -13.035   3.716  -9.326
  665    HA   ALA  92           HA       ALA  92 -14.382   1.547  -8.146
  666   1HB   ALA  92          1HB       ALA  92 -14.233   1.864 -10.568
  667   2HB   ALA  92          2HB       ALA  92 -13.656   0.267 -10.095
  668   3HB   ALA  92          3HB       ALA  92 -12.502   1.535 -10.509
  669    H    ALA  93           H        ALA  93 -10.989   2.414  -8.331
  670    HA   ALA  93           HA       ALA  93  -9.928  -0.036  -7.380
  671   1HB   ALA  93          1HB       ALA  93  -8.543   1.621  -8.531
  672   2HB   ALA  93          2HB       ALA  93  -7.879   1.220  -6.946
  673   3HB   ALA  93          3HB       ALA  93  -8.749   2.737  -7.181
  674    H    CYS  94           H        CYS  94 -11.021   2.926  -5.785
  675    HA   CYS  94           HA       CYS  94 -10.415   2.287  -3.145
  676   1HB   CYS  94          2HB       CYS  94 -11.268   4.465  -3.655
  677   2HB   CYS  94          1HB       CYS  94 -12.745   3.796  -4.343
  678    H    VAL  95           H        VAL  95 -13.337   1.504  -5.019
  679    HA   VAL  95           HA       VAL  95 -14.575  -0.035  -3.015
  680    HB   VAL  95           HB       VAL  95 -14.919  -0.280  -6.006
  681   1HG1  VAL  95          1HG1      VAL  95 -15.859  -2.188  -4.834
  682   2HG1  VAL  95          2HG1      VAL  95 -17.150  -1.160  -5.458
  683   3HG1  VAL  95          3HG1      VAL  95 -16.736  -1.112  -3.746
  684   1HG2  VAL  95          1HG2      VAL  95 -15.305   2.004  -5.280
  685   2HG2  VAL  95          2HG2      VAL  95 -16.398   1.438  -4.017
  686   3HG2  VAL  95          3HG2      VAL  95 -16.831   1.237  -5.715
  687    H    SER  96           H        SER  96 -12.333  -0.821  -5.552
  688    HA   SER  96           HA       SER  96 -12.313  -3.594  -5.406
  689   1HB   SER  96          2HB       SER  96 -10.107  -1.619  -5.942
  690   2HB   SER  96          1HB       SER  96  -9.955  -3.352  -6.230
  691    HG   SER  96           HG       SER  96 -11.915  -1.657  -7.409
  692    H    LEU  97           H        LEU  97 -10.596  -1.199  -3.428
  693    HA   LEU  97           HA       LEU  97  -9.071  -3.129  -1.986
  694   1HB   LEU  97          2HB       LEU  97  -9.751  -0.273  -1.273
  695   2HB   LEU  97          1HB       LEU  97  -8.535  -1.259  -0.478
  696    HG   LEU  97           HG       LEU  97  -8.461  -0.460  -3.394
  697   1HD1  LEU  97          1HD1      LEU  97  -8.135   1.472  -1.963
  698   2HD1  LEU  97          2HD1      LEU  97  -6.618   1.011  -2.737
  699   3HD1  LEU  97          3HD1      LEU  97  -6.905   0.608  -1.043
  700   1HD2  LEU  97          1HD2      LEU  97  -6.160  -1.310  -3.308
  701   2HD2  LEU  97          2HD2      LEU  97  -7.347  -2.573  -2.981
  702   3HD2  LEU  97          3HD2      LEU  97  -6.433  -1.859  -1.654
  703    H    ALA  98           H        ALA  98 -12.166  -1.554  -1.502
  704    HA   ALA  98           HA       ALA  98 -12.624  -2.554   1.119
  705   1HB   ALA  98          1HB       ALA  98 -14.631  -1.689  -0.961
  706   2HB   ALA  98          2HB       ALA  98 -13.838  -0.632   0.206
  707   3HB   ALA  98          3HB       ALA  98 -14.937  -1.892   0.766
  708    H    THR  99           H        THR  99 -12.752  -3.949  -2.002
  709    HA   THR  99           HA       THR  99 -14.225  -6.272  -0.997
  710    HB   THR  99           HB       THR  99 -14.328  -7.027  -3.332
  711    HG1  THR  99           1HG      THR  99 -12.371  -5.218  -3.668
  712   1HG2  THR  99          1HG2      THR  99 -15.807  -5.275  -4.204
  713   2HG2  THR  99          2HG2      THR  99 -15.207  -4.162  -2.974
  714   3HG2  THR  99          3HG2      THR  99 -16.116  -5.596  -2.497
  715    H    LEU 100           H        LEU 100 -11.190  -5.216  -0.922
  716    HA   LEU 100           HA       LEU 100  -9.970  -7.815  -1.583
  717   1HB   LEU 100          2HB       LEU 100  -9.192  -5.444  -2.508
  718   2HB   LEU 100          1HB       LEU 100  -8.358  -5.372  -0.971
  719    HG   LEU 100           HG       LEU 100  -7.970  -7.535  -3.046
  720   1HD1  LEU 100          1HD1      LEU 100  -6.240  -5.172  -2.333
  721   2HD1  LEU 100          2HD1      LEU 100  -7.152  -5.381  -3.827
  722   3HD1  LEU 100          3HD1      LEU 100  -5.810  -6.463  -3.453
  723   1HD2  LEU 100          1HD2      LEU 100  -7.519  -8.306  -0.765
  724   2HD2  LEU 100          2HD2      LEU 100  -6.428  -6.940  -0.519
  725   3HD2  LEU 100          3HD2      LEU 100  -6.035  -8.181  -1.710
  726    H    ASN 101           H        ASN 101  -9.473  -9.091   0.084
  727    HA   ASN 101           HA       ASN 101  -9.694  -8.093   2.772
  728   1HB   ASN 101          2HB       ASN 101 -10.467 -10.367   2.164
  729   2HB   ASN 101          1HB       ASN 101  -8.798 -10.829   1.839
  730   1HD2  ASN 101          1HD2      ASN 101  -9.975  -8.770   4.441
  731   2HD2  ASN 101          2HD2      ASN 101  -9.549  -9.851   5.724
  732    H    LEU 102           H        LEU 102  -8.018  -6.532   2.704
  733    HA   LEU 102           HA       LEU 102  -5.279  -7.381   2.471
  734   1HB   LEU 102          2HB       LEU 102  -6.535  -4.772   3.338
  735   2HB   LEU 102          1HB       LEU 102  -4.804  -5.030   3.242
  736    HG   LEU 102           HG       LEU 102  -6.692  -5.259   0.896
  737   1HD1  LEU 102          1HD1      LEU 102  -4.843  -3.021   1.698
  738   2HD1  LEU 102          2HD1      LEU 102  -6.604  -2.967   1.672
  739   3HD1  LEU 102          3HD1      LEU 102  -5.705  -3.134   0.165
  740   1HD2  LEU 102          1HD2      LEU 102  -4.642  -5.249  -0.430
  741   2HD2  LEU 102          2HD2      LEU 102  -4.671  -6.614   0.686
  742   3HD2  LEU 102          3HD2      LEU 102  -3.680  -5.201   1.048
  743    H    GLY 103           H        GLY 103  -5.735  -9.087   4.089
  744   1HA   GLY 103          2HA       GLY 103  -4.841  -8.088   6.709
  745   2HA   GLY 103          1HA       GLY 103  -6.170  -9.239   6.624
  746    H    THR 104           H        THR 104  -5.680 -11.285   5.428
  747    HA   THR 104           HA       THR 104  -3.575 -12.628   6.657
  748    HB   THR 104           HB       THR 104  -5.005 -13.450   4.127
  749    HG1  THR 104           1HG      THR 104  -6.595 -14.244   5.452
  750   1HG2  THR 104          1HG2      THR 104  -3.645 -15.084   6.275
  751   2HG2  THR 104          2HG2      THR 104  -3.042 -14.820   4.638
  752   3HG2  THR 104          3HG2      THR 104  -4.529 -15.733   4.894
  753    H    SER 105           H        SER 105  -3.871 -11.635   3.239
  754    HA   SER 105           HA       SER 105  -1.003 -12.159   2.916
  755   1HB   SER 105          2HB       SER 105  -2.704 -13.176   1.336
  756   2HB   SER 105          1HB       SER 105  -3.009 -11.548   0.740
  757    HG   SER 105           HG       SER 105  -0.396 -11.853   0.709
  758    H    ALA 106           H        ALA 106  -2.106  -9.783   4.297
  759    HA   ALA 106           HA       ALA 106  -0.671  -7.813   2.659
  760   1HB   ALA 106          1HB       ALA 106  -2.196  -6.057   3.422
  761   2HB   ALA 106          2HB       ALA 106  -3.173  -7.272   4.249
  762   3HB   ALA 106          3HB       ALA 106  -3.038  -7.295   2.491
  763    H    LYS 107           H        LYS 107   0.144  -5.986   3.985
  764    HA   LYS 107           HA       LYS 107   1.057  -7.008   6.576
  765   1HB   LYS 107          2HB       LYS 107   2.436  -5.828   4.490
  766   2HB   LYS 107          1HB       LYS 107   2.248  -4.512   5.638
  767   1HG   LYS 107          2HG       LYS 107   4.281  -5.467   6.210
  768   2HG   LYS 107          1HG       LYS 107   3.153  -6.158   7.378
  769   1HD   LYS 107          2HD       LYS 107   2.953  -8.159   5.917
  770   2HD   LYS 107          1HD       LYS 107   4.195  -7.468   4.869
  771   1HE   LYS 107          2HE       LYS 107   5.277  -9.019   6.307
  772   2HE   LYS 107          1HE       LYS 107   5.710  -7.404   6.861
  773   1HZ   LYS 107          1HZ       LYS 107   3.855  -9.338   8.101
  774   2HZ   LYS 107          2HZ       LYS 107   3.775  -7.688   8.481
  775   3HZ   LYS 107          3HZ       LYS 107   5.193  -8.561   8.794
  776    H    GLY 108           H        GLY 108  -0.519  -4.356   4.961
  777   1HA   GLY 108          2HA       GLY 108  -2.255  -3.621   6.951
  778   2HA   GLY 108          1HA       GLY 108  -0.807  -2.667   7.243
  779    H    TYR 109           H        TYR 109  -3.216  -1.456   6.596
  780    HA   TYR 109           HA       TYR 109  -2.470  -0.238   4.055
  781   1HB   TYR 109          2HB       TYR 109  -4.069  -1.882   3.354
  782   2HB   TYR 109          1HB       TYR 109  -5.164  -1.466   4.665
  783    HD1  TYR 109           1HD      TYR 109  -3.469   1.077   2.646
  784    HD2  TYR 109           2HD      TYR 109  -7.065  -1.111   3.217
  785    HE1  TYR 109           1HE      TYR 109  -4.632   2.608   1.115
  786    HE2  TYR 109           2HE      TYR 109  -8.244   0.414   1.685
  787    HH   TYR 109           HH       TYR 109  -7.980   2.739   0.825
  788    H    GLY 110           H        GLY 110  -2.553   1.934   4.169
  789   1HA   GLY 110          2HA       GLY 110  -4.209   3.119   6.305
  790   2HA   GLY 110          1HA       GLY 110  -2.544   3.623   6.042
  791    H    VAL 111           H        VAL 111  -4.625   5.458   6.001
  792    HA   VAL 111           HA       VAL 111  -4.563   6.262   3.170
  793    HB   VAL 111           HB       VAL 111  -6.853   5.623   3.637
  794   1HG1  VAL 111          1HG1      VAL 111  -6.752   7.575   5.935
  795   2HG1  VAL 111          2HG1      VAL 111  -6.823   5.817   6.067
  796   3HG1  VAL 111          3HG1      VAL 111  -8.184   6.703   5.382
  797   1HG2  VAL 111          1HG2      VAL 111  -6.532   7.559   2.202
  798   2HG2  VAL 111          2HG2      VAL 111  -6.574   8.623   3.606
  799   3HG2  VAL 111          3HG2      VAL 111  -8.014   7.716   3.146
  800    H    ASN 112           H        ASN 112  -3.721   8.204   2.799
  801    HA   ASN 112           HA       ASN 112  -2.878  10.283   3.091
  802   1HB   ASN 112          2HB       ASN 112  -4.903  10.186   5.235
  803   2HB   ASN 112          1HB       ASN 112  -3.606  11.346   5.480
  804   1HD2  ASN 112          1HD2      ASN 112  -6.457  11.772   4.911
  805   2HD2  ASN 112          2HD2      ASN 112  -6.496  12.753   3.487
  806    H    ILE 113           H        ILE 113  -1.839   7.709   4.494
  807    HA   ILE 113           HA       ILE 113  -0.082   8.824   6.490
  808    HB   ILE 113           HB       ILE 113  -0.409   6.085   5.312
  809   1HG1  ILE 113          2HG1      ILE 113  -0.475   5.494   7.766
  810   2HG1  ILE 113          1HG1      ILE 113  -0.408   7.215   8.114
  811   1HG2  ILE 113          1HG2      ILE 113   1.947   6.951   6.980
  812   2HG2  ILE 113          2HG2      ILE 113   1.995   6.442   5.293
  813   3HG2  ILE 113          3HG2      ILE 113   1.548   5.287   6.549
  814   1HD1  ILE 113          1HD1      ILE 113  -2.579   5.797   6.595
  815   2HD1  ILE 113          2HD1      ILE 113  -2.514   7.529   6.923
  816   3HD1  ILE 113          3HD1      ILE 113  -2.671   6.383   8.254
  817    H    SER 114           H        SER 114   1.733   9.840   6.079
  818    HA   SER 114           HA       SER 114   3.114   9.314   3.537
  819   1HB   SER 114          2HB       SER 114   2.291  11.662   3.871
  820   2HB   SER 114          1HB       SER 114   3.327  11.779   5.291
  821    HG   SER 114           HG       SER 114   5.086  11.780   4.034
  822    H    GLY 115           H        GLY 115   4.699   7.865   3.913
  823   1HA   GLY 115          2HA       GLY 115   6.984   7.848   5.019
  824   2HA   GLY 115          1HA       GLY 115   6.086   8.039   6.518
  825    H    GLU 116           H        GLU 116   5.849   5.945   3.640
  826    HA   GLU 116           HA       GLU 116   4.821   3.711   4.852
  827   1HB   GLU 116          2HB       GLU 116   6.694   3.998   2.511
  828   2HB   GLU 116          1HB       GLU 116   5.992   2.461   2.981
  829   1HG   GLU 116          2HG       GLU 116   4.528   3.114   1.375
  830   2HG   GLU 116          1HG       GLU 116   3.744   3.784   2.803
  831    H    ASN 117           H        ASN 117   8.082   4.896   4.937
  832    HA   ASN 117           HA       ASN 117   9.436   2.576   5.719
  833   1HB   ASN 117          2HB       ASN 117  10.457   4.771   5.009
  834   2HB   ASN 117          1HB       ASN 117  10.091   5.385   6.619
  835   1HD2  ASN 117          1HD2      ASN 117  12.002   3.141   4.770
  836   2HD2  ASN 117          2HD2      ASN 117  13.205   2.847   5.987
  837    H    ASN 118           H        ASN 118   7.269   4.628   7.452
  838    HA   ASN 118           HA       ASN 118   7.249   2.777   9.665
  839   1HB   ASN 118          2HB       ASN 118   8.999   4.348  10.396
  840   2HB   ASN 118          1HB       ASN 118   7.898   5.699  10.149
  841   1HD2  ASN 118          1HD2      ASN 118   8.011   6.355  12.272
  842   2HD2  ASN 118          2HD2      ASN 118   7.270   5.471  13.561
  843    H    ILE 119           H        ILE 119   5.171   2.454   8.701
  844    HA   ILE 119           HA       ILE 119   3.297   4.617   8.492
  845    HB   ILE 119           HB       ILE 119   3.240   2.787   6.881
  846   1HG1  ILE 119          2HG1      ILE 119   0.735   2.726   8.577
  847   2HG1  ILE 119          1HG1      ILE 119   1.119   3.994   7.421
  848   1HG2  ILE 119          1HG2      ILE 119   2.503   1.052   9.228
  849   2HG2  ILE 119          2HG2      ILE 119   3.994   0.980   8.288
  850   3HG2  ILE 119          3HG2      ILE 119   2.458   0.552   7.536
  851   1HD1  ILE 119          1HD1      ILE 119   0.654   1.089   6.794
  852   2HD1  ILE 119          2HD1      ILE 119   1.097   2.325   5.618
  853   3HD1  ILE 119          3HD1      ILE 119  -0.446   2.427   6.467
  854    H    THR 120           H        THR 120   1.279   4.745   9.574
  855    HA   THR 120           HA       THR 120   1.433   4.618  12.372
  856    HB   THR 120           HB       THR 120  -1.173   4.806  10.895
  857    HG1  THR 120           1HG      THR 120   0.286   7.159  11.099
  858   1HG2  THR 120          1HG2      THR 120   0.013   6.310  13.233
  859   2HG2  THR 120          2HG2      THR 120  -1.234   5.063  13.312
  860   3HG2  THR 120          3HG2      THR 120  -1.578   6.607  12.535
  861    H    SER 121           H        SER 121  -0.070   3.497  13.828
  862    HA   SER 121           HA       SER 121  -0.161   0.727  13.550
  863   1HB   SER 121          2HB       SER 121  -2.003   2.397  15.273
  864   2HB   SER 121          1HB       SER 121  -1.497   0.732  15.556
  865    HG   SER 121           HG       SER 121  -0.076   3.126  15.901
  866    H    PHE 122           H        PHE 122  -2.039  -0.691  13.381
  867    HA   PHE 122           HA       PHE 122  -3.847   0.343  11.299
  868   1HB   PHE 122          2HB       PHE 122  -3.105  -2.538  11.846
  869   2HB   PHE 122          1HB       PHE 122  -3.989  -1.918  10.455
  870    HD1  PHE 122           1HD      PHE 122  -2.760  -0.283   8.918
  871    HD2  PHE 122           2HD      PHE 122  -0.792  -2.758  11.761
  872    HE1  PHE 122           1HE      PHE 122  -0.652  -0.022   7.676
  873    HE2  PHE 122           2HE      PHE 122   1.319  -2.499  10.528
  874    HZ   PHE 122           HZ       PHE 122   1.409  -1.128   8.515
  875    H    GLY 123           H        GLY 123  -5.916   0.564  11.765
  876   1HA   GLY 123          2HA       GLY 123  -7.041  -0.972  14.020
  877   2HA   GLY 123          1HA       GLY 123  -7.652   0.577  13.453
  878    H    ASN 124           H        ASN 124  -9.564   0.371  12.475
  879    HA   ASN 124           HA       ASN 124  -9.916  -1.764  10.501
  880   1HB   ASN 124          2HB       ASN 124 -12.104  -2.407  11.429
  881   2HB   ASN 124          1HB       ASN 124 -10.802  -2.716  12.573
  882   1HD2  ASN 124          1HD2      ASN 124 -10.641  -1.464  14.432
  883   2HD2  ASN 124          2HD2      ASN 124 -11.956  -0.475  14.988
  884    H    SER 125           H        SER 125  -9.779   1.305  10.785
  885    HA   SER 125           HA       SER 125 -11.996   1.823   8.940
  886   1HB   SER 125          2HB       SER 125 -12.671   2.461  11.301
  887   2HB   SER 125          1HB       SER 125 -11.376   3.654  11.274
  888    HG   SER 125           HG       SER 125 -13.644   3.524   9.564
  889    H    ALA 126           H        ALA 126 -11.662   4.243   8.114
  890    HA   ALA 126           HA       ALA 126  -8.796   4.764   7.821
  891   1HB   ALA 126          1HB       ALA 126  -8.980   4.957   5.408
  892   2HB   ALA 126          2HB       ALA 126 -10.679   4.487   5.489
  893   3HB   ALA 126          3HB       ALA 126  -9.423   3.337   5.948
  894    H    ASP 127           H        ASP 127  -8.703   6.717   8.695
  895    HA   ASP 127           HA       ASP 127  -9.436   8.928   7.100
  896   1HB   ASP 127          2HB       ASP 127 -11.639   8.575   8.205
  897   2HB   ASP 127          1HB       ASP 127 -10.860   8.751   9.771
  898    H    GLN 128           H        GLN 128  -7.308   9.444   7.194
  899    HA   GLN 128           HA       GLN 128  -5.257  10.016   7.974
  900   1HB   GLN 128          2HB       GLN 128  -6.976  11.106  10.195
  901   2HB   GLN 128          1HB       GLN 128  -5.228  11.294  10.191
  902   1HG   GLN 128          2HG       GLN 128  -5.295  12.546   8.164
  903   2HG   GLN 128          1HG       GLN 128  -7.014  12.212   7.959
  904   1HE2  GLN 128          1HE2      GLN 128  -4.632  14.047   9.698
  905   2HE2  GLN 128          2HE2      GLN 128  -5.736  15.179  10.409
  906    H    ALA 129           H        ALA 129  -6.334   7.405   8.504
  907    HA   ALA 129           HA       ALA 129  -4.541   6.532  10.608
  908   1HB   ALA 129          1HB       ALA 129  -6.267   5.262  11.782
  909   2HB   ALA 129          2HB       ALA 129  -7.497   5.916  10.704
  910   3HB   ALA 129          3HB       ALA 129  -6.633   6.988  11.806
  911    H    ALA 130           H        ALA 130  -4.791   4.006  10.761
  912    HA   ALA 130           HA       ALA 130  -4.960   3.007   7.992
  913   1HB   ALA 130          1HB       ALA 130  -3.194   1.409   8.579
  914   2HB   ALA 130          2HB       ALA 130  -3.100   2.113  10.195
  915   3HB   ALA 130          3HB       ALA 130  -2.662   3.079   8.786
  916    H    LYS 131           H        LYS 131  -5.414   0.640   7.847
  917    HA   LYS 131           HA       LYS 131  -6.986  -0.363  10.100
  918   1HB   LYS 131          2HB       LYS 131  -8.909  -0.850   8.865
  919   2HB   LYS 131          1HB       LYS 131  -8.456   0.748   8.299
  920   1HG   LYS 131          2HG       LYS 131  -7.959  -1.855   6.842
  921   2HG   LYS 131          1HG       LYS 131  -9.223  -0.683   6.484
  922   1HD   LYS 131          2HD       LYS 131  -6.261  -0.143   6.326
  923   2HD   LYS 131          1HD       LYS 131  -7.308  -0.493   4.958
  924   1HE   LYS 131          2HE       LYS 131  -8.152   1.726   6.716
  925   2HE   LYS 131          1HE       LYS 131  -6.697   1.996   5.759
  926   1HZ   LYS 131          1HZ       LYS 131  -7.877   1.670   3.774
  927   2HZ   LYS 131          2HZ       LYS 131  -8.898   2.637   4.716
  928   3HZ   LYS 131          3HZ       LYS 131  -9.213   0.986   4.556
  929    H    SER 132           H        SER 132  -7.032  -2.608  10.307
  930    HA   SER 132           HA       SER 132  -4.754  -3.879   9.011
  931   1HB   SER 132          2HB       SER 132  -5.041  -3.954  11.491
  932   2HB   SER 132          1HB       SER 132  -6.494  -4.927  11.256
  933    HG   SER 132           HG       SER 132  -4.881  -6.267   9.920
  934    H    THR 133           H        THR 133  -8.042  -3.678   8.527
  935    HA   THR 133           HA       THR 133  -7.853  -5.733   6.500
  936    HB   THR 133           HB       THR 133 -10.291  -6.421   7.171
  937    HG1  THR 133           1HG      THR 133  -9.212  -5.883   9.748
  938   1HG2  THR 133          1HG2      THR 133  -9.426  -8.331   8.427
  939   2HG2  THR 133          2HG2      THR 133  -7.891  -7.493   8.658
  940   3HG2  THR 133          3HG2      THR 133  -8.399  -7.970   7.039
  941    H    ALA 134           H        ALA 134  -9.007  -5.230   4.716
  942    HA   ALA 134           HA       ALA 134 -10.552  -2.730   4.825
  943   1HB   ALA 134          1HB       ALA 134  -9.853  -2.325   2.512
  944   2HB   ALA 134          2HB       ALA 134  -8.917  -3.820   2.536
  945   3HB   ALA 134          3HB       ALA 134  -8.463  -2.478   3.588
  946    H    ILE 135           H        ILE 135 -11.338  -5.600   5.099
  947    HA   ILE 135           HA       ILE 135 -12.800  -6.153   2.648
  948    HB   ILE 135           HB       ILE 135 -11.618  -8.003   3.664
  949   1HG1  ILE 135          2HG1      ILE 135 -13.475  -9.644   3.816
  950   2HG1  ILE 135          1HG1      ILE 135 -14.618  -8.306   3.879
  951   1HG2  ILE 135          1HG2      ILE 135 -11.598  -7.382   5.976
  952   2HG2  ILE 135          2HG2      ILE 135 -12.347  -8.971   5.822
  953   3HG2  ILE 135          3HG2      ILE 135 -13.350  -7.546   6.080
  954   1HD1  ILE 135          1HD1      ILE 135 -13.905  -7.592   1.662
  955   2HD1  ILE 135          2HD1      ILE 135 -14.498  -9.253   1.655
  956   3HD1  ILE 135          3HD1      ILE 135 -12.764  -8.936   1.597
  957    H    THR 136           H        THR 136 -14.026  -4.149   3.046
  958    HA   THR 136           HA       THR 136 -16.683  -4.781   3.484
  959    HB   THR 136           HB       THR 136 -16.392  -4.871   5.847
  960    HG1  THR 136           1HG      THR 136 -18.256  -3.774   5.508
  961   1HG2  THR 136          1HG2      THR 136 -15.393  -3.078   7.173
  962   2HG2  THR 136          2HG2      THR 136 -15.021  -2.184   5.700
  963   3HG2  THR 136          3HG2      THR 136 -14.230  -3.728   6.019
  964    HA   PRO 137           HA       PRO 137 -16.794  -1.056   1.021
  965   1HB   PRO 137          2HB       PRO 137 -19.690  -1.196   1.649
  966   2HB   PRO 137          1HB       PRO 137 -18.881  -1.124   0.079
  967   1HG   PRO 137          2HG       PRO 137 -19.987  -3.392   0.945
  968   2HG   PRO 137          1HG       PRO 137 -18.459  -3.403   0.044
  969   1HD   PRO 137          2HD       PRO 137 -18.930  -3.700   2.985
  970   2HD   PRO 137          1HD       PRO 137 -17.783  -4.557   1.935
  971    H    ALA 138           H        ALA 138 -18.098  -1.457   4.225
  972    HA   ALA 138           HA       ALA 138 -18.787   1.272   4.679
  973   1HB   ALA 138          1HB       ALA 138 -18.942   0.643   7.027
  974   2HB   ALA 138          2HB       ALA 138 -18.144  -0.892   6.681
  975   3HB   ALA 138          3HB       ALA 138 -19.739  -0.555   6.007
  976    H    GLU 139           H        GLU 139 -15.862  -0.579   4.875
  977    HA   GLU 139           HA       GLU 139 -14.327   1.166   6.467
  978   1HB   GLU 139          2HB       GLU 139 -13.840  -1.249   5.805
  979   2HB   GLU 139          1HB       GLU 139 -13.310  -0.621   4.255
  980   1HG   GLU 139          2HG       GLU 139 -12.128   0.368   6.807
  981   2HG   GLU 139          1HG       GLU 139 -11.566  -1.124   6.055
  982    H    ALA 140           H        ALA 140 -14.209   0.642   2.949
  983    HA   ALA 140           HA       ALA 140 -12.611   2.865   2.377
  984   1HB   ALA 140          1HB       ALA 140 -12.925   0.984   0.840
  985   2HB   ALA 140          2HB       ALA 140 -13.247   2.531   0.056
  986   3HB   ALA 140          3HB       ALA 140 -14.589   1.500   0.555
  987    H    ALA 141           H        ALA 141 -16.057   2.577   2.784
  988    HA   ALA 141           HA       ALA 141 -16.839   4.982   1.545
  989   1HB   ALA 141          1HB       ALA 141 -18.924   4.733   2.783
  990   2HB   ALA 141          2HB       ALA 141 -18.181   3.491   3.792
  991   3HB   ALA 141          3HB       ALA 141 -18.416   3.204   2.068
  992    H    THR 142           H        THR 142 -15.267   4.387   4.574
  993    HA   THR 142           HA       THR 142 -16.112   6.871   5.761
  994    HB   THR 142           HB       THR 142 -13.842   5.022   6.539
  995    HG1  THR 142           1HG      THR 142 -16.513   4.808   6.773
  996   1HG2  THR 142          1HG2      THR 142 -13.963   6.151   8.723
  997   2HG2  THR 142          2HG2      THR 142 -15.160   7.270   8.076
  998   3HG2  THR 142          3HG2      THR 142 -13.516   7.274   7.441
  999    H    ALA 143           H        ALA 143 -13.316   5.728   3.938
 1000    HA   ALA 143           HA       ALA 143 -11.910   8.232   4.333
 1001   1HB   ALA 143          1HB       ALA 143 -10.115   7.185   3.039
 1002   2HB   ALA 143          2HB       ALA 143 -11.152   5.789   2.741
 1003   3HB   ALA 143          3HB       ALA 143 -10.639   6.172   4.385
 1004    H    CYS 144           H        CYS 144 -13.107   6.374   1.525
 1005    HA   CYS 144           HA       CYS 144 -12.389   8.359  -0.356
 1006   1HB   CYS 144          2HB       CYS 144 -14.316   6.044  -0.593
 1007   2HB   CYS 144          1HB       CYS 144 -13.779   7.037  -1.945
 1008    H    LYS 145           H        LYS 145 -14.919   8.303   1.846
 1009    HA   LYS 145           HA       LYS 145 -16.892   9.767   0.473
 1010   1HB   LYS 145          2HB       LYS 145 -17.547   8.851   2.538
 1011   2HB   LYS 145          1HB       LYS 145 -16.136   9.484   3.369
 1012   1HG   LYS 145          2HG       LYS 145 -18.170  10.640   4.032
 1013   2HG   LYS 145          1HG       LYS 145 -17.031  11.731   3.245
 1014   1HD   LYS 145          2HD       LYS 145 -18.315  11.532   1.154
 1015   2HD   LYS 145          1HD       LYS 145 -19.469  10.477   1.976
 1016   1HE   LYS 145          2HE       LYS 145 -20.060  12.259   3.504
 1017   2HE   LYS 145          1HE       LYS 145 -18.831  13.306   2.798
 1018   1HZ   LYS 145          1HZ       LYS 145 -20.043  13.370   0.750
 1019   2HZ   LYS 145          2HZ       LYS 145 -21.103  13.773   2.008
 1020   3HZ   LYS 145          3HZ       LYS 145 -21.167  12.231   1.310
 1021    H    ASN 146           H        ASN 146 -14.134  10.836   2.477
 1022    HA   ASN 146           HA       ASN 146 -14.169  13.352   1.017
 1023   1HB   ASN 146          2HB       ASN 146 -15.593  13.628   3.086
 1024   2HB   ASN 146          1HB       ASN 146 -14.130  13.375   4.036
 1025   1HD2  ASN 146          1HD2      ASN 146 -12.564  14.977   4.097
 1026   2HD2  ASN 146          2HD2      ASN 146 -12.841  16.569   3.480
 1027    H    THR 147           H        THR 147 -12.298  12.034   0.252
 1028    HA   THR 147           HA       THR 147  -9.918  12.748   1.825
 1029    HB   THR 147           HB       THR 147  -8.761  11.377  -0.062
 1030    HG1  THR 147           1HG      THR 147 -10.098   9.935  -1.140
 1031   1HG2  THR 147          1HG2      THR 147  -8.878  10.606   2.244
 1032   2HG2  THR 147          2HG2      THR 147  -9.163   9.263   1.136
 1033   3HG2  THR 147          3HG2      THR 147 -10.518  10.011   1.983
 1034    H    ASP 148           H        ASP 148 -10.925  12.569  -1.560
 1035    HA   ASP 148           HA       ASP 148 -10.850  13.991  -3.306
 1036   1HB   ASP 148          2HB       ASP 148 -11.265  15.982  -1.080
 1037   2HB   ASP 148          1HB       ASP 148 -11.360  16.396  -2.790
 1038    H    SER 149           H        SER 149  -9.399  16.469  -1.303
 1039    HA   SER 149           HA       SER 149  -7.291  16.769  -3.239
 1040   1HB   SER 149          2HB       SER 149  -7.761  18.252  -0.645
 1041   2HB   SER 149          1HB       SER 149  -6.707  18.760  -1.962
 1042    HG   SER 149           HG       SER 149  -8.700  18.677  -3.289
 1043    H    THR 150           H        THR 150  -7.656  14.763  -0.661
 1044    HA   THR 150           HA       THR 150  -4.742  14.612  -0.260
 1045    HB   THR 150           HB       THR 150  -5.216  13.762   2.049
 1046    HG1  THR 150           1HG      THR 150  -7.855  14.646   1.399
 1047   1HG2  THR 150          1HG2      THR 150  -4.515  16.080   1.685
 1048   2HG2  THR 150          2HG2      THR 150  -5.636  15.957   3.040
 1049   3HG2  THR 150          3HG2      THR 150  -6.200  16.561   1.483
 1050    H    ASN 151           H        ASN 151  -6.433  13.177  -2.191
 1051    HA   ASN 151           HA       ASN 151  -6.981  10.606  -0.962
 1052   1HB   ASN 151          2HB       ASN 151  -8.505  11.656  -2.677
 1053   2HB   ASN 151          1HB       ASN 151  -7.274  11.301  -3.885
 1054   1HD2  ASN 151          1HD2      ASN 151  -6.967   9.177  -4.558
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.039   7.900  -4.102
 1056    H    LYS 152           H        LYS 152  -4.783  10.097  -0.406
 1057    HA   LYS 152           HA       LYS 152  -3.718   8.411  -2.530
 1058   1HB   LYS 152          2HB       LYS 152  -1.341   9.088  -1.553
 1059   2HB   LYS 152          1HB       LYS 152  -2.073   9.944  -2.898
 1060   1HG   LYS 152          2HG       LYS 152  -1.187  11.579  -1.458
 1061   2HG   LYS 152          1HG       LYS 152  -2.933  11.614  -1.230
 1062   1HD   LYS 152          2HD       LYS 152  -2.742  10.397   0.832
 1063   2HD   LYS 152          1HD       LYS 152  -1.015  10.145   0.573
 1064   1HE   LYS 152          2HE       LYS 152  -1.443  11.947   2.180
 1065   2HE   LYS 152          1HE       LYS 152  -0.614  12.530   0.739
 1066   1HZ   LYS 152          1HZ       LYS 152  -2.361  14.042   1.366
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.509  12.796   1.328
 1068   3HZ   LYS 152          3HZ       LYS 152  -2.762  13.307  -0.111
 1069    H    VAL 153           H        VAL 153  -3.251   6.441  -1.834
 1070    HA   VAL 153           HA       VAL 153  -3.201   6.051   1.065
 1071    HB   VAL 153           HB       VAL 153  -4.335   3.819   0.507
 1072   1HG1  VAL 153          1HG1      VAL 153  -6.565   4.843   0.621
 1073   2HG1  VAL 153          2HG1      VAL 153  -5.851   6.407   0.227
 1074   3HG1  VAL 153          3HG1      VAL 153  -5.431   5.601   1.738
 1075   1HG2  VAL 153          1HG2      VAL 153  -5.035   5.365  -1.981
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.801   3.861  -1.465
 1077   3HG2  VAL 153          3HG2      VAL 153  -4.093   3.877  -1.901
 1078    H    THR 154           H        THR 154  -0.993   5.817   1.222
 1079    HA   THR 154           HA       THR 154   0.408   3.757  -0.161
 1080    HB   THR 154           HB       THR 154   2.171   4.220   1.462
 1081    HG1  THR 154           1HG      THR 154   1.391   6.088   2.996
 1082   1HG2  THR 154          1HG2      THR 154   2.423   6.622   1.086
 1083   2HG2  THR 154          2HG2      THR 154   0.719   6.737   0.647
 1084   3HG2  THR 154          3HG2      THR 154   1.829   5.816  -0.367
 1085    H    TYR 155           H        TYR 155   0.431   1.539   0.288
 1086    HA   TYR 155           HA       TYR 155  -0.077   0.772   3.054
 1087   1HB   TYR 155          2HB       TYR 155  -1.755  -0.865   2.562
 1088   2HB   TYR 155          1HB       TYR 155  -2.282   0.697   1.963
 1089    HD1  TYR 155           1HD      TYR 155  -1.558  -2.741   1.115
 1090    HD2  TYR 155           2HD      TYR 155  -2.213   1.141  -0.502
 1091    HE1  TYR 155           1HE      TYR 155  -1.957  -3.734  -1.101
 1092    HE2  TYR 155           2HE      TYR 155  -2.622   0.163  -2.718
 1093    HH   TYR 155           HH       TYR 155  -3.216  -3.068  -3.223
 1094    H    PHE 156           H        PHE 156   0.076  -1.695   3.281
 1095    HA   PHE 156           HA       PHE 156   2.390  -2.638   1.733
 1096   1HB   PHE 156          2HB       PHE 156   1.883  -2.784   4.698
 1097   2HB   PHE 156          1HB       PHE 156   3.093  -3.776   3.885
 1098    HD1  PHE 156           1HD      PHE 156   5.070  -2.751   2.872
 1099    HD2  PHE 156           2HD      PHE 156   2.191  -0.476   5.030
 1100    HE1  PHE 156           1HE      PHE 156   6.680  -0.902   3.070
 1101    HE2  PHE 156           2HE      PHE 156   3.797   1.369   5.236
 1102    HZ   PHE 156           HZ       PHE 156   6.064   1.150   4.115
 1103    H    MET 157           H        MET 157   2.589  -4.926   1.501
 1104    HA   MET 157           HA       MET 157   0.278  -6.541   2.151
 1105   1HB   MET 157          2HB       MET 157  -0.227  -5.179   0.032
 1106   2HB   MET 157          1HB       MET 157   0.981  -6.186  -0.759
 1107   1HG   MET 157          2HG       MET 157  -0.318  -8.162  -0.320
 1108   2HG   MET 157          1HG       MET 157  -1.477  -7.226   0.625
 1109   1HE   MET 157          1HE       MET 157  -2.317  -9.183  -1.733
 1110   2HE   MET 157          2HE       MET 157  -3.538  -8.207  -2.548
 1111   3HE   MET 157          3HE       MET 157  -3.468  -8.243  -0.787
 1112    H    LYS 158           H        LYS 158   0.814  -8.664   2.291
 1113    HA   LYS 158           HA       LYS 158   3.601  -9.337   1.610
 1114   1HB   LYS 158          2HB       LYS 158   3.156  -9.021   4.040
 1115   2HB   LYS 158          1HB       LYS 158   1.966 -10.306   3.967
 1116   1HG   LYS 158          2HG       LYS 158   4.796 -10.833   3.156
 1117   2HG   LYS 158          1HG       LYS 158   4.343 -10.798   4.859
 1118   1HD   LYS 158          2HD       LYS 158   3.195 -12.591   2.724
 1119   2HD   LYS 158          1HD       LYS 158   4.264 -13.075   4.041
 1120   1HE   LYS 158          2HE       LYS 158   2.541 -13.321   5.424
 1121   2HE   LYS 158          1HE       LYS 158   1.973 -11.687   5.083
 1122   1HZ   LYS 158          1HZ       LYS 158   0.262 -13.189   4.460
 1123   2HZ   LYS 158          2HZ       LYS 158   1.334 -14.166   3.582
 1124   3HZ   LYS 158          3HZ       LYS 158   0.953 -12.607   3.018
  Start of MODEL   12
    1   1H    MET   1          1HT       MET   1 -26.816  -9.243  -1.916
    2   2H    MET   1          2HT       MET   1 -26.493  -8.971  -3.554
    3   3H    MET   1          3HT       MET   1 -27.109  -7.721  -2.595
    4    HA   MET   1           HA       MET   1 -24.469  -9.015  -2.253
    5   1HB   MET   1          2HB       MET   1 -23.532  -6.893  -3.052
    6   2HB   MET   1          1HB       MET   1 -24.561  -7.625  -4.275
    7   1HG   MET   1          2HG       MET   1 -26.367  -6.099  -3.675
    8   2HG   MET   1          1HG       MET   1 -25.338  -5.367  -2.445
    9   1HE   MET   1          1HE       MET   1 -23.196  -3.901  -2.975
   10   2HE   MET   1          2HE       MET   1 -22.542  -3.682  -4.598
   11   3HE   MET   1          3HE       MET   1 -22.513  -5.276  -3.846
   12    H    GLU   2           H        GLU   2 -23.209  -8.203  -0.570
   13    HA   GLU   2           HA       GLU   2 -24.281  -6.159   1.164
   14   1HB   GLU   2          2HB       GLU   2 -24.225  -7.684   3.173
   15   2HB   GLU   2          1HB       GLU   2 -25.540  -7.975   2.046
   16   1HG   GLU   2          2HG       GLU   2 -24.107  -9.801   1.045
   17   2HG   GLU   2          1HG       GLU   2 -23.043  -9.596   2.435
   18    H    GLN   3           H        GLN   3 -22.679  -4.983   1.861
   19    HA   GLN   3           HA       GLN   3 -20.715  -4.308   2.740
   20   1HB   GLN   3          2HB       GLN   3 -20.331  -7.258   3.175
   21   2HB   GLN   3          1HB       GLN   3 -19.063  -6.104   3.553
   22   1HG   GLN   3          2HG       GLN   3 -20.317  -6.655   5.539
   23   2HG   GLN   3          1HG       GLN   3 -20.569  -4.965   5.114
   24   1HE2  GLN   3          1HE2      GLN   3 -22.592  -4.276   4.492
   25   2HE2  GLN   3          2HE2      GLN   3 -24.009  -5.272   4.616
   26    H    SER   4           H        SER   4 -19.279  -7.220   1.353
   27    HA   SER   4           HA       SER   4 -18.083  -5.531  -0.734
   28   1HB   SER   4          2HB       SER   4 -15.961  -6.867  -0.416
   29   2HB   SER   4          1HB       SER   4 -16.375  -5.829   0.953
   30    HG   SER   4           HG       SER   4 -16.798  -8.640   0.714
   31    H    ALA   5           H        ALA   5 -17.570  -6.636  -2.704
   32    HA   ALA   5           HA       ALA   5 -19.108  -9.127  -3.015
   33   1HB   ALA   5          1HB       ALA   5 -18.561  -7.010  -5.092
   34   2HB   ALA   5          2HB       ALA   5 -20.070  -7.210  -4.198
   35   3HB   ALA   5          3HB       ALA   5 -19.533  -8.466  -5.316
   36    H    SER   6           H        SER   6 -16.296  -7.392  -4.356
   37    HA   SER   6           HA       SER   6 -15.329  -9.775  -5.647
   38   1HB   SER   6          2HB       SER   6 -13.989  -7.086  -5.304
   39   2HB   SER   6          1HB       SER   6 -13.500  -8.361  -6.420
   40    HG   SER   6           HG       SER   6 -14.731  -7.119  -7.675
   41    H    ASP   7           H        ASP   7 -15.419  -9.228  -2.543
   42    HA   ASP   7           HA       ASP   7 -12.737  -9.217  -1.649
   43   1HB   ASP   7          2HB       ASP   7 -13.635  -9.816   0.534
   44   2HB   ASP   7          1HB       ASP   7 -14.646  -8.585  -0.213
   45    H    SER   8           H        SER   8 -14.840 -11.752  -2.730
   46    HA   SER   8           HA       SER   8 -12.881 -13.767  -1.893
   47   1HB   SER   8          2HB       SER   8 -15.683 -14.140  -2.979
   48   2HB   SER   8          1HB       SER   8 -14.637 -15.409  -2.341
   49    HG   SER   8           HG       SER   8 -15.236 -13.177  -0.719
   50    H    ASN   9           H        ASN   9 -13.997 -12.026  -4.602
   51    HA   ASN   9           HA       ASN   9 -13.217 -14.037  -6.540
   52   1HB   ASN   9          2HB       ASN   9 -14.354 -11.257  -6.869
   53   2HB   ASN   9          1HB       ASN   9 -13.936 -12.311  -8.215
   54   1HD2  ASN   9          1HD2      ASN   9 -14.807 -14.733  -6.838
   55   2HD2  ASN   9          2HD2      ASN   9 -16.535 -14.692  -6.860
   56    H    LYS  10           H        LYS  10 -12.304 -10.648  -5.864
   57    HA   LYS  10           HA       LYS  10 -10.144 -10.763  -7.743
   58   1HB   LYS  10          2HB       LYS  10 -11.442  -8.686  -7.227
   59   2HB   LYS  10          1HB       LYS  10 -10.671  -8.651  -5.645
   60   1HG   LYS  10          2HG       LYS  10  -8.477  -8.496  -6.745
   61   2HG   LYS  10          1HG       LYS  10  -9.285  -8.460  -8.311
   62   1HD   LYS  10          2HD       LYS  10 -10.492  -6.413  -7.565
   63   2HD   LYS  10          1HD       LYS  10  -9.502  -6.421  -6.101
   64   1HE   LYS  10          2HE       LYS  10  -8.482  -4.920  -7.648
   65   2HE   LYS  10          1HE       LYS  10  -7.479  -6.371  -7.573
   66   1HZ   LYS  10          1HZ       LYS  10  -8.643  -7.152  -9.607
   67   2HZ   LYS  10          2HZ       LYS  10  -7.715  -5.752  -9.841
   68   3HZ   LYS  10          3HZ       LYS  10  -9.407  -5.637  -9.710
   69    H    SER  11           H        SER  11 -10.509 -11.416  -4.391
   70    HA   SER  11           HA       SER  11  -7.982 -10.872  -3.381
   71   1HB   SER  11          2HB       SER  11  -8.557 -12.684  -1.713
   72   2HB   SER  11          1HB       SER  11  -9.784 -11.427  -1.904
   73    HG   SER  11           HG       SER  11 -10.612 -13.619  -1.920
   74    H    GLN  12           H        GLN  12  -9.210 -13.975  -4.595
   75    HA   GLN  12           HA       GLN  12  -6.896 -15.476  -4.398
   76   1HB   GLN  12          2HB       GLN  12  -8.978 -15.704  -6.581
   77   2HB   GLN  12          1HB       GLN  12  -7.900 -16.977  -6.021
   78   1HG   GLN  12          2HG       GLN  12  -8.998 -17.077  -3.905
   79   2HG   GLN  12          1HG       GLN  12  -9.962 -15.649  -4.283
   80   1HE2  GLN  12          1HE2      GLN  12 -10.825 -18.325  -3.543
   81   2HE2  GLN  12          2HE2      GLN  12 -11.851 -18.868  -4.831
   82    H    ASN  13           H        ASN  13  -7.935 -13.310  -6.955
   83    HA   ASN  13           HA       ASN  13  -5.852 -14.000  -8.777
   84   1HB   ASN  13          2HB       ASN  13  -7.779 -11.681  -8.645
   85   2HB   ASN  13          1HB       ASN  13  -6.560 -11.823  -9.907
   86   1HD2  ASN  13          1HD2      ASN  13  -9.517 -13.127  -8.614
   87   2HD2  ASN  13          2HD2      ASN  13  -9.905 -14.116  -9.981
   88    H    ALA  14           H        ALA  14  -6.409 -11.144  -6.719
   89    HA   ALA  14           HA       ALA  14  -4.030  -9.822  -7.455
   90   1HB   ALA  14          1HB       ALA  14  -4.492  -8.314  -5.624
   91   2HB   ALA  14          2HB       ALA  14  -5.639  -9.463  -4.931
   92   3HB   ALA  14          3HB       ALA  14  -5.986  -8.695  -6.482
   93    H    ILE  15           H        ILE  15  -4.776 -11.992  -4.761
   94    HA   ILE  15           HA       ILE  15  -2.366 -11.604  -3.352
   95    HB   ILE  15           HB       ILE  15  -4.491 -13.693  -3.324
   96   1HG1  ILE  15          2HG1      ILE  15  -4.547 -13.122  -0.932
   97   2HG1  ILE  15          1HG1      ILE  15  -3.150 -12.077  -1.144
   98   1HG2  ILE  15          1HG2      ILE  15  -1.808 -14.077  -2.006
   99   2HG2  ILE  15          2HG2      ILE  15  -2.521 -15.085  -3.265
  100   3HG2  ILE  15          3HG2      ILE  15  -3.252 -15.031  -1.660
  101   1HD1  ILE  15          1HD1      ILE  15  -4.474 -10.643  -2.628
  102   2HD1  ILE  15          2HD1      ILE  15  -5.169 -10.773  -1.011
  103   3HD1  ILE  15          3HD1      ILE  15  -5.875 -11.678  -2.351
  104    H    SER  16           H        SER  16  -3.252 -13.878  -5.920
  105    HA   SER  16           HA       SER  16  -0.900 -15.399  -5.905
  106   1HB   SER  16          2HB       SER  16  -2.988 -15.996  -7.134
  107   2HB   SER  16          1HB       SER  16  -2.619 -14.733  -8.305
  108    HG   SER  16           HG       SER  16  -1.910 -16.815  -8.982
  109    H    GLU  17           H        GLU  17  -1.712 -12.371  -7.526
  110    HA   GLU  17           HA       GLU  17   0.540 -12.081  -9.153
  111   1HB   GLU  17          2HB       GLU  17  -0.833  -9.803  -7.720
  112   2HB   GLU  17          1HB       GLU  17   0.005  -9.750  -9.263
  113   1HG   GLU  17          2HG       GLU  17  -2.505 -11.332  -8.803
  114   2HG   GLU  17          1HG       GLU  17  -2.502  -9.660  -9.361
  115    H    VAL  18           H        VAL  18  -0.053 -10.799  -5.892
  116    HA   VAL  18           HA       VAL  18   2.561  -9.684  -5.661
  117    HB   VAL  18           HB       VAL  18   0.555 -10.194  -3.457
  118   1HG1  VAL  18          1HG1      VAL  18   2.886  -8.284  -3.625
  119   2HG1  VAL  18          2HG1      VAL  18   2.777  -9.719  -2.603
  120   3HG1  VAL  18          3HG1      VAL  18   1.706  -8.347  -2.315
  121   1HG2  VAL  18          1HG2      VAL  18  -0.452  -8.891  -5.244
  122   2HG2  VAL  18          2HG2      VAL  18   0.913  -7.775  -5.224
  123   3HG2  VAL  18          3HG2      VAL  18  -0.164  -7.875  -3.832
  124    H    MET  19           H        MET  19   1.095 -12.719  -4.675
  125    HA   MET  19           HA       MET  19   3.003 -13.553  -2.811
  126   1HB   MET  19          2HB       MET  19   0.869 -14.711  -3.145
  127   2HB   MET  19          1HB       MET  19   1.392 -15.238  -4.737
  128   1HG   MET  19          2HG       MET  19   3.155 -16.577  -3.747
  129   2HG   MET  19          1HG       MET  19   2.701 -16.016  -2.139
  130   1HE   MET  19          1HE       MET  19  -0.038 -18.631  -4.785
  131   2HE   MET  19          2HE       MET  19   1.560 -18.077  -5.288
  132   3HE   MET  19          3HE       MET  19   0.248 -16.915  -5.085
  133    H    SER  20           H        SER  20   2.971 -13.868  -6.341
  134    HA   SER  20           HA       SER  20   5.430 -15.331  -6.418
  135   1HB   SER  20          2HB       SER  20   3.709 -15.434  -8.228
  136   2HB   SER  20          1HB       SER  20   4.101 -13.766  -8.648
  137    HG   SER  20           HG       SER  20   5.958 -14.388  -9.500
  138    H    ALA  21           H        ALA  21   4.499 -11.947  -6.657
  139    HA   ALA  21           HA       ALA  21   6.988 -10.933  -7.522
  140   1HB   ALA  21          1HB       ALA  21   4.831  -9.530  -5.950
  141   2HB   ALA  21          2HB       ALA  21   4.898  -9.673  -7.705
  142   3HB   ALA  21          3HB       ALA  21   6.136  -8.757  -6.848
  143    H    THR  22           H        THR  22   5.581 -11.270  -4.275
  144    HA   THR  22           HA       THR  22   7.711 -10.059  -2.889
  145    HB   THR  22           HB       THR  22   5.428 -10.447  -1.931
  146    HG1  THR  22           1HG      THR  22   6.252 -10.373   0.016
  147   1HG2  THR  22          1HG2      THR  22   6.408 -13.284  -1.605
  148   2HG2  THR  22          2HG2      THR  22   5.079 -12.754  -2.640
  149   3HG2  THR  22          3HG2      THR  22   4.943 -12.613  -0.885
  150    H    SER  23           H        SER  23   7.183 -13.331  -4.031
  151    HA   SER  23           HA       SER  23   9.383 -14.502  -2.661
  152   1HB   SER  23          2HB       SER  23   7.517 -15.837  -3.592
  153   2HB   SER  23          1HB       SER  23   8.014 -15.380  -5.220
  154    HG   SER  23           HG       SER  23   9.920 -16.524  -4.947
  155    H    ALA  24           H        ALA  24   8.928 -13.035  -5.836
  156    HA   ALA  24           HA       ALA  24  11.480 -13.618  -6.874
  157   1HB   ALA  24          1HB       ALA  24  10.990 -11.955  -8.567
  158   2HB   ALA  24          2HB       ALA  24   9.660 -11.323  -7.592
  159   3HB   ALA  24          3HB       ALA  24   9.567 -12.953  -8.264
  160    H    ILE  25           H        ILE  25  10.227 -10.647  -5.320
  161    HA   ILE  25           HA       ILE  25  12.659  -9.231  -5.536
  162    HB   ILE  25           HB       ILE  25  10.581  -8.033  -5.161
  163   1HG1  ILE  25          2HG1      ILE  25  12.520  -7.689  -2.858
  164   2HG1  ILE  25          1HG1      ILE  25  12.701  -6.990  -4.462
  165   1HG2  ILE  25          1HG2      ILE  25   9.414  -9.598  -3.742
  166   2HG2  ILE  25          2HG2      ILE  25   9.495  -8.023  -2.949
  167   3HG2  ILE  25          3HG2      ILE  25  10.571  -9.324  -2.438
  168   1HD1  ILE  25          1HD1      ILE  25  10.519  -6.359  -2.487
  169   2HD1  ILE  25          2HD1      ILE  25  10.662  -5.677  -4.107
  170   3HD1  ILE  25          3HD1      ILE  25  11.896  -5.335  -2.894
  171    H    ASN  26           H        ASN  26  11.416 -11.389  -3.048
  172    HA   ASN  26           HA       ASN  26  13.400 -10.802  -1.110
  173   1HB   ASN  26          2HB       ASN  26  11.213 -12.030  -0.701
  174   2HB   ASN  26          1HB       ASN  26  11.970 -13.446  -1.425
  175   1HD2  ASN  26          1HD2      ASN  26  11.932 -11.284   1.291
  176   2HD2  ASN  26          2HD2      ASN  26  12.879 -12.279   2.346
  177    H    GLY  27           H        GLY  27  13.195 -12.974  -3.836
  178   1HA   GLY  27          2HA       GLY  27  15.642 -14.361  -3.285
  179   2HA   GLY  27          1HA       GLY  27  14.718 -14.421  -4.776
  180    H    LEU  28           H        LEU  28  14.999 -11.263  -4.452
  181    HA   LEU  28           HA       LEU  28  17.294 -11.067  -6.187
  182   1HB   LEU  28          2HB       LEU  28  15.673  -8.857  -4.919
  183   2HB   LEU  28          1HB       LEU  28  16.813  -8.679  -6.236
  184    HG   LEU  28           HG       LEU  28  14.195 -10.180  -6.359
  185   1HD1  LEU  28          1HD1      LEU  28  13.883  -7.776  -6.251
  186   2HD1  LEU  28          2HD1      LEU  28  13.523  -8.369  -7.873
  187   3HD1  LEU  28          3HD1      LEU  28  15.051  -7.547  -7.552
  188   1HD2  LEU  28          1HD2      LEU  28  15.918 -11.171  -7.793
  189   2HD2  LEU  28          2HD2      LEU  28  16.208  -9.593  -8.525
  190   3HD2  LEU  28          3HD2      LEU  28  14.650 -10.390  -8.739
  191    H    TYR  29           H        TYR  29  16.593 -10.649  -2.828
  192    HA   TYR  29           HA       TYR  29  19.226  -9.409  -2.387
  193   1HB   TYR  29          2HB       TYR  29  16.707  -9.281  -0.709
  194   2HB   TYR  29          1HB       TYR  29  18.260  -8.602  -0.226
  195    HD1  TYR  29           1HD      TYR  29  15.811  -8.449  -3.044
  196    HD2  TYR  29           2HD      TYR  29  18.694  -6.372  -0.707
  197    HE1  TYR  29           1HE      TYR  29  15.261  -6.371  -4.229
  198    HE2  TYR  29           2HE      TYR  29  18.147  -4.279  -1.883
  199    HH   TYR  29           HH       TYR  29  15.416  -3.907  -3.798
  200    H    ILE  30           H        ILE  30  16.892 -11.515  -0.724
  201    HA   ILE  30           HA       ILE  30  17.092 -13.405   0.487
  202    HB   ILE  30           HB       ILE  30  19.715 -13.805  -0.956
  203   1HG1  ILE  30          2HG1      ILE  30  16.920 -14.710  -1.698
  204   2HG1  ILE  30          1HG1      ILE  30  17.823 -13.433  -2.507
  205   1HG2  ILE  30          1HG2      ILE  30  19.434 -15.254   0.992
  206   2HG2  ILE  30          2HG2      ILE  30  19.327 -16.181  -0.505
  207   3HG2  ILE  30          3HG2      ILE  30  17.860 -15.775   0.388
  208   1HD1  ILE  30          1HD1      ILE  30  18.589 -16.344  -2.393
  209   2HD1  ILE  30          2HD1      ILE  30  19.506 -15.068  -3.194
  210   3HD1  ILE  30          3HD1      ILE  30  17.897 -15.497  -3.776
  211    H    GLY  31           H        GLY  31  17.257 -12.447   2.507
  212   1HA   GLY  31          2HA       GLY  31  18.444 -13.013   4.541
  213   2HA   GLY  31          1HA       GLY  31  19.950 -12.751   3.672
  214    H    GLN  32           H        GLN  32  17.888 -10.381   2.716
  215    HA   GLN  32           HA       GLN  32  19.153  -8.369   4.297
  216   1HB   GLN  32          2HB       GLN  32  17.042  -8.413   2.198
  217   2HB   GLN  32          1HB       GLN  32  17.116  -7.009   3.248
  218   1HG   GLN  32          2HG       GLN  32  19.403  -8.057   1.597
  219   2HG   GLN  32          1HG       GLN  32  18.363  -6.703   1.158
  220   1HE2  GLN  32          1HE2      GLN  32  21.221  -6.677   1.538
  221   2HE2  GLN  32          2HE2      GLN  32  21.543  -5.566   2.825
  222    H    THR  33           H        THR  33  18.526  -7.471   6.150
  223    HA   THR  33           HA       THR  33  16.716  -8.662   7.871
  224    HB   THR  33           HB       THR  33  17.436  -5.731   7.989
  225    HG1  THR  33           1HG      THR  33  19.281  -6.754   9.295
  226   1HG2  THR  33          1HG2      THR  33  15.858  -6.531   9.678
  227   2HG2  THR  33          2HG2      THR  33  17.410  -6.133  10.412
  228   3HG2  THR  33          3HG2      THR  33  16.976  -7.818  10.126
  229    H    SER  34           H        SER  34  16.282  -5.875   5.746
  230    HA   SER  34           HA       SER  34  13.579  -6.555   5.222
  231   1HB   SER  34          2HB       SER  34  13.426  -5.375   7.480
  232   2HB   SER  34          1HB       SER  34  13.955  -3.917   6.641
  233    HG   SER  34           HG       SER  34  12.116  -4.317   5.197
  234    H    TYR  35           H        TYR  35  15.977  -6.149   3.767
  235    HA   TYR  35           HA       TYR  35  16.728  -5.208   1.828
  236   1HB   TYR  35          2HB       TYR  35  14.064  -3.778   1.718
  237   2HB   TYR  35          1HB       TYR  35  15.156  -4.095   0.374
  238    HD1  TYR  35           1HD      TYR  35  15.391  -6.388  -0.526
  239    HD2  TYR  35           2HD      TYR  35  12.567  -5.471   2.520
  240    HE1  TYR  35           1HE      TYR  35  14.205  -8.492  -0.997
  241    HE2  TYR  35           2HE      TYR  35  11.374  -7.570   2.056
  242    HH   TYR  35           HH       TYR  35  12.676 -10.060   0.164
  243    H    SER  36           H        SER  36  17.016  -3.982   4.466
  244    HA   SER  36           HA       SER  36  16.927  -1.217   4.427
  245   1HB   SER  36          2HB       SER  36  18.962  -2.980   5.814
  246   2HB   SER  36          1HB       SER  36  18.564  -1.314   6.241
  247    HG   SER  36           HG       SER  36  16.473  -1.995   6.779
  248    H    GLY  37           H        GLY  37  18.092   0.309   3.521
  249   1HA   GLY  37          2HA       GLY  37  20.409   0.905   2.680
  250   2HA   GLY  37          1HA       GLY  37  20.264  -0.568   1.720
  251    H    LEU  38           H        LEU  38  17.700  -0.508   0.858
  252    HA   LEU  38           HA       LEU  38  17.728   1.332  -1.276
  253   1HB   LEU  38          2HB       LEU  38  15.354  -0.074  -0.053
  254   2HB   LEU  38          1HB       LEU  38  15.388   0.681  -1.633
  255    HG   LEU  38           HG       LEU  38  17.054  -1.701  -0.826
  256   1HD1  LEU  38          1HD1      LEU  38  14.551  -1.530  -2.498
  257   2HD1  LEU  38          2HD1      LEU  38  14.675  -2.230  -0.886
  258   3HD1  LEU  38          3HD1      LEU  38  15.522  -2.978  -2.239
  259   1HD2  LEU  38          1HD2      LEU  38  16.607  -0.377  -3.502
  260   2HD2  LEU  38          2HD2      LEU  38  17.503  -1.871  -3.232
  261   3HD2  LEU  38          3HD2      LEU  38  18.101  -0.352  -2.564
  262    H    ASP  39           H        ASP  39  16.173   1.413   1.875
  263    HA   ASP  39           HA       ASP  39  14.505   3.632   1.427
  264   1HB   ASP  39          2HB       ASP  39  14.092   2.113   3.266
  265   2HB   ASP  39          1HB       ASP  39  15.650   2.509   3.984
  266    H    SER  40           H        SER  40  17.750   3.358   2.804
  267    HA   SER  40           HA       SER  40  18.071   5.980   3.645
  268   1HB   SER  40          2HB       SER  40  19.624   3.987   4.040
  269   2HB   SER  40          1HB       SER  40  20.297   4.326   2.445
  270    HG   SER  40           HG       SER  40  21.533   5.658   3.512
  271    H    THR  41           H        THR  41  18.576   4.540   0.459
  272    HA   THR  41           HA       THR  41  19.647   6.801  -0.820
  273    HB   THR  41           HB       THR  41  17.985   4.564  -1.992
  274    HG1  THR  41           1HG      THR  41  20.803   4.924  -1.669
  275   1HG2  THR  41          1HG2      THR  41  18.099   6.479  -3.506
  276   2HG2  THR  41          2HG2      THR  41  19.073   5.143  -4.117
  277   3HG2  THR  41          3HG2      THR  41  19.853   6.520  -3.339
  278    H    ILE  42           H        ILE  42  16.286   5.614  -0.681
  279    HA   ILE  42           HA       ILE  42  15.218   7.744  -2.222
  280    HB   ILE  42           HB       ILE  42  13.778   5.936  -0.272
  281   1HG1  ILE  42          2HG1      ILE  42  14.963   4.637  -1.960
  282   2HG1  ILE  42          1HG1      ILE  42  13.231   4.580  -2.263
  283   1HG2  ILE  42          1HG2      ILE  42  11.779   6.445  -1.605
  284   2HG2  ILE  42          2HG2      ILE  42  12.719   7.589  -2.562
  285   3HG2  ILE  42          3HG2      ILE  42  12.452   7.887  -0.844
  286   1HD1  ILE  42          1HD1      ILE  42  15.225   6.298  -3.720
  287   2HD1  ILE  42          2HD1      ILE  42  13.489   6.251  -4.026
  288   3HD1  ILE  42          3HD1      ILE  42  14.476   4.821  -4.329
  289    H    LEU  43           H        LEU  43  15.629   7.223   1.216
  290    HA   LEU  43           HA       LEU  43  13.983   9.220   2.241
  291   1HB   LEU  43          2HB       LEU  43  15.150   7.355   3.480
  292   2HB   LEU  43          1HB       LEU  43  16.616   8.314   3.402
  293    HG   LEU  43           HG       LEU  43  15.406  10.118   4.666
  294   1HD1  LEU  43          1HD1      LEU  43  13.346   7.937   4.979
  295   2HD1  LEU  43          2HD1      LEU  43  13.128   9.482   4.157
  296   3HD1  LEU  43          3HD1      LEU  43  13.385   9.440   5.902
  297   1HD2  LEU  43          1HD2      LEU  43  16.962   8.570   5.749
  298   2HD2  LEU  43          2HD2      LEU  43  15.642   7.429   6.018
  299   3HD2  LEU  43          3HD2      LEU  43  15.630   8.999   6.822
  300    H    LEU  44           H        LEU  44  17.520   9.370   1.731
  301    HA   LEU  44           HA       LEU  44  17.556  12.191   2.248
  302   1HB   LEU  44          2HB       LEU  44  19.952  12.051   1.695
  303   2HB   LEU  44          1HB       LEU  44  19.460  10.892   2.910
  304    HG   LEU  44           HG       LEU  44  19.322   9.224   0.910
  305   1HD1  LEU  44          1HD1      LEU  44  21.186  11.306  -0.220
  306   2HD1  LEU  44          2HD1      LEU  44  19.620  10.839  -0.878
  307   3HD1  LEU  44          3HD1      LEU  44  20.947   9.680  -0.859
  308   1HD2  LEU  44          1HD2      LEU  44  20.885   9.022   2.746
  309   2HD2  LEU  44          2HD2      LEU  44  21.944  10.224   2.008
  310   3HD2  LEU  44          3HD2      LEU  44  21.691   8.668   1.219
  311    H    ASN  45           H        ASN  45  16.865  10.321  -0.458
  312    HA   ASN  45           HA       ASN  45  17.980  11.833  -2.551
  313   1HB   ASN  45          2HB       ASN  45  16.978   9.554  -2.793
  314   2HB   ASN  45          1HB       ASN  45  15.385  10.285  -2.606
  315   1HD2  ASN  45          1HD2      ASN  45  14.721   9.625  -4.646
  316   2HD2  ASN  45          2HD2      ASN  45  15.321  10.353  -6.092
  317    H    THR  46           H        THR  46  14.780  11.985  -1.009
  318    HA   THR  46           HA       THR  46  14.420  14.583  -2.340
  319    HB   THR  46           HB       THR  46  12.237  12.570  -1.789
  320    HG1  THR  46           1HG      THR  46  13.755  13.182  -4.108
  321   1HG2  THR  46          1HG2      THR  46  10.878  14.041  -3.234
  322   2HG2  THR  46          2HG2      THR  46  12.220  15.182  -3.310
  323   3HG2  THR  46          3HG2      THR  46  11.417  14.865  -1.772
  324    H    SER  47           H        SER  47  15.092  15.739  -0.518
  325    HA   SER  47           HA       SER  47  14.471  17.257   1.053
  326   1HB   SER  47          2HB       SER  47  12.369  17.232  -0.308
  327   2HB   SER  47          1HB       SER  47  11.715  16.041   0.811
  328    HG   SER  47           HG       SER  47  11.170  17.630   2.053
  329    H    ALA  48           H        ALA  48  14.931  14.205   1.708
  330    HA   ALA  48           HA       ALA  48  15.303  12.985   3.585
  331   1HB   ALA  48          1HB       ALA  48  15.225  14.003   5.795
  332   2HB   ALA  48          2HB       ALA  48  14.429  15.428   5.121
  333   3HB   ALA  48          3HB       ALA  48  16.083  15.033   4.649
  334    H    ILE  49           H        ILE  49  12.271  14.651   3.258
  335    HA   ILE  49           HA       ILE  49  10.916  12.257   4.318
  336    HB   ILE  49           HB       ILE  49   9.725  15.016   3.953
  337   1HG1  ILE  49          2HG1      ILE  49  10.533  13.630   6.520
  338   2HG1  ILE  49          1HG1      ILE  49  11.406  14.964   5.777
  339   1HG2  ILE  49          1HG2      ILE  49   8.109  13.211   3.730
  340   2HG2  ILE  49          2HG2      ILE  49   7.834  14.109   5.222
  341   3HG2  ILE  49          3HG2      ILE  49   8.627  12.535   5.275
  342   1HD1  ILE  49          1HD1      ILE  49   9.470  16.410   6.094
  343   2HD1  ILE  49          2HD1      ILE  49  10.024  15.726   7.622
  344   3HD1  ILE  49          3HD1      ILE  49   8.590  15.070   6.832
  345    HA   PRO  50           HA       PRO  50  10.542  11.775  -0.178
  346   1HB   PRO  50          2HB       PRO  50   9.081   9.351   0.753
  347   2HB   PRO  50          1HB       PRO  50  10.384   9.502  -0.439
  348   1HG   PRO  50          2HG       PRO  50  10.872   8.504   1.981
  349   2HG   PRO  50          1HG       PRO  50  12.043   9.569   1.179
  350   1HD   PRO  50          2HD       PRO  50  10.118  10.184   3.383
  351   2HD   PRO  50          1HD       PRO  50  11.785  10.749   3.151
  352    H    ASP  51           H        ASP  51   9.107  13.211  -0.902
  353    HA   ASP  51           HA       ASP  51   6.506  13.566   0.183
  354   1HB   ASP  51          2HB       ASP  51   7.951  15.325  -0.947
  355   2HB   ASP  51          1HB       ASP  51   7.504  14.588  -2.482
  356    H    ASN  52           H        ASN  52   7.763  11.374  -2.028
  357    HA   ASN  52           HA       ASN  52   5.647  11.106  -3.876
  358   1HB   ASN  52          2HB       ASN  52   7.992  10.230  -4.169
  359   2HB   ASN  52          1HB       ASN  52   7.598   8.958  -3.016
  360   1HD2  ASN  52          1HD2      ASN  52   7.731   7.250  -4.361
  361   2HD2  ASN  52          2HD2      ASN  52   6.687   6.995  -5.713
  362    H    TYR  53           H        TYR  53   5.973  10.223  -0.618
  363    HA   TYR  53           HA       TYR  53   4.385   7.920  -0.390
  364   1HB   TYR  53          2HB       TYR  53   4.903  10.205   1.514
  365   2HB   TYR  53          1HB       TYR  53   3.999   8.767   1.960
  366    HD1  TYR  53           1HD      TYR  53   6.074   7.203  -0.058
  367    HD2  TYR  53           2HD      TYR  53   6.352   9.542   3.478
  368    HE1  TYR  53           1HE      TYR  53   8.146   6.031   0.546
  369    HE2  TYR  53           2HE      TYR  53   8.422   8.377   4.095
  370    HH   TYR  53           HH       TYR  53   9.963   6.083   1.925
  371    H    LYS  54           H        LYS  54   3.484  10.996  -1.405
  372    HA   LYS  54           HA       LYS  54   0.668  10.288  -1.081
  373   1HB   LYS  54          2HB       LYS  54   0.140  12.631  -0.394
  374   2HB   LYS  54          1HB       LYS  54   1.093  11.760   0.801
  375   1HG   LYS  54          2HG       LYS  54   3.109  12.893   0.048
  376   2HG   LYS  54          1HG       LYS  54   2.186  13.731  -1.198
  377   1HD   LYS  54          2HD       LYS  54   0.893  14.889   0.489
  378   2HD   LYS  54          1HD       LYS  54   1.705  13.985   1.770
  379   1HE   LYS  54          2HE       LYS  54   2.680  16.189   1.587
  380   2HE   LYS  54          1HE       LYS  54   3.851  14.976   1.070
  381   1HZ   LYS  54          1HZ       LYS  54   3.998  16.652  -0.511
  382   2HZ   LYS  54          2HZ       LYS  54   2.323  16.884  -0.592
  383   3HZ   LYS  54          3HZ       LYS  54   3.024  15.495  -1.269
  384    H    ASP  55           H        ASP  55  -0.612  11.032  -2.758
  385    HA   ASP  55           HA       ASP  55   0.673  12.708  -4.796
  386   1HB   ASP  55          2HB       ASP  55   0.123  10.555  -5.760
  387   2HB   ASP  55          1HB       ASP  55  -1.516  10.647  -5.116
  388    H    THR  56           H        THR  56  -0.299  14.605  -5.294
  389    HA   THR  56           HA       THR  56  -2.599  15.315  -3.631
  390    HB   THR  56           HB       THR  56  -1.907  17.690  -4.531
  391    HG1  THR  56           1HG      THR  56  -0.301  17.000  -5.973
  392   1HG2  THR  56          1HG2      THR  56  -0.402  17.943  -2.610
  393   2HG2  THR  56          2HG2      THR  56  -0.285  16.189  -2.472
  394   3HG2  THR  56          3HG2      THR  56  -1.828  16.995  -2.187
  395    H    THR  57           H        THR  57  -2.190  14.059  -6.521
  396    HA   THR  57           HA       THR  57  -3.944  15.830  -8.023
  397    HB   THR  57           HB       THR  57  -3.050  13.112  -8.948
  398    HG1  THR  57           1HG      THR  57  -1.072  13.867  -8.566
  399   1HG2  THR  57          1HG2      THR  57  -4.649  14.333 -10.331
  400   2HG2  THR  57          2HG2      THR  57  -3.087  14.206 -11.142
  401   3HG2  THR  57          3HG2      THR  57  -3.562  15.722 -10.375
  402    H    ASN  58           H        ASN  58  -3.921  12.384  -7.108
  403    HA   ASN  58           HA       ASN  58  -6.165  12.059  -5.714
  404   1HB   ASN  58          2HB       ASN  58  -8.023  11.457  -7.188
  405   2HB   ASN  58          1HB       ASN  58  -7.552  13.130  -7.441
  406   1HD2  ASN  58          1HD2      ASN  58  -6.814  13.767  -9.410
  407   2HD2  ASN  58          2HD2      ASN  58  -6.802  12.739 -10.805
  408    H    LYS  59           H        LYS  59  -3.597  10.766  -7.036
  409    HA   LYS  59           HA       LYS  59  -4.597   8.079  -6.786
  410   1HB   LYS  59          2HB       LYS  59  -4.260   7.279  -8.947
  411   2HB   LYS  59          1HB       LYS  59  -5.091   8.803  -9.162
  412   1HG   LYS  59          2HG       LYS  59  -2.156   8.288  -9.604
  413   2HG   LYS  59          1HG       LYS  59  -3.387   8.485 -10.847
  414   1HD   LYS  59          2HD       LYS  59  -2.628  10.604  -8.843
  415   2HD   LYS  59          1HD       LYS  59  -1.977  10.498 -10.478
  416   1HE   LYS  59          2HE       LYS  59  -4.868  10.861  -9.730
  417   2HE   LYS  59          1HE       LYS  59  -3.791  12.115 -10.338
  418   1HZ   LYS  59          1HZ       LYS  59  -5.017   9.859 -11.771
  419   2HZ   LYS  59          2HZ       LYS  59  -3.520  10.444 -12.310
  420   3HZ   LYS  59          3HZ       LYS  59  -4.859  11.484 -12.250
  421    H    LYS  60           H        LYS  60  -3.133   7.946  -5.067
  422    HA   LYS  60           HA       LYS  60  -0.611   6.865  -6.112
  423   1HB   LYS  60          2HB       LYS  60  -0.161   9.062  -4.987
  424   2HB   LYS  60          1HB       LYS  60  -0.791   8.369  -3.499
  425   1HG   LYS  60          2HG       LYS  60   1.523   8.156  -3.280
  426   2HG   LYS  60          1HG       LYS  60   1.006   6.551  -3.797
  427   1HD   LYS  60          2HD       LYS  60   2.984   7.212  -5.013
  428   2HD   LYS  60          1HD       LYS  60   1.605   7.136  -6.114
  429   1HE   LYS  60          2HE       LYS  60   1.370   9.528  -6.079
  430   2HE   LYS  60          1HE       LYS  60   2.601   9.675  -4.827
  431   1HZ   LYS  60          1HZ       LYS  60   3.364  10.202  -7.121
  432   2HZ   LYS  60          2HZ       LYS  60   3.150   8.570  -7.524
  433   3HZ   LYS  60          3HZ       LYS  60   4.274   9.006  -6.339
  434    H    ILE  61           H        ILE  61  -0.474   4.780  -5.618
  435    HA   ILE  61           HA       ILE  61  -1.402   3.912  -2.977
  436    HB   ILE  61           HB       ILE  61  -2.254   1.779  -3.927
  437   1HG1  ILE  61          2HG1      ILE  61  -1.930   3.224  -6.563
  438   2HG1  ILE  61          1HG1      ILE  61  -1.158   1.721  -6.068
  439   1HG2  ILE  61          1HG2      ILE  61  -4.399   2.682  -4.695
  440   2HG2  ILE  61          2HG2      ILE  61  -3.657   4.274  -4.851
  441   3HG2  ILE  61          3HG2      ILE  61  -3.789   3.517  -3.265
  442   1HD1  ILE  61          1HD1      ILE  61  -4.107   2.103  -6.528
  443   2HD1  ILE  61          2HD1      ILE  61  -3.314   0.602  -6.057
  444   3HD1  ILE  61          3HD1      ILE  61  -2.976   1.320  -7.631
  445    H    THR  62           H        THR  62   0.108   2.804  -1.954
  446    HA   THR  62           HA       THR  62   2.476   1.977  -3.406
  447    HB   THR  62           HB       THR  62   1.806   2.193  -0.488
  448    HG1  THR  62           1HG      THR  62   3.750   3.538  -0.645
  449   1HG2  THR  62          1HG2      THR  62   4.397   1.109  -1.566
  450   2HG2  THR  62          2HG2      THR  62   3.104   0.084  -0.941
  451   3HG2  THR  62          3HG2      THR  62   3.895   1.248   0.119
  452    H    ASN  63           H        ASN  63   2.638   0.051  -4.246
  453    HA   ASN  63           HA       ASN  63   2.730  -2.369  -3.190
  454   1HB   ASN  63          2HB       ASN  63   0.429  -2.072  -2.274
  455   2HB   ASN  63          1HB       ASN  63  -0.182  -2.026  -3.925
  456   1HD2  ASN  63          1HD2      ASN  63  -1.478  -3.807  -3.401
  457   2HD2  ASN  63          2HD2      ASN  63  -0.818  -5.408  -3.337
  458    HA   PRO  64           HA       PRO  64   0.939  -3.175  -7.565
  459   1HB   PRO  64          2HB       PRO  64   0.744  -0.652  -8.997
  460   2HB   PRO  64          1HB       PRO  64  -0.514  -1.841  -8.656
  461   1HG   PRO  64          2HG       PRO  64  -0.442   0.619  -7.513
  462   2HG   PRO  64          1HG       PRO  64  -1.153  -0.794  -6.715
  463   1HD   PRO  64          2HD       PRO  64   1.532   0.460  -6.326
  464   2HD   PRO  64          1HD       PRO  64   0.407  -0.174  -5.094
  465    H    PHE  65           H        PHE  65   1.966  -3.665  -9.470
  466    HA   PHE  65           HA       PHE  65   4.572  -2.377  -9.940
  467   1HB   PHE  65          2HB       PHE  65   3.921  -5.306 -10.365
  468   2HB   PHE  65          1HB       PHE  65   5.486  -4.537 -10.582
  469    HD1  PHE  65           1HD      PHE  65   3.122  -5.922  -8.199
  470    HD2  PHE  65           2HD      PHE  65   6.825  -3.876  -8.656
  471    HE1  PHE  65           1HE      PHE  65   3.692  -6.444  -5.866
  472    HE2  PHE  65           2HE      PHE  65   7.406  -4.398  -6.323
  473    HZ   PHE  65           HZ       PHE  65   5.863  -5.767  -4.951
  474    H    GLY  66           H        GLY  66   3.074  -1.079 -11.421
  475   1HA   GLY  66          2HA       GLY  66   3.383  -1.982 -14.096
  476   2HA   GLY  66          1HA       GLY  66   1.718  -2.198 -13.575
  477    H    GLY  67           H        GLY  67   4.037   0.370 -12.851
  478   1HA   GLY  67          2HA       GLY  67   2.876   2.320 -14.524
  479   2HA   GLY  67          1HA       GLY  67   2.223   2.445 -12.884
  480    H    GLU  68           H        GLU  68   3.278   4.443 -12.513
  481    HA   GLU  68           HA       GLU  68   6.182   4.395 -12.446
  482   1HB   GLU  68          2HB       GLU  68   4.176   6.437 -11.524
  483   2HB   GLU  68          1HB       GLU  68   5.916   6.693 -11.553
  484   1HG   GLU  68          2HG       GLU  68   4.149   6.191 -13.943
  485   2HG   GLU  68          1HG       GLU  68   4.800   7.753 -13.447
  486    H    LEU  69           H        LEU  69   6.852   3.010 -10.904
  487    HA   LEU  69           HA       LEU  69   5.695   3.269  -8.222
  488   1HB   LEU  69          2HB       LEU  69   6.127   1.004  -7.781
  489   2HB   LEU  69          1HB       LEU  69   5.427   1.048  -9.383
  490    HG   LEU  69           HG       LEU  69   8.401   0.832  -8.910
  491   1HD1  LEU  69          1HD1      LEU  69   7.373  -1.069  -7.845
  492   2HD1  LEU  69          2HD1      LEU  69   8.111  -1.582  -9.362
  493   3HD1  LEU  69          3HD1      LEU  69   6.366  -1.365  -9.263
  494   1HD2  LEU  69          1HD2      LEU  69   8.056   1.487 -11.133
  495   2HD2  LEU  69          2HD2      LEU  69   6.616   0.485 -11.303
  496   3HD2  LEU  69          3HD2      LEU  69   8.210  -0.265 -11.220
  497    H    ASN  70           H        ASN  70   6.961   3.480  -6.469
  498    HA   ASN  70           HA       ASN  70   9.815   4.036  -6.921
  499   1HB   ASN  70          2HB       ASN  70   8.553   5.866  -5.898
  500   2HB   ASN  70          1HB       ASN  70   7.953   4.782  -4.646
  501   1HD2  ASN  70          1HD2      ASN  70   8.818   5.562  -2.843
  502   2HD2  ASN  70          2HD2      ASN  70  10.511   5.798  -2.574
  503    H    VAL  71           H        VAL  71  11.237   2.530  -6.239
  504    HA   VAL  71           HA       VAL  71  10.286   0.317  -4.646
  505    HB   VAL  71           HB       VAL  71  12.580  -0.603  -4.912
  506   1HG1  VAL  71          1HG1      VAL  71  11.228   0.280  -7.461
  507   2HG1  VAL  71          2HG1      VAL  71  10.841  -1.157  -6.516
  508   3HG1  VAL  71          3HG1      VAL  71  12.404  -1.029  -7.325
  509   1HG2  VAL  71          1HG2      VAL  71  13.055   1.858  -6.596
  510   2HG2  VAL  71          2HG2      VAL  71  14.147   0.484  -6.440
  511   3HG2  VAL  71          3HG2      VAL  71  13.815   1.506  -5.044
  512    H    GLY  72           H        GLY  72  10.450   0.108  -2.538
  513   1HA   GLY  72          2HA       GLY  72  12.677   1.271  -1.092
  514   2HA   GLY  72          1HA       GLY  72  11.096   1.932  -0.691
  515    HA   PRO  73           HA       PRO  73  11.462  -2.078   1.615
  516   1HB   PRO  73          2HB       PRO  73  13.516  -1.963   3.259
  517   2HB   PRO  73          1HB       PRO  73  13.794  -2.250   1.534
  518   1HG   PRO  73          2HG       PRO  73  14.230   0.213   3.142
  519   2HG   PRO  73          1HG       PRO  73  15.122  -0.381   1.730
  520   1HD   PRO  73          2HD       PRO  73  12.999   1.548   1.785
  521   2HD   PRO  73          1HD       PRO  73  13.845   0.901   0.363
  522    H    ALA  74           H        ALA  74  11.512  -2.446   4.121
  523    HA   ALA  74           HA       ALA  74  10.388  -0.076   5.469
  524   1HB   ALA  74          1HB       ALA  74   9.118  -1.608   6.879
  525   2HB   ALA  74          2HB       ALA  74   9.823  -2.986   6.032
  526   3HB   ALA  74          3HB       ALA  74   8.755  -1.876   5.172
  527    H    ASN  75           H        ASN  75  10.471  -0.936   8.070
  528    HA   ASN  75           HA       ASN  75  13.248  -0.614   8.670
  529   1HB   ASN  75          2HB       ASN  75  12.557  -0.626  11.029
  530   2HB   ASN  75          1HB       ASN  75  11.582   0.481  10.073
  531   1HD2  ASN  75          1HD2      ASN  75  11.132  -0.985  12.633
  532   2HD2  ASN  75          2HD2      ASN  75   9.608  -1.768  12.423
  533    H    ASN  76           H        ASN  76  10.893  -3.247   9.306
  534    HA   ASN  76           HA       ASN  76  13.120  -5.128   9.248
  535   1HB   ASN  76          2HB       ASN  76  12.740  -4.323  11.646
  536   2HB   ASN  76          1HB       ASN  76  11.202  -5.182  11.572
  537   1HD2  ASN  76          1HD2      ASN  76  14.639  -5.471  11.716
  538   2HD2  ASN  76          2HD2      ASN  76  14.685  -7.177  12.026
  539    H    ASN  77           H        ASN  77  12.552  -7.210   8.720
  540    HA   ASN  77           HA       ASN  77  10.259  -7.513   7.118
  541   1HB   ASN  77          2HB       ASN  77  12.253  -8.746   6.588
  542   2HB   ASN  77          1HB       ASN  77  12.247  -9.535   8.160
  543   1HD2  ASN  77          1HD2      ASN  77  11.032 -11.334   8.466
  544   2HD2  ASN  77          2HD2      ASN  77  10.100 -12.093   7.222
  545    H    THR  78           H        THR  78  10.809  -8.217  10.494
  546    HA   THR  78           HA       THR  78   8.750 -10.105  10.864
  547    HB   THR  78           HB       THR  78   8.757  -9.353  13.263
  548    HG1  THR  78           1HG      THR  78  10.956  -7.707  12.535
  549   1HG2  THR  78          1HG2      THR  78  11.448  -9.932  12.022
  550   2HG2  THR  78          2HG2      THR  78  10.246 -11.128  12.508
  551   3HG2  THR  78          3HG2      THR  78  11.042 -10.131  13.726
  552    H    ALA  79           H        ALA  79   8.754  -6.607  10.762
  553    HA   ALA  79           HA       ALA  79   5.922  -6.498  11.428
  554   1HB   ALA  79          1HB       ALA  79   7.433  -4.881  12.481
  555   2HB   ALA  79          2HB       ALA  79   6.210  -4.087  11.490
  556   3HB   ALA  79          3HB       ALA  79   7.861  -4.256  10.889
  557    H    PHE  80           H        PHE  80   8.082  -5.320   8.849
  558    HA   PHE  80           HA       PHE  80   5.825  -5.524   6.974
  559   1HB   PHE  80          2HB       PHE  80   7.825  -3.257   7.032
  560   2HB   PHE  80          1HB       PHE  80   6.447  -3.413   5.950
  561    HD1  PHE  80           1HD      PHE  80   7.616  -1.910   8.873
  562    HD2  PHE  80           2HD      PHE  80   4.130  -3.667   7.182
  563    HE1  PHE  80           1HE      PHE  80   6.224  -0.695  10.495
  564    HE2  PHE  80           2HE      PHE  80   2.733  -2.460   8.798
  565    HZ   PHE  80           HZ       PHE  80   3.775  -0.971  10.459
  566    H    GLY  81           H        GLY  81   7.849  -4.238   5.017
  567   1HA   GLY  81          2HA       GLY  81  10.072  -5.980   4.863
  568   2HA   GLY  81          1HA       GLY  81   8.795  -6.553   3.801
  569    H    TYR  82           H        TYR  82   7.814  -4.743   2.429
  570    HA   TYR  82           HA       TYR  82   9.784  -2.803   1.530
  571   1HB   TYR  82          2HB       TYR  82   9.671  -3.634  -0.807
  572   2HB   TYR  82          1HB       TYR  82  10.393  -4.816   0.278
  573    HD1  TYR  82           1HD      TYR  82   9.003  -6.769   1.045
  574    HD2  TYR  82           2HD      TYR  82   7.721  -4.150  -2.049
  575    HE1  TYR  82           1HE      TYR  82   7.388  -8.461   0.291
  576    HE2  TYR  82           2HE      TYR  82   6.101  -5.833  -2.812
  577    HH   TYR  82           HH       TYR  82   5.851  -8.345  -2.683
  578    H    TYR  83           H        TYR  83   8.866  -1.288  -0.027
  579    HA   TYR  83           HA       TYR  83   5.975  -1.403  -0.363
  580   1HB   TYR  83          2HB       TYR  83   5.585   0.817   0.432
  581   2HB   TYR  83          1HB       TYR  83   6.467  -0.028   1.688
  582    HD1  TYR  83           1HD      TYR  83   8.609   0.729   2.408
  583    HD2  TYR  83           2HD      TYR  83   6.733   2.540  -0.956
  584    HE1  TYR  83           1HE      TYR  83  10.273   2.538   2.456
  585    HE2  TYR  83           2HE      TYR  83   8.400   4.351  -0.913
  586    HH   TYR  83           HH       TYR  83   9.944   5.391   0.559
  587    H    LEU  84           H        LEU  84   5.260  -0.468  -2.244
  588    HA   LEU  84           HA       LEU  84   7.278   0.842  -3.943
  589   1HB   LEU  84          2HB       LEU  84   5.059  -1.020  -4.820
  590   2HB   LEU  84          1HB       LEU  84   6.064  -0.092  -5.911
  591    HG   LEU  84           HG       LEU  84   6.877  -2.302  -5.963
  592   1HD1  LEU  84          1HD1      LEU  84   9.147  -2.113  -5.117
  593   2HD1  LEU  84          2HD1      LEU  84   8.669  -0.738  -4.120
  594   3HD1  LEU  84          3HD1      LEU  84   8.623  -0.611  -5.879
  595   1HD2  LEU  84          1HD2      LEU  84   5.799  -3.128  -3.934
  596   2HD2  LEU  84          2HD2      LEU  84   6.987  -2.268  -2.953
  597   3HD2  LEU  84          3HD2      LEU  84   7.500  -3.589  -4.004
  598    H    THR  85           H        THR  85   6.673   2.981  -3.763
  599    HA   THR  85           HA       THR  85   3.898   3.690  -3.517
  600    HB   THR  85           HB       THR  85   5.952   5.773  -4.077
  601    HG1  THR  85           1HG      THR  85   5.856   4.788  -1.440
  602   1HG2  THR  85          1HG2      THR  85   3.649   6.378  -3.537
  603   2HG2  THR  85          2HG2      THR  85   4.757   6.936  -2.284
  604   3HG2  THR  85          3HG2      THR  85   3.766   5.501  -2.012
  605    H    LEU  86           H        LEU  86   2.767   3.378  -5.320
  606    HA   LEU  86           HA       LEU  86   3.906   4.302  -7.867
  607   1HB   LEU  86          2HB       LEU  86   3.718   1.892  -7.801
  608   2HB   LEU  86          1HB       LEU  86   2.058   1.996  -7.262
  609    HG   LEU  86           HG       LEU  86   2.655   3.248  -9.880
  610   1HD1  LEU  86          1HD1      LEU  86   2.550   1.082 -11.026
  611   2HD1  LEU  86          2HD1      LEU  86   2.608   0.259  -9.468
  612   3HD1  LEU  86          3HD1      LEU  86   3.988   1.213 -10.013
  613   1HD2  LEU  86          1HD2      LEU  86   0.402   3.236  -8.986
  614   2HD2  LEU  86          2HD2      LEU  86   0.458   1.484  -8.800
  615   3HD2  LEU  86          3HD2      LEU  86   0.484   2.199 -10.412
  616    H    THR  87           H        THR  87   2.783   5.756  -9.025
  617    HA   THR  87           HA       THR  87   0.137   6.511  -8.058
  618    HB   THR  87           HB       THR  87   1.585   8.381  -8.500
  619    HG1  THR  87           1HG      THR  87  -0.534   8.791  -9.084
  620   1HG2  THR  87          1HG2      THR  87   3.166   7.433 -10.035
  621   2HG2  THR  87          2HG2      THR  87   2.437   8.851 -10.789
  622   3HG2  THR  87          3HG2      THR  87   1.919   7.233 -11.268
  623    H    ARG  88           H        ARG  88  -1.631   5.799  -8.932
  624    HA   ARG  88           HA       ARG  88  -2.501   5.568 -11.463
  625   1HB   ARG  88          2HB       ARG  88  -0.534   3.893 -11.712
  626   2HB   ARG  88          1HB       ARG  88  -1.512   2.803 -10.744
  627   1HG   ARG  88          2HG       ARG  88  -3.332   3.058 -12.439
  628   2HG   ARG  88          1HG       ARG  88  -2.183   3.950 -13.439
  629   1HD   ARG  88          2HD       ARG  88  -2.103   1.725 -14.216
  630   2HD   ARG  88          1HD       ARG  88  -0.653   1.941 -13.235
  631    HE   ARG  88           HE       ARG  88  -3.094   0.539 -12.322
  632   1HH1  ARG  88          1HH1      ARG  88   0.384   1.028 -12.232
  633   2HH1  ARG  88          2HH1      ARG  88   0.682  -0.377 -11.264
  634   1HH2  ARG  88          1HH2      ARG  88  -2.699  -1.319 -11.051
  635   2HH2  ARG  88          2HH2      ARG  88  -1.066  -1.729 -10.610
  636    H    LEU  89           H        LEU  89  -4.155   6.199  -9.891
  637    HA   LEU  89           HA       LEU  89  -5.577   3.869  -8.809
  638   1HB   LEU  89          2HB       LEU  89  -4.353   4.942  -6.966
  639   2HB   LEU  89          1HB       LEU  89  -5.098   6.478  -7.356
  640    HG   LEU  89           HG       LEU  89  -7.316   5.493  -6.781
  641   1HD1  LEU  89          1HD1      LEU  89  -7.395   3.411  -5.530
  642   2HD1  LEU  89          2HD1      LEU  89  -5.664   3.184  -5.775
  643   3HD1  LEU  89          3HD1      LEU  89  -6.761   3.143  -7.154
  644   1HD2  LEU  89          1HD2      LEU  89  -6.108   6.842  -5.170
  645   2HD2  LEU  89          2HD2      LEU  89  -5.211   5.425  -4.624
  646   3HD2  LEU  89          3HD2      LEU  89  -6.952   5.526  -4.357
  647    H    ASP  90           H        ASP  90  -7.858   4.412  -8.295
  648    HA   ASP  90           HA       ASP  90  -9.030   6.681  -9.655
  649   1HB   ASP  90          2HB       ASP  90  -8.815   5.126 -11.511
  650   2HB   ASP  90          1HB       ASP  90  -9.498   3.822 -10.547
  651    H    LYS  91           H        LYS  91 -11.366   6.843  -9.122
  652    HA   LYS  91           HA       LYS  91 -11.885   6.326  -6.438
  653   1HB   LYS  91          2HB       LYS  91 -13.070   8.011  -7.845
  654   2HB   LYS  91          1HB       LYS  91 -13.957   6.700  -8.611
  655   1HG   LYS  91          2HG       LYS  91 -15.277   7.806  -6.877
  656   2HG   LYS  91          1HG       LYS  91 -14.977   6.112  -6.491
  657   1HD   LYS  91          2HD       LYS  91 -13.175   6.762  -4.980
  658   2HD   LYS  91          1HD       LYS  91 -13.429   8.459  -5.386
  659   1HE   LYS  91          2HE       LYS  91 -15.488   6.664  -4.105
  660   2HE   LYS  91          1HE       LYS  91 -14.457   7.796  -3.230
  661   1HZ   LYS  91          1HZ       LYS  91 -16.426   8.525  -5.337
  662   2HZ   LYS  91          2HZ       LYS  91 -15.439   9.610  -4.493
  663   3HZ   LYS  91          3HZ       LYS  91 -16.642   8.743  -3.669
  664    H    ALA  92           H        ALA  92 -12.798   4.437  -9.301
  665    HA   ALA  92           HA       ALA  92 -14.354   2.527  -7.868
  666   1HB   ALA  92          1HB       ALA  92 -14.262   1.203  -9.900
  667   2HB   ALA  92          2HB       ALA  92 -12.971   2.226 -10.530
  668   3HB   ALA  92          3HB       ALA  92 -14.585   2.894 -10.286
  669    H    ALA  93           H        ALA  93 -10.986   2.708  -8.882
  670    HA   ALA  93           HA       ALA  93 -10.227   0.115  -8.051
  671   1HB   ALA  93          1HB       ALA  93  -8.892   1.471  -9.606
  672   2HB   ALA  93          2HB       ALA  93  -7.941   0.909  -8.232
  673   3HB   ALA  93          3HB       ALA  93  -8.503   2.579  -8.292
  674    H    CYS  94           H        CYS  94 -10.430   3.209  -6.414
  675    HA   CYS  94           HA       CYS  94  -9.163   2.551  -4.005
  676   1HB   CYS  94          2HB       CYS  94  -9.801   4.846  -4.571
  677   2HB   CYS  94          1HB       CYS  94 -11.504   4.407  -4.513
  678    H    VAL  95           H        VAL  95 -12.574   2.275  -4.963
  679    HA   VAL  95           HA       VAL  95 -13.442   1.038  -2.579
  680    HB   VAL  95           HB       VAL  95 -14.664   0.820  -5.336
  681   1HG1  VAL  95          1HG1      VAL  95 -16.751   0.335  -4.159
  682   2HG1  VAL  95          2HG1      VAL  95 -15.899   0.395  -2.615
  683   3HG1  VAL  95          3HG1      VAL  95 -15.514  -0.867  -3.784
  684   1HG2  VAL  95          1HG2      VAL  95 -15.171   2.812  -3.126
  685   2HG2  VAL  95          2HG2      VAL  95 -16.129   2.664  -4.601
  686   3HG2  VAL  95          3HG2      VAL  95 -14.433   3.143  -4.694
  687    H    SER  96           H        SER  96 -11.926  -0.150  -5.453
  688    HA   SER  96           HA       SER  96 -12.628  -2.879  -5.178
  689   1HB   SER  96          2HB       SER  96 -11.800  -1.708  -7.264
  690   2HB   SER  96          1HB       SER  96 -10.184  -1.779  -6.564
  691    HG   SER  96           HG       SER  96 -11.715  -4.130  -6.722
  692    H    LEU  97           H        LEU  97  -9.762  -1.007  -4.203
  693    HA   LEU  97           HA       LEU  97  -8.264  -3.131  -3.149
  694   1HB   LEU  97          2HB       LEU  97  -8.338  -0.245  -2.254
  695   2HB   LEU  97          1HB       LEU  97  -7.096  -1.405  -1.825
  696    HG   LEU  97           HG       LEU  97  -7.678  -0.440  -4.625
  697   1HD1  LEU  97          1HD1      LEU  97  -5.507   0.700  -4.418
  698   2HD1  LEU  97          2HD1      LEU  97  -5.439   0.226  -2.720
  699   3HD1  LEU  97          3HD1      LEU  97  -6.703   1.319  -3.281
  700   1HD2  LEU  97          1HD2      LEU  97  -6.828  -2.716  -4.601
  701   2HD2  LEU  97          2HD2      LEU  97  -5.498  -2.226  -3.550
  702   3HD2  LEU  97          3HD2      LEU  97  -5.595  -1.604  -5.198
  703    H    ALA  98           H        ALA  98 -10.836  -1.196  -1.811
  704    HA   ALA  98           HA       ALA  98 -10.669  -2.295   0.819
  705   1HB   ALA  98          1HB       ALA  98 -12.737  -1.101   1.230
  706   2HB   ALA  98          2HB       ALA  98 -12.936  -0.814  -0.498
  707   3HB   ALA  98          3HB       ALA  98 -11.596  -0.069   0.370
  708    H    THR  99           H        THR  99 -12.586  -3.024  -2.079
  709    HA   THR  99           HA       THR  99 -13.975  -5.189  -0.741
  710    HB   THR  99           HB       THR  99 -14.582  -5.764  -3.237
  711    HG1  THR  99           1HG      THR  99 -13.807  -3.026  -3.434
  712   1HG2  THR  99          1HG2      THR  99 -16.248  -5.032  -1.679
  713   2HG2  THR  99          2HG2      THR  99 -16.433  -4.086  -3.156
  714   3HG2  THR  99          3HG2      THR  99 -15.657  -3.370  -1.741
  715    H    LEU 100           H        LEU 100 -11.008  -4.951  -1.102
  716    HA   LEU 100           HA       LEU 100 -10.560  -7.664  -2.165
  717   1HB   LEU 100          2HB       LEU 100  -9.442  -5.474  -3.224
  718   2HB   LEU 100          1HB       LEU 100  -8.313  -5.718  -1.908
  719    HG   LEU 100           HG       LEU 100  -8.919  -7.679  -4.126
  720   1HD1  LEU 100          1HD1      LEU 100  -6.456  -6.056  -3.516
  721   2HD1  LEU 100          2HD1      LEU 100  -7.597  -5.754  -4.823
  722   3HD1  LEU 100          3HD1      LEU 100  -6.630  -7.228  -4.821
  723   1HD2  LEU 100          1HD2      LEU 100  -7.071  -9.002  -3.188
  724   2HD2  LEU 100          2HD2      LEU 100  -8.435  -8.883  -2.076
  725   3HD2  LEU 100          3HD2      LEU 100  -6.994  -7.901  -1.814
  726    H    ASN 101           H        ASN 101 -10.706  -8.814  -0.317
  727    HA   ASN 101           HA       ASN 101  -9.973  -7.753   2.205
  728   1HB   ASN 101          2HB       ASN 101 -11.740  -9.369   2.040
  729   2HB   ASN 101          1HB       ASN 101 -10.657 -10.572   1.345
  730   1HD2  ASN 101          1HD2      ASN 101 -11.636  -8.894   4.225
  731   2HD2  ASN 101          2HD2      ASN 101 -10.858  -9.963   5.349
  732    H    LEU 102           H        LEU 102  -7.866  -7.229   2.410
  733    HA   LEU 102           HA       LEU 102  -5.765  -9.079   1.642
  734   1HB   LEU 102          2HB       LEU 102  -5.529  -6.444   3.098
  735   2HB   LEU 102          1HB       LEU 102  -4.232  -7.340   2.333
  736    HG   LEU 102           HG       LEU 102  -6.496  -5.916   0.944
  737   1HD1  LEU 102          1HD1      LEU 102  -4.707  -4.518   0.046
  738   2HD1  LEU 102          2HD1      LEU 102  -3.528  -5.408   1.009
  739   3HD1  LEU 102          3HD1      LEU 102  -4.769  -4.444   1.806
  740   1HD2  LEU 102          1HD2      LEU 102  -4.222  -7.507  -0.241
  741   2HD2  LEU 102          2HD2      LEU 102  -5.422  -6.579  -1.139
  742   3HD2  LEU 102          3HD2      LEU 102  -5.915  -8.000  -0.217
  743    H    GLY 103           H        GLY 103  -7.717  -9.669   3.863
  744   1HA   GLY 103          2HA       GLY 103  -6.429  -9.249   6.360
  745   2HA   GLY 103          1HA       GLY 103  -7.786 -10.324   6.066
  746    H    THR 104           H        THR 104  -5.499 -11.272   3.936
  747    HA   THR 104           HA       THR 104  -4.227 -13.104   5.852
  748    HB   THR 104           HB       THR 104  -4.234 -14.767   3.916
  749    HG1  THR 104           1HG      THR 104  -6.417 -14.025   2.705
  750   1HG2  THR 104          1HG2      THR 104  -6.859 -13.946   5.167
  751   2HG2  THR 104          2HG2      THR 104  -5.671 -15.052   5.856
  752   3HG2  THR 104          3HG2      THR 104  -6.543 -15.498   4.390
  753    H    SER 105           H        SER 105  -3.634 -10.621   3.770
  754    HA   SER 105           HA       SER 105  -0.919 -11.535   3.189
  755   1HB   SER 105          2HB       SER 105  -1.287 -10.716   0.776
  756   2HB   SER 105          1HB       SER 105  -1.968 -12.283   1.216
  757    HG   SER 105           HG       SER 105  -3.756 -11.440   0.502
  758    H    ALA 106           H        ALA 106  -2.605  -9.245   4.584
  759    HA   ALA 106           HA       ALA 106  -1.198  -6.984   3.365
  760   1HB   ALA 106          1HB       ALA 106  -3.254  -7.019   5.574
  761   2HB   ALA 106          2HB       ALA 106  -3.546  -6.614   3.883
  762   3HB   ALA 106          3HB       ALA 106  -2.526  -5.574   4.874
  763    H    LYS 107           H        LYS 107   0.475  -5.965   4.338
  764    HA   LYS 107           HA       LYS 107   1.235  -6.980   6.969
  765   1HB   LYS 107          2HB       LYS 107   2.941  -5.419   5.025
  766   2HB   LYS 107          1HB       LYS 107   3.473  -6.135   6.543
  767   1HG   LYS 107          2HG       LYS 107   2.509  -8.320   5.443
  768   2HG   LYS 107          1HG       LYS 107   2.838  -7.435   3.959
  769   1HD   LYS 107          2HD       LYS 107   4.736  -8.804   4.459
  770   2HD   LYS 107          1HD       LYS 107   5.184  -7.121   4.765
  771   1HE   LYS 107          2HE       LYS 107   4.895  -7.406   7.127
  772   2HE   LYS 107          1HE       LYS 107   4.218  -9.016   6.901
  773   1HZ   LYS 107          1HZ       LYS 107   6.425  -9.338   7.571
  774   2HZ   LYS 107          2HZ       LYS 107   7.026  -8.147   6.532
  775   3HZ   LYS 107          3HZ       LYS 107   6.453  -9.607   5.897
  776    H    GLY 108           H        GLY 108  -0.221  -4.450   5.396
  777   1HA   GLY 108          2HA       GLY 108  -1.189  -3.130   7.516
  778   2HA   GLY 108          1HA       GLY 108   0.386  -2.393   7.328
  779    H    TYR 109           H        TYR 109  -2.780  -2.108   6.504
  780    HA   TYR 109           HA       TYR 109  -2.121  -0.740   3.987
  781   1HB   TYR 109          2HB       TYR 109  -3.818  -2.587   3.919
  782   2HB   TYR 109          1HB       TYR 109  -4.812  -1.652   5.030
  783    HD1  TYR 109           1HD      TYR 109  -5.613  -2.714   2.349
  784    HD2  TYR 109           2HD      TYR 109  -4.015   1.034   3.519
  785    HE1  TYR 109           1HE      TYR 109  -6.755  -1.666   0.445
  786    HE2  TYR 109           2HE      TYR 109  -5.153   2.122   1.613
  787    HH   TYR 109           HH       TYR 109  -7.609   0.695  -0.093
  788    H    GLY 110           H        GLY 110  -2.131   1.440   4.021
  789   1HA   GLY 110          2HA       GLY 110  -3.408   2.745   6.340
  790   2HA   GLY 110          1HA       GLY 110  -1.836   3.233   5.723
  791    H    VAL 111           H        VAL 111  -4.601   4.511   5.986
  792    HA   VAL 111           HA       VAL 111  -4.956   5.315   3.184
  793    HB   VAL 111           HB       VAL 111  -6.853   5.660   5.518
  794   1HG1  VAL 111          1HG1      VAL 111  -7.085   7.435   3.862
  795   2HG1  VAL 111          2HG1      VAL 111  -8.482   6.358   3.835
  796   3HG1  VAL 111          3HG1      VAL 111  -7.247   6.230   2.583
  797   1HG2  VAL 111          1HG2      VAL 111  -6.948   3.752   3.181
  798   2HG2  VAL 111          2HG2      VAL 111  -8.218   3.960   4.386
  799   3HG2  VAL 111          3HG2      VAL 111  -6.644   3.326   4.865
  800    H    ASN 112           H        ASN 112  -4.071   7.166   2.629
  801    HA   ASN 112           HA       ASN 112  -3.587   9.378   2.580
  802   1HB   ASN 112          2HB       ASN 112  -5.596   9.257   4.659
  803   2HB   ASN 112          1HB       ASN 112  -4.405  10.506   5.001
  804   1HD2  ASN 112          1HD2      ASN 112  -6.900   9.438   2.840
  805   2HD2  ASN 112          2HD2      ASN 112  -7.041  10.911   1.944
  806    H    ILE 113           H        ILE 113  -2.116   7.214   4.253
  807    HA   ILE 113           HA       ILE 113  -0.655   8.571   6.255
  808    HB   ILE 113           HB       ILE 113  -0.409   5.965   4.854
  809   1HG1  ILE 113          2HG1      ILE 113  -0.184   5.158   7.191
  810   2HG1  ILE 113          1HG1      ILE 113  -0.238   6.827   7.746
  811   1HG2  ILE 113          1HG2      ILE 113   1.778   5.464   5.828
  812   2HG2  ILE 113          2HG2      ILE 113   1.921   7.136   6.365
  813   3HG2  ILE 113          3HG2      ILE 113   1.878   6.765   4.643
  814   1HD1  ILE 113          1HD1      ILE 113  -2.379   5.741   8.020
  815   2HD1  ILE 113          2HD1      ILE 113  -2.433   5.374   6.294
  816   3HD1  ILE 113          3HD1      ILE 113  -2.488   7.051   6.843
  817    H    SER 114           H        SER 114   1.215   9.683   6.224
  818    HA   SER 114           HA       SER 114   2.770   9.734   3.732
  819   1HB   SER 114          2HB       SER 114   2.163  12.119   5.500
  820   2HB   SER 114          1HB       SER 114   3.242  12.130   4.103
  821    HG   SER 114           HG       SER 114   0.883  11.062   3.409
  822    H    GLY 115           H        GLY 115   4.339   8.394   4.392
  823   1HA   GLY 115          2HA       GLY 115   6.563   8.693   5.650
  824   2HA   GLY 115          1HA       GLY 115   5.515   8.771   7.064
  825    H    GLU 116           H        GLU 116   6.057   6.725   4.211
  826    HA   GLU 116           HA       GLU 116   4.656   4.522   5.187
  827   1HB   GLU 116          2HB       GLU 116   6.796   4.716   3.078
  828   2HB   GLU 116          1HB       GLU 116   5.797   3.302   3.354
  829   1HG   GLU 116          2HG       GLU 116   3.805   4.798   2.954
  830   2HG   GLU 116          1HG       GLU 116   4.958   6.005   2.381
  831    H    ASN 117           H        ASN 117   8.122   5.275   5.293
  832    HA   ASN 117           HA       ASN 117   9.145   2.840   6.058
  833   1HB   ASN 117          2HB       ASN 117  10.513   4.847   5.563
  834   2HB   ASN 117          1HB       ASN 117  10.045   5.529   7.117
  835   1HD2  ASN 117          1HD2      ASN 117  12.032   3.260   5.469
  836   2HD2  ASN 117          2HD2      ASN 117  12.967   2.757   6.832
  837    H    ASN 118           H        ASN 118   7.652   5.295   8.121
  838    HA   ASN 118           HA       ASN 118   7.315   3.205  10.159
  839   1HB   ASN 118          2HB       ASN 118   7.900   6.135  10.647
  840   2HB   ASN 118          1HB       ASN 118   7.363   5.019  11.897
  841   1HD2  ASN 118          1HD2      ASN 118   8.961   2.811  10.741
  842   2HD2  ASN 118          2HD2      ASN 118  10.597   3.151  11.195
  843    H    ILE 119           H        ILE 119   5.375   2.966   8.748
  844    HA   ILE 119           HA       ILE 119   3.319   4.882   8.670
  845    HB   ILE 119           HB       ILE 119   3.448   2.943   7.155
  846   1HG1  ILE 119          2HG1      ILE 119   0.878   2.970   8.755
  847   2HG1  ILE 119          1HG1      ILE 119   1.288   4.108   7.478
  848   1HG2  ILE 119          1HG2      ILE 119   2.615   1.318   9.550
  849   2HG2  ILE 119          2HG2      ILE 119   4.195   1.276   8.762
  850   3HG2  ILE 119          3HG2      ILE 119   2.760   0.728   7.892
  851   1HD1  ILE 119          1HD1      ILE 119   0.903   1.143   7.156
  852   2HD1  ILE 119          2HD1      ILE 119   1.349   2.264   5.869
  853   3HD1  ILE 119          3HD1      ILE 119  -0.221   2.407   6.661
  854    H    THR 120           H        THR 120   1.194   4.707   9.755
  855    HA   THR 120           HA       THR 120   1.570   4.659  12.588
  856    HB   THR 120           HB       THR 120  -0.963   5.199  12.530
  857    HG1  THR 120           1HG      THR 120  -0.707   6.164   9.980
  858   1HG2  THR 120          1HG2      THR 120  -0.494   7.533  11.961
  859   2HG2  THR 120          2HG2      THR 120   1.027   7.052  11.209
  860   3HG2  THR 120          3HG2      THR 120   0.800   6.852  12.947
  861    H    SER 121           H        SER 121  -0.338   3.714  13.937
  862    HA   SER 121           HA       SER 121  -0.175   0.879  13.675
  863   1HB   SER 121          2HB       SER 121  -1.872   2.546  15.550
  864   2HB   SER 121          1HB       SER 121  -1.488   0.834  15.737
  865    HG   SER 121           HG       SER 121   0.738   1.444  15.871
  866    H    PHE 122           H        PHE 122  -1.933  -0.601  13.431
  867    HA   PHE 122           HA       PHE 122  -3.869   0.419  11.470
  868   1HB   PHE 122          2HB       PHE 122  -3.322  -2.500  11.946
  869   2HB   PHE 122          1HB       PHE 122  -3.861  -1.697  10.476
  870    HD1  PHE 122           1HD      PHE 122  -2.234  -0.366   9.133
  871    HD2  PHE 122           2HD      PHE 122  -1.025  -2.782  12.420
  872    HE1  PHE 122           1HE      PHE 122   0.087  -0.293   8.326
  873    HE2  PHE 122           2HE      PHE 122   1.299  -2.706  11.623
  874    HZ   PHE 122           HZ       PHE 122   1.857  -1.456   9.579
  875    H    GLY 123           H        GLY 123  -5.891   0.610  11.977
  876   1HA   GLY 123          2HA       GLY 123  -7.008  -1.226  14.003
  877   2HA   GLY 123          1HA       GLY 123  -7.603   0.405  13.735
  878    H    ASN 124           H        ASN 124  -9.545   0.297  12.862
  879    HA   ASN 124           HA       ASN 124  -9.953  -1.556  10.607
  880   1HB   ASN 124          2HB       ASN 124 -11.162  -2.432  12.501
  881   2HB   ASN 124          1HB       ASN 124 -11.866  -0.857  12.846
  882   1HD2  ASN 124          1HD2      ASN 124 -13.706  -0.270  11.853
  883   2HD2  ASN 124          2HD2      ASN 124 -14.547  -1.248  10.698
  884    H    SER 125           H        SER 125  -9.929   1.622  11.694
  885    HA   SER 125           HA       SER 125 -12.057   2.524   9.891
  886   1HB   SER 125          2HB       SER 125 -11.959   3.402  12.227
  887   2HB   SER 125          1HB       SER 125 -10.400   4.134  11.857
  888    HG   SER 125           HG       SER 125 -12.827   5.134  11.429
  889    H    ALA 126           H        ALA 126 -11.481   4.730   8.812
  890    HA   ALA 126           HA       ALA 126  -8.788   4.755   7.716
  891   1HB   ALA 126          1HB       ALA 126  -9.621   4.733   5.389
  892   2HB   ALA 126          2HB       ALA 126 -11.231   4.338   5.997
  893   3HB   ALA 126          3HB       ALA 126  -9.896   3.211   6.231
  894    H    ASP 127           H        ASP 127  -8.172   6.783   7.741
  895    HA   ASP 127           HA       ASP 127  -9.801   8.876   6.633
  896   1HB   ASP 127          2HB       ASP 127 -10.652   8.912   8.916
  897   2HB   ASP 127          1HB       ASP 127  -9.011   8.961   9.557
  898    H    GLN 128           H        GLN 128  -7.209   9.035   9.015
  899    HA   GLN 128           HA       GLN 128  -5.222   9.286   6.882
  900   1HB   GLN 128          2HB       GLN 128  -5.462  11.166   9.241
  901   2HB   GLN 128          1HB       GLN 128  -4.055  11.074   8.193
  902   1HG   GLN 128          2HG       GLN 128  -5.907  11.488   6.334
  903   2HG   GLN 128          1HG       GLN 128  -6.725  12.245   7.700
  904   1HE2  GLN 128          1HE2      GLN 128  -3.267  12.125   7.333
  905   2HE2  GLN 128          2HE2      GLN 128  -3.035  13.814   7.047
  906    H    ALA 129           H        ALA 129  -5.991   7.119   8.501
  907    HA   ALA 129           HA       ALA 129  -3.572   6.709  10.103
  908   1HB   ALA 129          1HB       ALA 129  -4.846   5.555  11.813
  909   2HB   ALA 129          2HB       ALA 129  -6.342   5.824  10.920
  910   3HB   ALA 129          3HB       ALA 129  -5.471   7.191  11.614
  911    H    ALA 130           H        ALA 130  -3.250   4.327  10.534
  912    HA   ALA 130           HA       ALA 130  -3.690   2.906   8.039
  913   1HB   ALA 130          1HB       ALA 130  -1.430   3.013   8.949
  914   2HB   ALA 130          2HB       ALA 130  -2.008   1.350   8.863
  915   3HB   ALA 130          3HB       ALA 130  -1.976   2.191  10.411
  916    H    LYS 131           H        LYS 131  -4.373   0.673   8.044
  917    HA   LYS 131           HA       LYS 131  -5.999  -0.137  10.325
  918   1HB   LYS 131          2HB       LYS 131  -7.984  -0.440   8.978
  919   2HB   LYS 131          1HB       LYS 131  -7.444   1.226   8.857
  920   1HG   LYS 131          2HG       LYS 131  -6.210   0.346   6.719
  921   2HG   LYS 131          1HG       LYS 131  -7.444  -0.920   6.800
  922   1HD   LYS 131          2HD       LYS 131  -8.026   2.036   6.814
  923   2HD   LYS 131          1HD       LYS 131  -8.070   1.011   5.378
  924   1HE   LYS 131          2HE       LYS 131  -9.744   0.599   7.861
  925   2HE   LYS 131          1HE       LYS 131 -10.307   1.383   6.388
  926   1HZ   LYS 131          1HZ       LYS 131 -11.020  -0.857   6.323
  927   2HZ   LYS 131          2HZ       LYS 131  -9.485  -1.441   6.713
  928   3HZ   LYS 131          3HZ       LYS 131  -9.749  -0.717   5.199
  929    H    SER 132           H        SER 132  -6.840  -2.339  10.069
  930    HA   SER 132           HA       SER 132  -4.922  -4.068   8.778
  931   1HB   SER 132          2HB       SER 132  -5.702  -4.635  11.005
  932   2HB   SER 132          1HB       SER 132  -7.371  -4.620  10.464
  933    HG   SER 132           HG       SER 132  -6.336  -6.319   8.881
  934    H    THR 133           H        THR 133  -7.410  -2.350   7.718
  935    HA   THR 133           HA       THR 133  -8.832  -2.346   5.951
  936    HB   THR 133           HB       THR 133  -6.645  -2.101   4.887
  937    HG1  THR 133           1HG      THR 133  -8.173  -1.881   3.388
  938   1HG2  THR 133          1HG2      THR 133  -6.767  -5.068   4.384
  939   2HG2  THR 133          2HG2      THR 133  -5.618  -4.246   5.440
  940   3HG2  THR 133          3HG2      THR 133  -5.580  -3.957   3.700
  941    H    ALA 134           H        ALA 134  -8.646  -4.330   3.781
  942    HA   ALA 134           HA       ALA 134  -9.318  -6.355   3.086
  943   1HB   ALA 134          1HB       ALA 134  -9.642  -7.057   6.000
  944   2HB   ALA 134          2HB       ALA 134  -8.197  -7.331   5.026
  945   3HB   ALA 134          3HB       ALA 134  -9.690  -8.188   4.649
  946    H    ILE 135           H        ILE 135 -11.097  -3.990   3.873
  947    HA   ILE 135           HA       ILE 135 -13.486  -5.235   2.994
  948    HB   ILE 135           HB       ILE 135 -13.531  -5.963   5.352
  949   1HG1  ILE 135          2HG1      ILE 135 -15.827  -5.118   5.909
  950   2HG1  ILE 135          1HG1      ILE 135 -15.681  -3.999   4.557
  951   1HG2  ILE 135          1HG2      ILE 135 -13.678  -3.031   6.001
  952   2HG2  ILE 135          2HG2      ILE 135 -12.364  -4.138   6.402
  953   3HG2  ILE 135          3HG2      ILE 135 -13.950  -4.343   7.148
  954   1HD1  ILE 135          1HD1      ILE 135 -15.458  -5.883   3.025
  955   2HD1  ILE 135          2HD1      ILE 135 -16.962  -5.965   3.944
  956   3HD1  ILE 135          3HD1      ILE 135 -15.604  -7.004   4.381
  957    H    THR 136           H        THR 136 -14.723  -3.877   1.973
  958    HA   THR 136           HA       THR 136 -14.034  -1.189   1.624
  959    HB   THR 136           HB       THR 136 -16.460  -2.744   0.771
  960    HG1  THR 136           1HG      THR 136 -14.490  -1.486  -0.818
  961   1HG2  THR 136          1HG2      THR 136 -17.108  -0.850  -0.638
  962   2HG2  THR 136          2HG2      THR 136 -15.834   0.134   0.085
  963   3HG2  THR 136          3HG2      THR 136 -17.188  -0.421   1.071
  964    HA   PRO 137           HA       PRO 137 -18.387  -0.066   3.615
  965   1HB   PRO 137          2HB       PRO 137 -18.215  -2.176   5.743
  966   2HB   PRO 137          1HB       PRO 137 -19.649  -1.400   5.056
  967   1HG   PRO 137          2HG       PRO 137 -18.948  -3.804   4.235
  968   2HG   PRO 137          1HG       PRO 137 -19.473  -2.589   3.052
  969   1HD   PRO 137          2HD       PRO 137 -16.732  -3.591   3.652
  970   2HD   PRO 137          1HD       PRO 137 -17.431  -3.068   2.107
  971    H    ALA 138           H        ALA 138 -15.779  -1.315   5.702
  972    HA   ALA 138           HA       ALA 138 -16.123   0.845   7.594
  973   1HB   ALA 138          1HB       ALA 138 -13.942  -1.228   7.427
  974   2HB   ALA 138          2HB       ALA 138 -15.449  -1.404   8.323
  975   3HB   ALA 138          3HB       ALA 138 -14.281  -0.170   8.797
  976    H    GLU 139           H        GLU 139 -14.035   0.074   4.909
  977    HA   GLU 139           HA       GLU 139 -12.108   2.145   5.530
  978   1HB   GLU 139          2HB       GLU 139 -11.514  -0.080   4.555
  979   2HB   GLU 139          1HB       GLU 139 -12.338   0.398   3.080
  980   1HG   GLU 139          2HG       GLU 139 -10.742   2.060   2.608
  981   2HG   GLU 139          1HG       GLU 139 -10.056   1.972   4.232
  982    H    ALA 140           H        ALA 140 -14.177   1.410   2.741
  983    HA   ALA 140           HA       ALA 140 -13.664   3.757   1.318
  984   1HB   ALA 140          1HB       ALA 140 -15.605   3.130  -0.030
  985   2HB   ALA 140          2HB       ALA 140 -16.074   1.947   1.199
  986   3HB   ALA 140          3HB       ALA 140 -14.565   1.743   0.304
  987    H    ALA 141           H        ALA 141 -16.307   2.980   3.556
  988    HA   ALA 141           HA       ALA 141 -17.839   5.277   2.948
  989   1HB   ALA 141          1HB       ALA 141 -19.162   4.699   4.901
  990   2HB   ALA 141          2HB       ALA 141 -17.917   3.567   5.428
  991   3HB   ALA 141          3HB       ALA 141 -18.811   3.264   3.939
  992    H    THR 142           H        THR 142 -15.221   4.714   5.213
  993    HA   THR 142           HA       THR 142 -15.834   7.124   6.688
  994    HB   THR 142           HB       THR 142 -13.371   5.419   7.015
  995    HG1  THR 142           1HG      THR 142 -14.670   3.887   7.691
  996   1HG2  THR 142          1HG2      THR 142 -13.516   6.214   9.334
  997   2HG2  THR 142          2HG2      THR 142 -14.951   7.152   8.923
  998   3HG2  THR 142          3HG2      THR 142 -13.393   7.563   8.205
  999    H    ALA 143           H        ALA 143 -13.371   6.032   4.374
 1000    HA   ALA 143           HA       ALA 143 -12.226   8.746   4.463
 1001   1HB   ALA 143          1HB       ALA 143 -10.862   6.198   3.626
 1002   2HB   ALA 143          2HB       ALA 143 -10.691   6.989   5.194
 1003   3HB   ALA 143          3HB       ALA 143 -10.126   7.799   3.732
 1004    H    CYS 144           H        CYS 144 -12.908   6.071   2.205
 1005    HA   CYS 144           HA       CYS 144 -12.032   7.621  -0.050
 1006   1HB   CYS 144          2HB       CYS 144 -11.753   5.138   0.152
 1007   2HB   CYS 144          1HB       CYS 144 -13.490   4.976  -0.066
 1008    H    LYS 145           H        LYS 145 -13.687   9.320   0.656
 1009    HA   LYS 145           HA       LYS 145 -16.015   8.977  -1.103
 1010   1HB   LYS 145          2HB       LYS 145 -15.987  10.261   1.632
 1011   2HB   LYS 145          1HB       LYS 145 -17.305  10.443   0.486
 1012   1HG   LYS 145          2HG       LYS 145 -16.356   7.810   1.590
 1013   2HG   LYS 145          1HG       LYS 145 -17.726   8.730   2.214
 1014   1HD   LYS 145          2HD       LYS 145 -18.874   8.524   0.091
 1015   2HD   LYS 145          1HD       LYS 145 -17.477   7.707  -0.616
 1016   1HE   LYS 145          2HE       LYS 145 -17.758   5.843   0.895
 1017   2HE   LYS 145          1HE       LYS 145 -19.071   6.675   1.725
 1018   1HZ   LYS 145          1HZ       LYS 145 -19.126   5.845  -1.130
 1019   2HZ   LYS 145          2HZ       LYS 145 -20.399   6.549  -0.260
 1020   3HZ   LYS 145          3HZ       LYS 145 -19.859   4.997   0.144
 1021    H    ASN 146           H        ASN 146 -14.589  11.614   0.848
 1022    HA   ASN 146           HA       ASN 146 -14.674  13.275  -1.582
 1023   1HB   ASN 146          2HB       ASN 146 -14.881  13.985   1.335
 1024   2HB   ASN 146          1HB       ASN 146 -14.526  15.195   0.108
 1025   1HD2  ASN 146          1HD2      ASN 146 -16.088  15.752  -1.376
 1026   2HD2  ASN 146          2HD2      ASN 146 -17.763  15.346  -1.162
 1027    H    THR 147           H        THR 147 -12.480  11.475  -0.077
 1028    HA   THR 147           HA       THR 147 -10.322  13.363  -0.032
 1029    HB   THR 147           HB       THR 147 -10.229  11.354   1.393
 1030    HG1  THR 147           1HG      THR 147  -8.280  12.424   0.375
 1031   1HG2  THR 147          1HG2      THR 147 -11.310   9.727  -0.050
 1032   2HG2  THR 147          2HG2      THR 147  -9.710   9.153   0.425
 1033   3HG2  THR 147          3HG2      THR 147  -9.966   9.817  -1.189
 1034    H    ASP 148           H        ASP 148  -9.875  14.341  -1.850
 1035    HA   ASP 148           HA       ASP 148  -9.828  12.782  -4.355
 1036   1HB   ASP 148          2HB       ASP 148 -11.684  14.314  -4.383
 1037   2HB   ASP 148          1HB       ASP 148 -10.664  15.640  -3.840
 1038    H    SER 149           H        SER 149  -8.615  15.872  -3.048
 1039    HA   SER 149           HA       SER 149  -6.234  15.681  -4.682
 1040   1HB   SER 149          2HB       SER 149  -7.422  17.856  -4.122
 1041   2HB   SER 149          1HB       SER 149  -6.818  17.674  -2.476
 1042    HG   SER 149           HG       SER 149  -4.867  17.391  -4.386
 1043    H    THR 150           H        THR 150  -7.286  14.536  -1.715
 1044    HA   THR 150           HA       THR 150  -4.548  14.188  -0.702
 1045    HB   THR 150           HB       THR 150  -5.732  13.613   1.466
 1046    HG1  THR 150           1HG      THR 150  -7.942  14.612   1.490
 1047   1HG2  THR 150          1HG2      THR 150  -6.192  16.392   0.373
 1048   2HG2  THR 150          2HG2      THR 150  -4.683  15.808   1.074
 1049   3HG2  THR 150          3HG2      THR 150  -6.129  15.940   2.077
 1050    H    ASN 151           H        ASN 151  -6.350  12.593  -2.703
 1051    HA   ASN 151           HA       ASN 151  -6.878  10.138  -1.320
 1052   1HB   ASN 151          2HB       ASN 151  -8.250  10.969  -3.249
 1053   2HB   ASN 151          1HB       ASN 151  -6.889  10.600  -4.304
 1054   1HD2  ASN 151          1HD2      ASN 151  -8.079   9.096  -5.461
 1055   2HD2  ASN 151          2HD2      ASN 151  -8.477   7.546  -4.812
 1056    H    LYS 152           H        LYS 152  -4.889   9.532  -0.506
 1057    HA   LYS 152           HA       LYS 152  -3.307   8.029  -2.420
 1058   1HB   LYS 152          2HB       LYS 152  -1.271   8.935  -0.874
 1059   2HB   LYS 152          1HB       LYS 152  -1.693   9.584  -2.445
 1060   1HG   LYS 152          2HG       LYS 152  -1.412  11.461  -1.103
 1061   2HG   LYS 152          1HG       LYS 152  -3.159  11.248  -1.175
 1062   1HD   LYS 152          2HD       LYS 152  -3.208  10.325   1.029
 1063   2HD   LYS 152          1HD       LYS 152  -1.445  10.223   1.088
 1064   1HE   LYS 152          2HE       LYS 152  -1.257  12.625   1.069
 1065   2HE   LYS 152          1HE       LYS 152  -2.992  12.799   0.828
 1066   1HZ   LYS 152          1HZ       LYS 152  -1.808  11.528   3.239
 1067   2HZ   LYS 152          2HZ       LYS 152  -3.416  12.009   3.002
 1068   3HZ   LYS 152          3HZ       LYS 152  -2.199  13.174   3.148
 1069    H    VAL 153           H        VAL 153  -3.419   6.037  -1.695
 1070    HA   VAL 153           HA       VAL 153  -3.135   5.611   1.190
 1071    HB   VAL 153           HB       VAL 153  -4.287   3.389   0.707
 1072   1HG1  VAL 153          1HG1      VAL 153  -5.374   5.233   1.883
 1073   2HG1  VAL 153          2HG1      VAL 153  -6.517   4.366   0.856
 1074   3HG1  VAL 153          3HG1      VAL 153  -5.870   5.924   0.336
 1075   1HG2  VAL 153          1HG2      VAL 153  -4.084   3.387  -1.716
 1076   2HG2  VAL 153          2HG2      VAL 153  -5.081   4.837  -1.809
 1077   3HG2  VAL 153          3HG2      VAL 153  -5.778   3.325  -1.231
 1078    H    THR 154           H        THR 154  -0.930   5.412   1.241
 1079    HA   THR 154           HA       THR 154   0.423   3.410  -0.327
 1080    HB   THR 154           HB       THR 154   2.334   3.973   1.173
 1081    HG1  THR 154           1HG      THR 154   0.929   4.497   3.006
 1082   1HG2  THR 154          1HG2      THR 154   0.867   6.360   0.033
 1083   2HG2  THR 154          2HG2      THR 154   1.930   5.278  -0.868
 1084   3HG2  THR 154          3HG2      THR 154   2.588   6.294   0.416
 1085    H    TYR 155           H        TYR 155   0.411   1.193   0.169
 1086    HA   TYR 155           HA       TYR 155   0.212   0.571   3.035
 1087   1HB   TYR 155          2HB       TYR 155  -1.411  -1.217   2.626
 1088   2HB   TYR 155          1HB       TYR 155  -2.045   0.364   2.194
 1089    HD1  TYR 155           1HD      TYR 155  -1.322  -2.974   1.050
 1090    HD2  TYR 155           2HD      TYR 155  -2.169   0.993  -0.243
 1091    HE1  TYR 155           1HE      TYR 155  -1.917  -3.833  -1.177
 1092    HE2  TYR 155           2HE      TYR 155  -2.768   0.151  -2.472
 1093    HH   TYR 155           HH       TYR 155  -3.166  -3.221  -3.102
 1094    H    PHE 156           H        PHE 156   1.118  -1.307   3.749
 1095    HA   PHE 156           HA       PHE 156   3.087  -2.531   1.977
 1096   1HB   PHE 156          2HB       PHE 156   2.607  -2.755   4.957
 1097   2HB   PHE 156          1HB       PHE 156   3.842  -3.667   4.098
 1098    HD1  PHE 156           1HD      PHE 156   5.901  -2.681   3.504
 1099    HD2  PHE 156           2HD      PHE 156   2.766  -0.283   5.087
 1100    HE1  PHE 156           1HE      PHE 156   7.479  -0.815   3.789
 1101    HE2  PHE 156           2HE      PHE 156   4.334   1.586   5.373
 1102    HZ   PHE 156           HZ       PHE 156   6.694   1.323   4.723
 1103    H    MET 157           H        MET 157   3.060  -4.683   1.407
 1104    HA   MET 157           HA       MET 157   0.772  -6.269   2.292
 1105   1HB   MET 157          2HB       MET 157   0.226  -5.083   0.135
 1106   2HB   MET 157          1HB       MET 157   1.524  -5.996  -0.624
 1107   1HG   MET 157          2HG       MET 157   0.367  -8.081  -0.076
 1108   2HG   MET 157          1HG       MET 157  -0.928  -7.153   0.678
 1109   1HE   MET 157          1HE       MET 157  -2.769  -8.377  -0.812
 1110   2HE   MET 157          2HE       MET 157  -1.467  -9.355  -1.491
 1111   3HE   MET 157          3HE       MET 157  -2.620  -8.560  -2.562
 1112    H    LYS 158           H        LYS 158   1.169  -8.379   2.506
 1113    HA   LYS 158           HA       LYS 158   3.755  -9.277   2.935
 1114   1HB   LYS 158          2HB       LYS 158   1.701 -10.219   3.928
 1115   2HB   LYS 158          1HB       LYS 158   1.288 -10.928   2.379
 1116   1HG   LYS 158          2HG       LYS 158   3.418 -12.225   2.499
 1117   2HG   LYS 158          1HG       LYS 158   3.618 -11.613   4.143
 1118   1HD   LYS 158          2HD       LYS 158   1.353 -13.311   3.105
 1119   2HD   LYS 158          1HD       LYS 158   2.618 -13.805   4.232
 1120   1HE   LYS 158          2HE       LYS 158   1.809 -12.143   5.847
 1121   2HE   LYS 158          1HE       LYS 158   0.524 -11.694   4.727
 1122   1HZ   LYS 158          1HZ       LYS 158   0.899 -14.375   5.941
 1123   2HZ   LYS 158          2HZ       LYS 158  -0.352 -13.936   4.885
 1124   3HZ   LYS 158          3HZ       LYS 158  -0.251 -13.227   6.424